#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ynj s GLU 2 N 0.00 4.37 -0.12 0.03 -1.05 -1.26 -4.81 118.70 115.85 1ynj s GLU 2 Ca 0.00 1.66 -0.03 0.00 -0.15 0.00 0.00 54.97 56.45 1ynj s GLU 2 Cb 0.00 -2.84 -0.03 0.00 -0.44 0.00 0.00 34.13 30.82 1ynj s GLU 2 CO 0.00 0.01 -0.00 0.42 0.95 0.00 0.00 175.26 176.63 1ynj s ILE 3 N -1.42 4.23 -0.24 1.83 1.09 -1.26 -3.36 121.20 122.08 1ynj s ILE 3 Ca 0.52 -0.26 -0.10 0.00 -1.10 0.00 0.00 60.65 59.71 1ynj s ILE 3 Cb -0.27 -2.82 -0.05 0.00 -1.06 0.00 0.00 42.46 38.26 1ynj s ILE 3 CO 0.34 0.55 0.14 -0.75 -0.10 0.00 0.00 174.94 175.12 1ynj s LYS 4 N -0.30 4.02 0.01 2.79 2.20 -1.17 -5.01 119.74 122.29 1ynj s LYS 4 Ca 0.06 -0.30 -0.16 0.00 -0.36 0.00 0.00 55.97 55.21 1ynj s LYS 4 Cb -0.12 -3.49 -0.06 0.00 -1.51 0.00 0.00 37.83 32.64 1ynj s LYS 4 CO 0.02 0.05 0.45 0.50 -0.36 0.00 0.00 175.35 176.01 1ynj s ARG 5 N 1.07 3.99 0.16 4.03 3.52 -1.26 -2.02 118.95 128.43 1ynj s ARG 5 Ca 0.07 0.49 0.09 0.00 -0.13 0.00 0.00 55.73 56.24 1ynj s ARG 5 Cb -0.14 -3.23 -0.04 0.00 -1.56 0.00 0.00 34.95 29.98 1ynj s ARG 5 CO 0.04 0.67 -0.13 -0.06 -0.81 0.00 0.00 175.30 175.01 1ynj s PHE 6 N -1.05 2.58 0.25 5.12 0.40 -0.65 -4.98 117.98 119.64 1ynj s PHE 6 Ca 0.25 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.34 1ynj s PHE 6 Cb -0.17 -1.30 0.00 0.00 0.51 0.00 0.00 43.02 42.06 1ynj s PHE 6 CO 0.15 0.47 0.00 0.41 0.70 0.00 0.00 175.22 176.95 1ynj n GLY 7 N 0.32 -3.00 0.00 4.36 0.00 -1.21 -4.59 105.19 101.08 1ynj n GLY 7 Ca -0.12 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1ynj n GLY 7 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ynj n ARG 8 N -2.75 0.00 -1.81 1.61 3.00 -1.26 -4.96 116.66 110.49 1ynj n ARG 8 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.82 1ynj n ARG 8 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.72 1ynj n ARG 8 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 1ynj n ILE 9 N 0.00 -0.92 -2.31 5.15 -5.35 -1.26 -4.79 119.36 109.87 1ynj n ILE 9 Ca 0.00 0.20 -0.43 0.00 -0.27 0.00 0.00 62.75 62.25 1ynj n ILE 9 Cb 0.00 -1.48 -0.02 0.00 -1.74 0.00 0.00 39.64 36.40 1ynj n ILE 9 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1ynj s ARG 10 N -0.41 3.56 -0.60 6.28 6.06 -1.26 -4.89 118.95 127.69 1ynj s ARG 10 Ca 0.00 1.00 -0.29 0.00 -2.50 0.00 0.00 55.73 53.94 1ynj s ARG 10 Cb 0.00 -4.04 -0.12 0.00 0.06 0.00 0.00 34.95 30.85 1ynj s ARG 10 CO 0.00 -1.59 2.46 0.39 -2.50 0.00 0.00 175.30 174.06 1ynj n GLU 11 N 8.10 0.78 -0.13 5.12 -0.58 -1.26 -4.82 120.64 127.85 1ynj n GLU 11 Ca 0.17 0.06 -0.11 0.00 -0.42 0.00 0.00 57.16 56.86 1ynj n GLU 11 Cb 0.48 -2.72 -0.02 0.00 -0.57 0.00 0.00 31.44 28.61 1ynj n GLU 11 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1ynj h VAL 12 N 7.67 1.27 -3.33 2.62 2.07 -1.90 -3.40 116.25 121.25 1ynj h VAL 12 Ca -0.20 -1.13 -0.67 0.00 0.82 0.00 0.00 66.70 65.52 1ynj h VAL 12 Cb 1.29 1.22 -0.30 0.00 -1.52 0.00 0.00 31.29 31.98 1ynj h VAL 12 CO 1.20 0.38 -0.82 -0.63 0.02 0.00 0.00 177.57 177.71 1ynj s ILE 13 N -4.84 2.57 0.76 4.57 -1.09 -1.26 -5.12 121.20 116.78 1ynj s ILE 13 Ca -0.13 -0.83 -0.14 0.00 -2.23 0.00 0.00 60.65 57.32 1ynj s ILE 13 Cb 0.10 -2.04 0.05 0.00 -1.58 0.00 0.00 42.46 38.99 1ynj s ILE 13 CO 0.81 0.54 1.18 -2.84 -1.23 0.00 0.00 174.94 173.39 1ynj s PRO 14 N 0.36 2.04 0.33 2.79 0.02 -1.26 -4.99 135.00 134.28 1ynj s PRO 14 Ca -0.15 1.64 -0.29 0.00 0.02 0.00 0.00 61.00 62.23 1ynj s PRO 14 Cb -0.17 -1.83 -0.12 0.00 0.02 0.00 0.00 34.50 32.40 1ynj s PRO 14 CO 0.07 -1.89 1.42 1.28 -0.33 0.00 0.00 177.00 177.55 1ynj n LEU 15 N -2.99 3.99 -4.73 -5.54 4.32 -1.26 -4.97 117.00 105.81 1ynj n LEU 15 Ca 0.12 1.19 -0.29 0.00 -0.02 0.00 0.00 56.01 57.01 1ynj n LEU 15 Cb 0.51 -1.54 0.14 0.00 -1.62 0.00 0.00 43.42 40.91 1ynj n LEU 15 CO 0.48 -0.18 0.67 -2.84 -1.22 0.00 0.00 177.39 174.30 1ynj s PRO 16 N -1.48 1.18 0.00 3.23 0.02 -1.26 -4.77 135.00 131.92 1ynj s PRO 16 Ca 0.58 0.64 0.00 0.00 0.02 0.00 0.00 61.00 62.24 1ynj s PRO 16 Cb -0.54 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.17 1ynj s PRO 16 CO 0.58 -2.25 0.13 -2.30 -0.33 0.00 0.00 177.00 172.83 1ynj n PRO 17 N -3.86 0.00 0.00 5.54 -0.02 -1.26 -4.81 135.00 130.59 1ynj n PRO 17 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1ynj n PRO 17 Cb 0.56 -1.35 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 1ynj n PRO 17 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1ynj n LEU 18 N -0.53 0.00 -0.02 2.45 4.77 -1.26 -3.69 117.00 118.72 1ynj n LEU 18 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1ynj n LEU 18 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1ynj n LEU 18 CO 0.00 0.00 0.15 0.35 -1.33 0.00 0.00 177.39 176.56 1ynj n THR 19 N 0.00 0.00 -0.35 -5.08 -2.24 -1.26 -3.78 114.28 101.57 1ynj n THR 19 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 1ynj n THR 19 Cb 0.00 -0.34 0.08 0.00 -2.10 0.00 0.00 70.33 67.97 1ynj n THR 19 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1ynj h GLU 20 N 0.02 -0.01 -0.88 -0.78 4.81 -1.92 -0.64 114.58 115.18 1ynj h GLU 20 Ca 0.00 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 1ynj h GLU 20 Cb 0.00 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 29.28 1ynj h GLU 20 CO 0.00 -0.01 -0.54 0.82 -0.73 0.00 0.00 179.01 178.55 1ynj h ILE 21 N -0.01 0.00 0.63 2.32 5.03 -1.94 -1.95 117.51 121.59 1ynj h ILE 21 Ca 0.40 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 65.11 1ynj h ILE 21 Cb 0.65 0.00 0.01 0.00 -3.03 0.00 0.00 36.82 34.44 1ynj h ILE 21 CO -0.97 0.00 -0.30 -0.61 -0.68 0.00 0.00 178.15 175.59 1ynj h GLN 22 N -0.03 -0.82 -0.36 2.37 5.75 -1.61 -3.11 115.11 117.30 1ynj h GLN 22 Ca 0.14 0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.66 1ynj h GLN 22 Cb 0.39 0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.11 1ynj h GLN 22 CO -0.84 -0.54 0.09 0.28 -2.65 0.00 0.00 178.83 175.17 1ynj h VAL 23 N -1.19 1.22 0.00 2.39 2.07 -0.94 -2.48 116.25 117.33 1ynj h VAL 23 Ca -0.09 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1ynj h VAL 23 Cb 0.65 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1ynj h VAL 23 CO 0.14 0.26 0.00 -0.33 0.02 0.00 0.00 177.57 177.66 1ynj h GLU 24 N 0.44 0.00 0.46 1.57 4.39 -1.54 -3.19 114.58 116.70 1ynj h GLU 24 Ca 0.11 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.79 1ynj h GLU 24 Cb 0.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1ynj h GLU 24 CO 0.00 0.00 -0.22 1.03 -1.16 0.00 0.00 179.01 178.66 1ynj h SER 25 N 0.00 -0.52 -0.44 1.42 0.87 -1.37 -3.17 113.55 110.35 1ynj h SER 25 Ca 0.00 0.02 0.05 0.00 -1.23 0.00 0.00 61.79 60.63 1ynj h SER 25 Cb 0.81 0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 62.83 1ynj h SER 25 CO 0.00 -0.29 -0.48 0.22 -0.53 0.00 0.00 176.83 175.76 1ynj h TYR 26 N -0.79 -1.47 -0.55 2.24 3.20 -1.61 -0.77 116.97 117.22 1ynj h TYR 26 Ca -0.06 0.08 0.08 0.00 3.14 0.00 0.00 58.73 61.96 1ynj h TYR 26 Cb 0.47 0.70 -0.08 0.00 1.54 0.00 0.00 36.73 39.36 1ynj h TYR 26 CO 0.06 -0.40 -0.24 1.17 -1.64 0.00 0.00 178.16 177.12 1ynj n LYS 27 N -4.94 -0.15 -1.63 1.82 4.81 -1.21 -0.33 118.16 116.53 1ynj n LYS 27 Ca -0.02 0.85 -0.36 0.00 -0.87 0.00 0.00 58.31 57.90 1ynj n LYS 27 Cb 0.27 -1.26 -0.03 0.00 0.02 0.00 0.00 35.03 34.04 1ynj n LYS 27 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1ynj n LYS 28 N -4.79 3.90 0.00 1.64 0.00 -0.30 -1.72 118.16 116.89 1ynj n LYS 28 Ca 0.05 -2.73 0.00 0.00 -0.00 0.00 0.00 58.31 55.63 1ynj n LYS 28 Cb 0.21 -2.61 0.00 0.00 -0.00 0.00 0.00 35.03 32.63 1ynj n LYS 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ynj n ALA 29 N 2.38 0.00 -2.89 0.58 0.00 0.55 -4.46 120.51 116.68 1ynj n ALA 29 Ca 0.66 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.97 1ynj n ALA 29 Cb 0.31 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.79 1ynj n ALA 29 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ynj n LEU 30 N 0.00 -1.76 -2.75 0.00 4.32 -0.70 -1.93 117.00 114.18 1ynj n LEU 30 Ca 0.00 -3.86 -0.18 0.00 -0.02 0.00 0.00 56.01 51.95 1ynj n LEU 30 Cb 0.13 0.80 -0.06 0.00 -1.62 0.00 0.00 43.42 42.67 1ynj n LEU 30 CO 0.00 2.06 2.02 0.00 -1.22 0.00 0.00 177.39 180.25 1ynj n GLN 31 N 1.22 1.99 0.27 3.23 3.00 -1.23 -4.50 117.38 121.37 1ynj n GLN 31 Ca 0.13 -1.21 0.15 0.00 -0.01 0.00 0.00 57.00 56.06 1ynj n GLN 31 Cb 0.62 -2.23 0.75 0.00 0.00 0.00 0.00 30.24 29.39 1ynj n GLN 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ynj h ALA 32 N 5.10 1.10 -0.96 -1.58 0.00 -1.96 -2.10 119.26 118.86 1ynj h ALA 32 Ca 0.39 -0.07 -0.63 0.00 0.00 0.00 0.00 54.91 54.60 1ynj h ALA 32 Cb 0.56 -0.01 -0.36 0.00 0.00 0.00 0.00 17.79 17.97 1ynj h ALA 32 CO 1.00 0.10 0.00 -0.25 0.00 0.00 0.00 179.25 180.10 1ynj n ASP 33 N -3.32 6.19 -3.70 0.00 9.92 -1.26 -4.94 116.55 119.44 1ynj n ASP 33 Ca -0.01 -3.77 -0.10 0.00 -0.53 0.00 0.00 54.79 50.38 1ynj n ASP 33 Cb 0.27 -0.66 -0.11 0.00 -0.64 0.00 0.00 41.12 39.98 1ynj n ASP 33 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1ynj s VAL 34 N -4.85 -0.02 0.31 2.53 1.01 -0.79 -5.15 120.40 113.44 1ynj s VAL 34 Ca 0.56 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.33 1ynj s VAL 34 Cb 0.45 -0.62 -0.12 0.00 0.00 0.00 0.00 36.38 36.09 1ynj s VAL 34 CO -0.05 0.04 1.58 -2.65 0.00 0.00 0.00 175.10 174.01 1ynj n PRO 35 N 4.20 2.70 0.00 2.72 -0.02 -1.26 -4.82 135.00 138.52 1ynj n PRO 35 Ca -0.23 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1ynj n PRO 35 Cb 0.55 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 1ynj n PRO 35 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ynj n PRO 36 N 1.86 0.14 -0.09 0.52 -0.02 -1.26 -1.52 135.00 134.64 1ynj n PRO 36 Ca 0.07 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.33 1ynj n PRO 36 Cb 0.37 -1.02 -0.12 0.00 -0.02 0.00 0.00 33.50 32.71 1ynj n PRO 36 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ynj n GLU 37 N -0.26 0.60 0.00 -0.52 4.71 -1.26 -4.82 120.64 119.09 1ynj n GLU 37 Ca 0.00 0.52 0.00 0.00 -0.01 0.00 0.00 57.16 57.67 1ynj n GLU 37 Cb 0.01 -1.74 0.00 0.00 -1.01 0.00 0.00 31.44 28.70 1ynj n GLU 37 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1ynj n LYS 38 N -4.26 0.00 -3.99 3.49 5.02 -0.57 -4.87 118.16 112.97 1ynj n LYS 38 Ca -0.32 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.54 1ynj n LYS 38 Cb 0.75 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.78 1ynj n LYS 38 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1ynj n ARG 39 N 0.00 -0.48 -2.09 1.97 1.74 -1.26 -4.72 116.66 111.82 1ynj n ARG 39 Ca 0.00 0.18 -0.28 0.00 -0.77 0.00 0.00 57.85 56.98 1ynj n ARG 39 Cb 0.00 -2.82 -0.05 0.00 -1.02 0.00 0.00 32.46 28.57 1ynj n ARG 39 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1ynj s GLU 40 N -7.04 2.64 0.78 5.56 8.01 -1.26 -4.88 118.70 122.50 1ynj s GLU 40 Ca 0.47 -0.37 0.00 0.00 0.01 0.00 0.00 54.97 55.08 1ynj s GLU 40 Cb -0.24 -5.09 0.00 0.00 -4.31 0.00 0.00 34.13 24.49 1ynj s GLU 40 CO 0.95 -3.29 0.00 0.09 0.01 0.00 0.00 175.26 173.01 1ynj n ASN 41 N 13.57 -0.40 -0.69 -0.19 3.02 -1.26 -5.01 115.26 124.30 1ynj n ASN 41 Ca 0.40 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 55.04 1ynj n ASN 41 Cb 0.47 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.62 1ynj n ASN 41 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1ynj n VAL 42 N 0.00 0.00 -3.46 2.41 0.31 -1.26 -4.30 118.33 112.03 1ynj n VAL 42 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1ynj n VAL 42 Cb 0.00 -0.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 1ynj n VAL 42 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ynj n GLY 43 N -2.22 1.19 0.28 2.92 0.00 -1.26 0.20 105.19 106.30 1ynj n GLY 43 Ca 0.00 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.39 1ynj n GLY 43 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ynj h ILE 44 N 0.00 1.26 -0.44 -0.61 2.04 -1.73 -2.22 117.51 115.81 1ynj h ILE 44 Ca 0.00 -1.21 0.09 0.00 1.00 0.00 0.00 64.86 64.74 1ynj h ILE 44 Cb 0.00 1.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.99 1ynj h ILE 44 CO 0.00 0.42 -0.15 -0.61 0.00 0.00 0.00 178.15 177.81 1ynj h GLN 45 N 0.80 -0.05 -0.12 2.37 -0.00 -1.73 -1.68 115.11 114.69 1ynj h GLN 45 Ca 0.13 0.00 -0.20 0.00 -0.00 0.00 0.00 58.65 58.58 1ynj h GLN 45 Cb 0.62 0.01 0.00 0.00 0.00 0.00 0.00 27.48 28.12 1ynj h GLN 45 CO 0.04 -0.04 -0.74 0.00 0.00 0.00 0.00 178.83 178.10 1ynj h ALA 46 N 1.33 0.48 0.00 3.38 0.00 -0.23 -3.15 119.26 121.07 1ynj h ALA 46 Ca 0.21 -0.60 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1ynj h ALA 46 Cb 0.38 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ynj h ALA 46 CO -0.48 0.73 -0.01 0.00 0.00 0.00 0.00 179.25 179.49 1ynj h ALA 47 N 0.78 1.62 0.35 0.00 0.00 -0.68 0.73 119.26 122.06 1ynj h ALA 47 Ca -0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ynj h ALA 47 Cb 1.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1ynj h ALA 47 CO 0.14 0.01 -0.17 0.74 0.00 0.00 0.00 179.25 179.97 1ynj h PHE 48 N 0.00 -0.44 -1.14 0.00 0.05 -1.45 -3.30 116.94 110.66 1ynj h PHE 48 Ca -0.00 -0.01 0.35 0.00 3.82 0.00 0.00 57.97 62.13 1ynj h PHE 48 Cb 0.02 0.15 -0.12 0.00 2.00 0.00 0.00 35.95 37.99 1ynj h PHE 48 CO 0.00 -0.27 0.71 0.87 -0.18 0.00 0.00 178.31 179.44 1ynj h LYS 49 N -1.07 0.23 0.00 1.51 1.79 -1.13 0.57 116.57 118.48 1ynj h LYS 49 Ca -0.05 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 1ynj h LYS 49 Cb 0.36 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1ynj h LYS 49 CO 0.08 0.16 0.00 -1.91 -1.08 0.00 0.00 179.45 176.69 1ynj n GLU 50 N -4.78 0.08 0.00 3.15 2.13 0.24 -3.65 120.64 117.80 1ynj n GLU 50 Ca 0.32 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.54 1ynj n GLU 50 Cb 1.14 -1.67 0.00 0.00 0.27 0.00 0.00 31.44 31.18 1ynj n GLU 50 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1ynj n THR 51 N -1.82 0.00 0.04 6.31 -2.24 0.19 -4.81 114.28 111.95 1ynj n THR 51 Ca 0.02 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.89 1ynj n THR 51 Cb 0.14 0.14 0.19 0.00 -2.10 0.00 0.00 70.33 68.70 1ynj n THR 51 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1ynj n PHE 52 N -0.99 0.50 -2.49 4.78 0.99 -0.30 -4.11 117.46 115.85 1ynj n PHE 52 Ca 0.00 -0.34 -0.43 0.00 -0.00 0.00 0.00 57.45 56.68 1ynj n PHE 52 Cb 0.05 -0.01 0.00 0.00 -1.00 0.00 0.00 39.48 38.53 1ynj n PHE 52 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 1ynj n PRO 53 N 1.07 3.40 -3.19 -1.08 -0.02 -1.26 -2.53 135.00 131.40 1ynj n PRO 53 Ca 0.16 -3.49 -0.41 0.00 -2.02 0.00 0.00 63.50 57.74 1ynj n PRO 53 Cb 0.50 -3.07 -0.07 0.00 -0.02 0.00 0.00 33.50 30.84 1ynj n PRO 53 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1ynj s ILE 54 N 1.53 4.99 0.84 4.25 2.07 -1.23 -5.07 121.20 128.58 1ynj s ILE 54 Ca 0.43 0.70 -0.14 0.00 -1.41 0.00 0.00 60.65 60.23 1ynj s ILE 54 Cb 0.05 -3.94 0.19 0.00 0.13 0.00 0.00 42.46 38.89 1ynj s ILE 54 CO 0.00 -0.11 1.14 -0.62 -1.91 0.00 0.00 174.94 173.45 1ynj n GLU 55 N 5.76 -1.08 -4.53 3.50 1.02 -1.26 -4.30 120.64 119.75 1ynj n GLU 55 Ca -0.03 -1.82 -0.25 0.00 -0.02 0.00 0.00 57.16 55.04 1ynj n GLU 55 Cb 0.49 -1.16 -0.09 0.00 -0.02 0.00 0.00 31.44 30.66 1ynj n GLU 55 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1ynj s GLU 56 N -5.49 1.85 0.17 3.49 4.04 -1.26 -4.79 118.70 116.70 1ynj s GLU 56 Ca 0.65 -2.09 -0.30 0.00 0.04 0.00 0.00 54.97 53.27 1ynj s GLU 56 Cb -0.02 -0.95 -0.17 0.00 0.02 0.00 0.00 34.13 33.00 1ynj s GLU 56 CO 0.46 -0.29 0.64 0.41 -1.84 0.00 0.00 175.26 174.64 1ynj n GLY 57 N -0.87 -1.41 0.00 -3.83 0.00 -1.26 -4.73 105.19 93.09 1ynj n GLY 57 Ca -0.06 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.37 1ynj n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ynj n ASP 58 N 1.89 0.00 -4.00 1.61 8.00 -1.26 -4.54 116.55 118.25 1ynj n ASP 58 Ca 0.18 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.29 1ynj n ASP 58 Cb 0.22 0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.43 1ynj n ASP 58 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1ynj n LYS 59 N -1.60 3.45 -0.73 -1.24 2.85 -1.26 -4.71 118.16 114.91 1ynj n LYS 59 Ca 0.00 -4.54 0.00 0.00 -1.05 0.00 0.00 58.31 52.72 1ynj n LYS 59 Cb 0.00 -2.45 0.00 0.00 -0.65 0.00 0.00 35.03 31.93 1ynj n LYS 59 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ynj n GLY 60 N 1.78 0.99 1.46 2.58 0.00 -1.26 -5.03 105.19 105.71 1ynj n GLY 60 Ca 0.25 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1ynj n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ynj n LYS 61 N -0.15 0.00 -2.77 1.61 4.76 -1.26 -5.07 118.16 115.28 1ynj n LYS 61 Ca 0.00 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.04 1ynj n LYS 61 Cb 0.15 -0.28 -0.06 0.00 -1.84 0.00 0.00 35.03 32.99 1ynj n LYS 61 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1ynj s GLY 62 N -4.63 3.08 0.00 0.72 0.00 -1.26 -5.04 107.32 100.18 1ynj s GLY 62 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 44.72 45.32 1ynj s GLY 62 CO 0.00 1.15 0.00 0.61 0.00 0.00 0.00 173.10 174.86 1ynj n GLY 63 N 1.41 -0.47 2.05 0.20 0.00 -1.26 -4.87 105.19 102.25 1ynj n GLY 63 Ca -0.02 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1ynj n GLY 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ynj n LEU 64 N 0.00 -5.72 0.01 0.99 4.77 -1.13 -4.63 117.00 111.28 1ynj n LEU 64 Ca 0.00 3.20 0.00 0.00 -0.03 0.00 0.00 56.01 59.18 1ynj n LEU 64 Cb 0.00 -3.10 0.00 0.00 -2.33 0.00 0.00 43.42 37.99 1ynj n LEU 64 CO 0.00 -1.54 0.00 0.52 -1.33 0.00 0.00 177.39 175.04 1ynj n VAL 65 N 1.73 0.15 -1.60 4.08 0.31 -1.12 -4.13 118.33 117.75 1ynj n VAL 65 Ca 0.00 0.05 -0.01 0.00 -0.01 0.00 0.00 64.34 64.37 1ynj n VAL 65 Cb 0.00 -0.93 -0.00 0.00 -0.91 0.00 0.00 33.84 32.00 1ynj n VAL 65 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1ynj n LEU 66 N -2.64 -2.38 -4.24 7.52 7.94 -1.16 -4.25 117.00 117.79 1ynj n LEU 66 Ca 0.00 0.21 -0.31 0.00 -1.11 0.00 0.00 56.01 54.80 1ynj n LEU 66 Cb 0.00 -1.21 -0.16 0.00 0.53 0.00 0.00 43.42 42.58 1ynj n LEU 66 CO 0.00 -0.36 -0.55 -0.62 -1.11 0.00 0.00 177.39 174.74 1ynj s ASP 67 N -0.07 2.91 0.24 1.96 3.68 0.60 -3.53 116.67 122.46 1ynj s ASP 67 Ca -0.03 -0.49 -0.30 0.00 2.13 0.00 0.00 52.55 53.87 1ynj s ASP 67 Cb 0.00 -0.87 -0.09 0.00 -1.45 0.00 0.00 42.92 40.51 1ynj s ASP 67 CO 0.07 0.22 1.33 0.12 0.13 0.00 0.00 175.17 177.04 1ynj s PHE 68 N -0.06 3.18 -0.05 -5.34 5.36 -1.05 -0.33 117.98 119.70 1ynj s PHE 68 Ca -0.06 1.24 -0.04 0.00 -0.96 0.00 0.00 56.93 57.12 1ynj s PHE 68 Cb -0.14 -3.65 -0.03 0.00 -0.34 0.00 0.00 43.02 38.87 1ynj s PHE 68 CO 0.04 -1.98 -0.09 1.28 -1.46 0.00 0.00 175.22 173.02 1ynj n LEU 69 N 2.14 0.65 -3.55 6.12 4.77 -0.61 -4.94 117.00 121.59 1ynj n LEU 69 Ca 0.05 0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.98 1ynj n LEU 69 Cb 0.42 -0.25 -0.06 0.00 -2.33 0.00 0.00 43.42 41.20 1ynj n LEU 69 CO 0.58 -0.01 0.54 -1.83 -1.33 0.00 0.00 177.39 175.35 1ynj s GLU 70 N -2.15 0.89 0.28 3.23 -1.05 -1.19 -5.02 118.70 113.69 1ynj s GLU 70 Ca -0.09 0.33 0.06 0.00 -0.15 0.00 0.00 54.97 55.12 1ynj s GLU 70 Cb 0.03 0.42 -0.03 0.00 -0.44 0.00 0.00 34.13 34.12 1ynj s GLU 70 CO 0.12 -0.25 0.34 1.52 0.95 0.00 0.00 175.26 177.94 1ynj s TYR 71 N -0.92 3.22 -0.05 4.83 -0.85 -1.26 -0.19 117.35 122.13 1ynj s TYR 71 Ca -0.07 -0.13 -0.01 0.00 -0.52 0.00 0.00 57.07 56.35 1ynj s TYR 71 Cb -0.01 -1.67 0.03 0.00 0.38 0.00 0.00 41.96 40.69 1ynj s TYR 71 CO 0.06 0.31 0.02 0.50 -1.52 0.00 0.00 175.55 174.92 1ynj s ARG 72 N -4.00 0.31 0.01 -3.49 3.52 0.08 -4.92 118.95 110.46 1ynj s ARG 72 Ca 0.37 0.19 -0.29 0.00 -0.13 0.00 0.00 55.73 55.87 1ynj s ARG 72 Cb -0.08 -0.70 -0.04 0.00 -1.56 0.00 0.00 34.95 32.57 1ynj s ARG 72 CO 0.28 -0.27 0.94 0.42 -0.81 0.00 0.00 175.30 175.86 1ynj s ILE 73 N 1.81 4.83 0.00 4.11 1.01 -1.26 -1.03 121.20 130.66 1ynj s ILE 73 Ca 0.01 1.98 0.00 0.00 0.00 0.00 0.00 60.65 62.64 1ynj s ILE 73 Cb -0.12 -4.28 0.00 0.00 0.01 0.00 0.00 42.46 38.06 1ynj s ILE 73 CO -0.04 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.72 1ynj n GLY 74 N 2.80 -1.42 2.98 6.18 0.00 0.32 -4.97 105.19 111.08 1ynj n GLY 74 Ca 0.04 -1.40 -0.16 0.00 0.00 0.00 0.00 46.02 44.50 1ynj n GLY 74 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ynj s ASP 75 N -1.39 0.72 -0.11 1.61 3.68 -1.26 -4.79 116.67 115.12 1ynj s ASP 75 Ca 0.00 -0.16 -0.29 0.00 2.13 0.00 0.00 52.55 54.23 1ynj s ASP 75 Cb 0.00 -0.06 -0.06 0.00 -1.45 0.00 0.00 42.92 41.34 1ynj s ASP 75 CO 0.00 0.04 2.02 -2.84 0.13 0.00 0.00 175.17 174.53 1ynj s PRO 76 N -0.30 3.66 0.26 4.34 0.02 -1.26 -4.61 135.00 137.11 1ynj s PRO 76 Ca 0.01 2.22 0.25 0.00 0.02 0.00 0.00 61.00 63.50 1ynj s PRO 76 Cb -0.03 -4.23 0.94 0.00 0.02 0.00 0.00 34.50 31.19 1ynj s PRO 76 CO -0.00 -1.50 1.74 -2.30 -0.33 0.00 0.00 177.00 174.61 1ynj n PRO 77 N 8.08 0.23 -3.83 5.54 -0.02 -1.26 -4.70 135.00 139.03 1ynj n PRO 77 Ca 0.24 0.37 -0.13 0.00 -2.02 0.00 0.00 63.50 61.96 1ynj n PRO 77 Cb 0.43 -1.87 -0.15 0.00 -0.02 0.00 0.00 33.50 31.90 1ynj n PRO 77 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1ynj s PHE 78 N -3.27 -0.00 0.48 6.00 0.40 -1.26 -5.13 117.98 115.20 1ynj s PHE 78 Ca 0.06 0.08 -0.24 0.00 -0.60 0.00 0.00 56.93 56.24 1ynj s PHE 78 Cb 0.10 -0.09 -0.07 0.00 0.51 0.00 0.00 43.02 43.48 1ynj s PHE 78 CO 0.46 -0.04 1.30 -1.54 0.70 0.00 0.00 175.22 176.10 1ynj s SER 79 N 0.43 5.84 0.38 1.36 1.04 -1.26 -4.73 113.70 116.76 1ynj s SER 79 Ca -0.04 2.63 0.20 0.00 0.48 0.00 0.00 55.95 59.22 1ynj s SER 79 Cb -0.05 -2.63 0.69 0.00 0.10 0.00 0.00 66.02 64.13 1ynj s SER 79 CO -0.01 -1.17 0.87 0.00 0.98 0.00 0.00 173.24 173.91 1ynj n GLN 80 N -0.50 0.01 -0.12 4.02 6.02 -1.26 -0.79 117.38 124.77 1ynj n GLN 80 Ca 0.07 0.66 -0.23 0.00 -0.01 0.00 0.00 57.00 57.50 1ynj n GLN 80 Cb 0.45 -1.63 -0.11 0.00 1.02 0.00 0.00 30.24 29.97 1ynj n GLN 80 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1ynj n ASP 81 N -2.68 1.98 -0.26 1.08 9.92 -1.26 -3.75 116.55 121.57 1ynj n ASP 81 Ca 0.18 0.09 0.04 0.00 -0.53 0.00 0.00 54.79 54.56 1ynj n ASP 81 Cb 1.05 -0.62 0.13 0.00 -0.64 0.00 0.00 41.12 41.03 1ynj n ASP 81 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1ynj h GLU 82 N -0.41 0.04 -0.17 -1.24 5.08 -1.30 0.29 114.58 116.86 1ynj h GLU 82 Ca -0.60 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.79 1ynj h GLU 82 Cb 1.78 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.96 1ynj h GLU 82 CO -0.21 0.02 -0.52 0.00 -1.00 0.00 0.00 179.01 177.31 1ynj h ARG 84 N -0.52 0.00 0.00 0.00 3.08 -1.07 0.11 114.38 115.98 1ynj h ARG 84 Ca 0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1ynj h ARG 84 Cb 0.63 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 1ynj h ARG 84 CO -0.44 0.02 -0.24 0.93 -1.07 0.00 0.00 179.97 179.16 1ynj h GLU 85 N 0.00 0.00 0.00 0.04 5.08 0.16 -3.37 114.58 116.49 1ynj h GLU 85 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ynj h GLU 85 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ynj h GLU 85 CO 0.00 0.30 0.00 1.63 -1.00 0.00 0.00 179.01 179.95 1ynj n LYS 86 N -4.67 0.10 -1.50 2.33 5.02 0.47 -4.86 118.16 115.05 1ynj n LYS 86 Ca -0.07 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1ynj n LYS 86 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 1ynj n LYS 86 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ynj n ASP 87 N -1.41 -0.83 -4.87 4.39 9.92 0.19 -4.35 116.55 119.58 1ynj n ASP 87 Ca 0.06 0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 54.11 1ynj n ASP 87 Cb 0.17 -0.36 -0.03 0.00 -0.64 0.00 0.00 41.12 40.26 1ynj n ASP 87 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1ynj s LEU 88 N -0.11 3.53 -0.32 0.64 1.43 -0.10 -3.65 118.68 120.11 1ynj s LEU 88 Ca 0.00 -0.58 -0.13 0.00 -1.03 0.00 0.00 54.13 52.39 1ynj s LEU 88 Cb 0.00 -2.19 -0.03 0.00 0.03 0.00 0.00 46.19 44.01 1ynj s LEU 88 CO 0.00 -0.48 0.27 -0.89 0.23 0.00 0.00 176.35 175.48 1ynj s THR 89 N -2.36 5.25 -0.54 5.49 2.01 -1.26 -2.10 115.64 122.12 1ynj s THR 89 Ca 0.44 0.03 -0.32 0.00 0.31 0.00 0.00 61.69 62.15 1ynj s THR 89 Cb -0.05 -3.70 -0.13 0.00 0.01 0.00 0.00 72.50 68.63 1ynj s THR 89 CO 0.27 0.05 2.37 0.00 -0.69 0.00 0.00 174.62 176.62 1ynj n TYR 90 N 5.19 1.30 -4.41 4.92 9.36 -1.21 -4.88 117.16 127.41 1ynj n TYR 90 Ca -0.12 0.27 -0.20 0.00 3.32 0.00 0.00 57.90 61.18 1ynj n TYR 90 Cb 0.50 -2.52 -0.05 0.00 -0.63 0.00 0.00 39.34 36.64 1ynj n TYR 90 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1ynj n GLN 91 N 8.47 0.80 -3.67 2.98 6.02 -1.26 -1.30 117.38 129.41 1ynj n GLN 91 Ca 0.46 -2.54 -0.10 0.00 -0.01 0.00 0.00 57.00 54.82 1ynj n GLN 91 Cb 0.26 1.17 -0.09 0.00 1.02 0.00 0.00 30.24 32.60 1ynj n GLN 91 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ynj s ALA 92 N -2.75 -1.41 0.50 -1.58 0.00 0.73 -4.11 121.76 113.14 1ynj s ALA 92 Ca 0.11 1.87 -0.22 0.00 0.00 0.00 0.00 51.96 53.72 1ynj s ALA 92 Cb 0.01 -1.11 -0.08 0.00 0.00 0.00 0.00 23.12 21.93 1ynj s ALA 92 CO 0.08 -0.31 0.98 -0.35 0.00 0.00 0.00 175.76 176.16 1ynj n PRO 93 N 4.05 1.17 -5.22 0.00 -0.04 -1.26 0.07 135.00 133.77 1ynj n PRO 93 Ca -0.21 0.43 -0.32 0.00 -0.04 0.00 0.00 63.50 63.37 1ynj n PRO 93 Cb 0.57 -2.10 -0.17 0.00 -0.04 0.00 0.00 33.50 31.76 1ynj n PRO 93 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ynj s LEU 94 N -1.14 2.08 0.00 1.53 2.96 0.12 0.12 118.68 124.35 1ynj s LEU 94 Ca 0.68 -0.54 0.05 0.00 -0.22 0.00 0.00 54.13 54.10 1ynj s LEU 94 Cb -0.49 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 1ynj s LEU 94 CO 0.53 0.18 -0.15 -0.31 -1.32 0.00 0.00 176.35 175.28 1ynj s TYR 95 N 0.23 2.66 -0.17 5.38 1.51 -0.20 -1.83 117.35 124.94 1ynj s TYR 95 Ca -0.15 -0.19 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1ynj s TYR 95 Cb -0.17 -1.55 0.02 0.00 -0.11 0.00 0.00 41.96 40.15 1ynj s TYR 95 CO 0.08 0.25 -0.19 0.00 -1.11 0.00 0.00 175.55 174.57 1ynj s ALA 96 N -0.87 2.25 -1.11 3.71 0.00 0.70 -0.74 121.76 125.70 1ynj s ALA 96 Ca 0.14 -1.16 -0.22 0.00 0.00 0.00 0.00 51.96 50.72 1ynj s ALA 96 Cb -0.11 -1.14 -0.00 0.00 0.00 0.00 0.00 23.12 21.88 1ynj s ALA 96 CO 0.04 -0.31 1.76 1.03 0.00 0.00 0.00 175.76 178.28 1ynj s ARG 97 N 1.25 3.19 0.49 0.00 1.81 0.73 0.02 118.95 126.44 1ynj s ARG 97 Ca 0.03 -1.19 0.03 0.00 -1.72 0.00 0.00 55.73 52.89 1ynj s ARG 97 Cb -0.13 -5.31 0.02 0.00 -0.45 0.00 0.00 34.95 29.07 1ynj s ARG 97 CO -0.11 -2.93 0.69 -0.51 -0.68 0.00 0.00 175.30 171.75 1ynj s LEU 98 N 7.45 3.47 -0.20 2.53 1.43 -1.26 -1.57 118.68 130.52 1ynj s LEU 98 Ca 0.59 -0.08 -0.06 0.00 -1.03 0.00 0.00 54.13 53.56 1ynj s LEU 98 Cb -0.01 -2.86 0.10 0.00 0.03 0.00 0.00 46.19 43.45 1ynj s LEU 98 CO 0.03 -0.94 0.38 -1.58 0.23 0.00 0.00 176.35 174.47 1ynj s GLN 99 N -4.59 0.30 -0.21 1.70 0.74 0.56 -3.40 119.66 114.74 1ynj s GLN 99 Ca 0.54 0.86 -0.07 0.00 0.05 0.00 0.00 55.36 56.75 1ynj s GLN 99 Cb -0.10 0.06 -0.03 0.00 1.10 0.00 0.00 33.01 34.04 1ynj s GLN 99 CO 0.37 -0.35 0.04 -1.17 -0.55 0.00 0.00 175.29 173.63 1ynj s LEU 100 N 2.56 3.50 0.45 3.68 0.20 -0.34 0.22 118.68 128.95 1ynj s LEU 100 Ca 0.02 -0.11 0.07 0.00 0.69 0.00 0.00 54.13 54.80 1ynj s LEU 100 Cb -0.13 -1.90 -0.00 0.00 -0.43 0.00 0.00 46.19 43.72 1ynj s LEU 100 CO -0.13 0.07 0.41 -0.63 -0.29 0.00 0.00 176.35 175.78 1ynj s ILE 101 N 1.00 2.44 0.29 6.68 -1.09 -1.26 -2.58 121.20 126.68 1ynj s ILE 101 Ca 0.03 -1.35 0.05 0.00 -2.23 0.00 0.00 60.65 57.15 1ynj s ILE 101 Cb -0.14 -2.79 -0.02 0.00 -1.58 0.00 0.00 42.46 37.93 1ynj s ILE 101 CO 0.03 0.00 0.17 1.41 -1.23 0.00 0.00 174.94 175.31 1ynj n HIS 102 N -1.63 -0.26 0.05 3.97 8.25 -1.26 -2.81 115.22 121.53 1ynj n HIS 102 Ca 0.03 -2.12 -0.01 0.00 -0.26 0.00 0.00 57.72 55.36 1ynj n HIS 102 Cb 0.62 0.11 -0.07 0.00 1.12 0.00 0.00 29.99 31.78 1ynj n HIS 102 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1ynj h LYS 103 N 0.00 0.00 -0.19 -0.41 3.11 -1.94 -3.26 116.57 113.87 1ynj h LYS 103 Ca -0.22 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.62 1ynj h LYS 103 Cb 0.94 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.17 1ynj h LYS 103 CO 0.33 0.42 0.00 -0.40 -2.81 0.00 0.00 179.45 176.99 1ynj n ASP 104 N -3.02 1.97 -0.57 4.20 5.75 -1.26 -5.06 116.55 118.56 1ynj n ASP 104 Ca -0.07 -1.75 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 1ynj n ASP 104 Cb 0.85 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.82 1ynj n ASP 104 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1ynj n THR 105 N 0.52 -2.55 0.00 2.12 -1.04 -1.23 -5.11 114.28 106.99 1ynj n THR 105 Ca 0.17 0.86 0.00 0.00 -2.04 0.00 0.00 64.05 63.04 1ynj n THR 105 Cb 0.38 -1.19 0.00 0.00 -1.82 0.00 0.00 70.33 67.70 1ynj n THR 105 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ynj n GLY 106 N -0.95 -1.66 3.56 3.41 0.00 -1.26 -4.80 105.19 103.49 1ynj n GLY 106 Ca 0.00 0.85 -0.33 0.00 0.00 0.00 0.00 46.02 46.54 1ynj n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ynj s LEU 107 N 0.00 3.26 -0.49 0.99 1.02 -1.26 -4.36 118.68 117.83 1ynj s LEU 107 Ca 0.00 -0.62 -0.17 0.00 0.02 0.00 0.00 54.13 53.36 1ynj s LEU 107 Cb 0.00 -2.56 0.07 0.00 0.02 0.00 0.00 46.19 43.72 1ynj s LEU 107 CO 0.00 -2.37 0.50 -0.63 0.02 0.00 0.00 176.35 173.88 1ynj s ILE 108 N 8.58 5.07 -0.79 -0.59 1.01 -1.06 -4.97 121.20 128.44 1ynj s ILE 108 Ca 0.62 -0.81 -0.16 0.00 0.00 0.00 0.00 60.65 60.30 1ynj s ILE 108 Cb -0.07 -4.21 0.18 0.00 0.01 0.00 0.00 42.46 38.37 1ynj s ILE 108 CO 0.03 -0.69 0.79 -1.59 0.00 0.00 0.00 174.94 173.48 1ynj s LYS 109 N 2.09 3.47 0.11 2.79 0.00 -1.26 -1.20 119.74 125.74 1ynj s LYS 109 Ca 0.09 -2.12 -0.31 0.00 0.00 0.00 0.00 55.97 53.63 1ynj s LYS 109 Cb -0.22 -4.49 -0.09 0.00 0.00 0.00 0.00 37.83 33.04 1ynj s LYS 109 CO 0.09 -1.41 1.55 -2.00 0.00 0.00 0.00 175.35 173.57 1ynj s GLU 110 N 1.07 4.23 -0.86 1.78 -6.30 -1.22 -4.77 118.70 112.64 1ynj s GLU 110 Ca 0.18 2.27 -0.23 0.00 -2.50 0.00 0.00 54.97 54.69 1ynj s GLU 110 Cb -0.13 -3.34 -0.18 0.00 0.00 0.00 0.00 34.13 30.47 1ynj s GLU 110 CO -0.06 -0.61 2.21 -3.47 0.02 0.00 0.00 175.26 173.35 1ynj n ASP 111 N 4.57 1.08 -0.94 -1.70 -0.08 -1.26 -4.29 116.55 113.94 1ynj n ASP 111 Ca 0.14 -1.71 0.11 0.00 -1.51 0.00 0.00 54.79 51.82 1ynj n ASP 111 Cb 0.40 -1.51 -0.03 0.00 2.34 0.00 0.00 41.12 42.32 1ynj n ASP 111 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1ynj n GLU 112 N 7.99 -1.72 -3.95 -0.67 1.02 -1.26 -4.96 120.64 117.10 1ynj n GLU 112 Ca 0.44 1.22 -0.10 0.00 -0.02 0.00 0.00 57.16 58.70 1ynj n GLU 112 Cb 0.42 -2.19 -0.10 0.00 -0.02 0.00 0.00 31.44 29.55 1ynj n GLU 112 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1ynj s VAL 113 N -2.49 0.12 -0.37 2.62 -7.23 0.10 -4.84 120.40 108.30 1ynj s VAL 113 Ca 0.00 -0.95 -0.28 0.00 -1.81 0.00 0.00 61.98 58.94 1ynj s VAL 113 Cb 0.00 -0.52 0.02 0.00 0.56 0.00 0.00 36.38 36.44 1ynj s VAL 113 CO 0.00 -0.52 1.05 0.12 -0.31 0.00 0.00 175.10 175.44 1ynj s PHE 114 N -1.84 3.05 -0.07 2.82 5.36 -1.26 -0.22 117.98 125.82 1ynj s PHE 114 Ca -0.12 0.96 0.21 0.00 -0.96 0.00 0.00 56.93 57.02 1ynj s PHE 114 Cb -0.06 -3.87 -0.32 0.00 -0.34 0.00 0.00 43.02 38.43 1ynj s PHE 114 CO -0.02 -0.91 0.47 1.28 -1.46 0.00 0.00 175.22 174.59 1ynj n LEU 115 N 7.09 0.04 0.00 6.12 4.77 -0.76 -4.24 117.00 130.03 1ynj n LEU 115 Ca 0.11 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1ynj n LEU 115 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1ynj n LEU 115 CO 0.62 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1ynj n GLY 116 N 1.33 -1.73 3.49 -0.72 0.00 -1.25 -4.10 105.19 102.20 1ynj n GLY 116 Ca -0.03 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1ynj n GLY 116 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ynj s HIS 117 N -2.73 3.08 -0.32 1.61 3.76 -1.26 -0.70 115.29 118.73 1ynj s HIS 117 Ca 0.00 -0.33 -0.12 0.00 -0.15 0.00 0.00 55.06 54.46 1ynj s HIS 117 Cb 0.00 -2.10 -0.03 0.00 1.11 0.00 0.00 32.58 31.57 1ynj s HIS 117 CO 0.00 -0.17 0.21 -1.17 -0.85 0.00 0.00 174.74 172.76 1ynj s LEU 118 N 0.93 4.29 0.12 0.89 2.96 0.11 -4.86 118.68 123.13 1ynj s LEU 118 Ca 0.02 -0.31 -0.31 0.00 -0.22 0.00 0.00 54.13 53.30 1ynj s LEU 118 Cb -0.14 -2.11 -0.09 0.00 0.50 0.00 0.00 46.19 44.35 1ynj s LEU 118 CO 0.02 -0.17 1.51 -2.16 -1.32 0.00 0.00 176.35 174.23 1ynj s PRO 119 N 1.72 4.25 -0.09 0.98 0.04 -1.26 -0.19 135.00 140.45 1ynj s PRO 119 Ca 0.06 2.23 -0.13 0.00 0.04 0.00 0.00 61.00 63.21 1ynj s PRO 119 Cb -0.17 -3.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.03 1ynj s PRO 119 CO 0.10 -0.57 0.30 -0.51 0.04 0.00 0.00 177.00 176.37 1ynj s LEU 120 N 1.46 4.37 0.36 -3.56 1.43 -0.42 -4.92 118.68 117.39 1ynj s LEU 120 Ca 0.68 0.69 -0.25 0.00 -1.03 0.00 0.00 54.13 54.22 1ynj s LEU 120 Cb -0.40 -2.39 -0.10 0.00 0.03 0.00 0.00 46.19 43.34 1ynj s LEU 120 CO 0.31 0.26 0.99 -0.32 0.23 0.00 0.00 176.35 177.82 1ynj s MET 121 N -0.51 4.41 0.88 1.70 -2.45 -1.26 -4.64 119.30 117.43 1ynj s MET 121 Ca 0.19 1.41 -0.14 0.00 -1.25 0.00 0.00 55.69 55.91 1ynj s MET 121 Cb -0.14 -2.69 0.13 0.00 1.25 0.00 0.00 34.83 33.39 1ynj s MET 121 CO 0.08 0.10 1.23 0.99 1.05 0.00 0.00 175.02 178.46 1ynj s THR 122 N -1.64 1.99 0.44 10.11 2.01 -0.85 -4.95 115.64 122.74 1ynj s THR 122 Ca 0.53 0.00 0.15 0.00 0.31 0.00 0.00 61.69 62.69 1ynj s THR 122 Cb -0.20 -2.97 0.34 0.00 0.01 0.00 0.00 72.50 69.69 1ynj s THR 122 CO 0.25 0.00 1.96 -0.08 -0.69 0.00 0.00 174.62 176.06 1ynj h GLU 123 N -1.35 0.37 0.09 4.92 4.81 -1.97 -3.06 114.58 118.39 1ynj h GLU 123 Ca -0.46 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 58.76 1ynj h GLU 123 Cb 1.29 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 1ynj h GLU 123 CO 0.55 0.25 -0.13 0.22 -0.73 0.00 0.00 179.01 179.17 1ynj h ASP 124 N 0.38 -0.34 0.00 1.04 1.82 -1.95 -3.46 116.42 113.91 1ynj h ASP 124 Ca 0.31 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.99 1ynj h ASP 124 Cb 0.69 0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.83 1ynj h ASP 124 CO -0.09 -0.19 0.00 0.61 -1.61 0.00 0.00 179.24 177.96 1ynj n GLY 125 N -1.25 1.40 3.96 -0.78 0.00 -1.16 -4.90 105.19 102.47 1ynj n GLY 125 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 1ynj n GLY 125 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ynj s SER 126 N -1.44 6.32 0.48 1.61 1.04 -1.26 -4.80 113.70 115.64 1ynj s SER 126 Ca 0.00 0.16 0.08 0.00 0.48 0.00 0.00 55.95 56.67 1ynj s SER 126 Cb 0.00 -1.90 0.03 0.00 0.10 0.00 0.00 66.02 64.24 1ynj s SER 126 CO 0.00 -0.12 0.55 -0.36 0.98 0.00 0.00 173.24 174.29 1ynj s PHE 127 N -2.05 2.25 -0.10 5.02 0.40 0.14 -2.02 117.98 121.62 1ynj s PHE 127 Ca 0.35 -0.57 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1ynj s PHE 127 Cb -0.09 -2.21 0.01 0.00 0.51 0.00 0.00 43.02 41.24 1ynj s PHE 127 CO 0.31 -0.54 -0.15 0.42 0.70 0.00 0.00 175.22 175.96 1ynj s ILE 128 N -2.53 1.43 -0.09 0.64 1.01 -1.26 -2.34 121.20 118.06 1ynj s ILE 128 Ca 0.52 -0.61 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 1ynj s ILE 128 Cb -0.06 -1.30 0.04 0.00 0.01 0.00 0.00 42.46 41.14 1ynj s ILE 128 CO 0.32 0.43 0.04 -0.63 0.00 0.00 0.00 174.94 175.09 1ynj s ILE 129 N 0.89 0.17 -1.30 2.92 1.09 -0.52 -3.36 121.20 121.09 1ynj s ILE 129 Ca -0.09 0.09 -0.23 0.00 -1.10 0.00 0.00 60.65 59.32 1ynj s ILE 129 Cb -0.15 -0.48 0.03 0.00 -1.06 0.00 0.00 42.46 40.80 1ynj s ILE 129 CO 0.00 0.09 0.53 0.59 -0.10 0.00 0.00 174.94 176.05 1ynj n ASN 130 N 5.20 -2.86 0.00 3.58 3.02 -1.21 -4.19 115.26 118.80 1ynj n ASN 130 Ca -0.06 -1.24 0.00 0.00 -0.03 0.00 0.00 54.58 53.25 1ynj n ASN 130 Cb 0.49 -1.96 0.00 0.00 -0.61 0.00 0.00 39.78 37.71 1ynj n ASN 130 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ynj n GLY 131 N -2.15 -0.35 1.62 7.41 0.00 -0.89 -4.65 105.19 106.18 1ynj n GLY 131 Ca -0.17 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1ynj n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynj n ALA 132 N 4.73 -1.02 -2.59 4.61 0.00 -1.26 -4.73 120.51 120.25 1ynj n ALA 132 Ca 0.00 0.01 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 1ynj n ALA 132 Cb 0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 1ynj n ALA 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ynj s ASP 133 N -0.01 6.97 0.11 0.00 -0.00 -1.26 -1.44 116.67 121.04 1ynj s ASP 133 Ca 0.00 1.30 0.05 0.00 -0.00 0.00 0.00 52.55 53.90 1ynj s ASP 133 Cb 0.00 -2.54 -0.04 0.00 -0.00 0.00 0.00 42.92 40.34 1ynj s ASP 133 CO 0.00 -0.80 0.00 -0.13 -0.00 0.00 0.00 175.17 174.24 1ynj s ARG 134 N 3.51 2.52 -0.08 8.23 0.52 -0.99 -2.86 118.95 129.81 1ynj s ARG 134 Ca 0.47 -0.90 0.05 0.00 -0.52 0.00 0.00 55.73 54.84 1ynj s ARG 134 Cb -0.15 -2.50 -0.00 0.00 0.52 0.00 0.00 34.95 32.81 1ynj s ARG 134 CO 0.12 0.52 -0.23 0.08 0.02 0.00 0.00 175.30 175.81 1ynj s VAL 135 N -1.41 1.97 -0.36 3.52 1.01 -0.98 0.26 120.40 124.40 1ynj s VAL 135 Ca 0.26 -0.99 -0.19 0.00 0.00 0.00 0.00 61.98 61.06 1ynj s VAL 135 Cb -0.11 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.59 1ynj s VAL 135 CO 0.18 0.54 0.57 -0.63 0.00 0.00 0.00 175.10 175.77 1ynj s ILE 136 N 0.13 4.95 0.30 2.22 -1.09 -1.26 -1.80 121.20 124.65 1ynj s ILE 136 Ca -0.11 0.39 -0.28 0.00 -2.23 0.00 0.00 60.65 58.41 1ynj s ILE 136 Cb -0.16 -4.03 -0.09 0.00 -1.58 0.00 0.00 42.46 36.60 1ynj s ILE 136 CO 0.06 -0.30 1.08 -0.69 -1.23 0.00 0.00 174.94 173.86 1ynj s VAL 137 N 2.55 3.55 0.05 2.92 1.01 0.16 -4.70 120.40 125.94 1ynj s VAL 137 Ca 0.21 1.50 -0.30 0.00 0.00 0.00 0.00 61.98 63.39 1ynj s VAL 137 Cb -0.15 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1ynj s VAL 137 CO 0.14 0.30 1.01 -0.44 0.00 0.00 0.00 175.10 176.12 1ynj s SER 138 N -1.02 7.36 0.33 3.32 0.01 -1.23 -4.82 113.70 117.66 1ynj s SER 138 Ca 0.47 1.76 0.04 0.00 1.31 0.00 0.00 55.95 59.53 1ynj s SER 138 Cb -0.30 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.34 1ynj s SER 138 CO 0.38 -0.24 0.50 0.00 0.41 0.00 0.00 173.24 174.29 1ynj s GLN 139 N 0.68 3.26 0.02 12.44 -2.07 -0.97 -2.07 119.66 130.95 1ynj s GLN 139 Ca 0.51 -0.72 0.05 0.00 -1.82 0.00 0.00 55.36 53.39 1ynj s GLN 139 Cb -0.23 -2.76 -0.02 0.00 -1.09 0.00 0.00 33.01 28.91 1ynj s GLN 139 CO 0.29 0.11 -0.14 0.96 -1.32 0.00 0.00 175.29 175.19 1ynj s ILE 140 N -2.23 1.12 0.26 3.63 -4.36 -0.53 -1.53 121.20 117.56 1ynj s ILE 140 Ca 0.42 -0.88 0.06 0.00 -0.26 0.00 0.00 60.65 59.99 1ynj s ILE 140 Cb -0.09 -0.99 -0.02 0.00 1.25 0.00 0.00 42.46 42.60 1ynj s ILE 140 CO 0.33 0.10 0.23 0.00 0.24 0.00 0.00 174.94 175.84 1ynj n HIS 141 N 2.16 -0.65 -2.05 1.37 1.44 -1.20 -4.31 115.22 111.98 1ynj n HIS 141 Ca -0.17 -2.17 -0.42 0.00 -2.01 0.00 0.00 57.72 52.95 1ynj n HIS 141 Cb 0.55 0.24 -0.03 0.00 0.12 0.00 0.00 29.99 30.87 1ynj n HIS 141 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 1ynj s ARG 142 N -3.04 4.20 0.09 -1.40 6.06 -1.26 -1.94 118.95 121.67 1ynj s ARG 142 Ca 0.31 2.14 -0.31 0.00 -2.50 0.00 0.00 55.73 55.37 1ynj s ARG 142 Cb 0.01 -3.83 -0.09 0.00 0.06 0.00 0.00 34.95 31.10 1ynj s ARG 142 CO 0.22 -0.77 1.70 0.45 -2.50 0.00 0.00 175.30 174.39 1ynj s SER 143 N 2.84 6.55 0.54 -2.12 0.15 0.91 -4.72 113.70 117.85 1ynj s SER 143 Ca 0.71 2.57 -0.20 0.00 0.70 0.00 0.00 55.95 59.73 1ynj s SER 143 Cb -0.33 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 61.34 1ynj s SER 143 CO 0.29 -0.92 0.96 -0.81 1.20 0.00 0.00 173.24 173.96 1ynj n PRO 144 N 5.51 1.05 -3.91 5.44 -0.04 -1.26 -4.85 135.00 136.94 1ynj n PRO 144 Ca 0.16 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1ynj n PRO 144 Cb 0.40 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.74 1ynj n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ynj n GLY 145 N 1.27 -1.02 3.30 0.55 0.00 -0.34 -4.42 105.19 104.52 1ynj n GLY 145 Ca 0.12 -1.14 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 1ynj n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ynj s VAL 146 N -3.00 1.99 0.00 1.61 0.11 -1.26 -2.12 120.40 117.73 1ynj s VAL 146 Ca 0.00 -1.14 0.00 0.00 -2.93 0.00 0.00 61.98 57.91 1ynj s VAL 146 Cb 0.00 -1.67 0.00 0.00 -1.53 0.00 0.00 36.38 33.18 1ynj s VAL 146 CO 0.00 0.51 0.00 -1.22 -3.33 0.00 0.00 175.10 171.06 1ynj n TYR 147 N 2.31 0.00 0.00 1.54 4.02 -0.81 -4.93 117.16 119.28 1ynj n TYR 147 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1ynj n TYR 147 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 1ynj n TYR 147 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1ynj n PHE 148 N -1.74 0.00 0.00 -0.72 3.01 -1.26 -4.26 117.46 112.49 1ynj n PHE 148 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1ynj n PHE 148 Cb 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.67 1ynj n PHE 148 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1ynj n THR 149 N 0.00 0.00 -1.84 4.37 -1.04 -1.24 -3.52 114.28 111.01 1ynj n THR 149 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 1ynj n THR 149 Cb 0.00 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 68.57 1ynj n THR 149 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1ynj s PRO 150 N -3.28 2.51 -0.29 -2.82 0.02 -1.26 -3.02 135.00 126.86 1ynj s PRO 150 Ca 0.00 0.39 -0.07 0.00 0.02 0.00 0.00 61.00 61.35 1ynj s PRO 150 Cb 0.00 -1.99 0.01 0.00 0.02 0.00 0.00 34.50 32.54 1ynj s PRO 150 CO 0.00 -1.27 0.08 0.34 -0.33 0.00 0.00 177.00 175.82 1ynj s ASP 151 N -4.35 5.11 0.44 2.53 -1.08 -1.08 -4.48 116.67 113.75 1ynj s ASP 151 Ca 0.60 -0.67 0.23 0.00 -0.52 0.00 0.00 52.55 52.19 1ynj s ASP 151 Cb -0.12 -1.88 0.95 0.00 -1.46 0.00 0.00 42.92 40.42 1ynj s ASP 151 CO 0.51 -0.18 1.85 -0.65 0.52 0.00 0.00 175.17 177.23 1ynj h PRO 152 N 8.23 0.00 -0.01 4.34 0.11 -1.97 -2.97 132.00 139.73 1ynj h PRO 152 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1ynj h PRO 152 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1ynj h PRO 152 CO 0.60 0.25 -0.65 0.00 -0.21 0.00 0.00 178.00 177.99 1ynj n ALA 153 N -2.26 3.95 -3.41 -0.75 0.00 -1.26 -4.83 120.51 111.96 1ynj n ALA 153 Ca -0.00 -0.56 -0.14 0.00 0.00 0.00 0.00 53.44 52.73 1ynj n ALA 153 Cb 0.41 -0.87 -0.10 0.00 0.00 0.00 0.00 19.45 18.90 1ynj n ALA 153 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ynj s ARG 154 N -2.74 0.30 0.64 0.00 0.52 -1.12 -5.16 118.95 111.39 1ynj s ARG 154 Ca 0.14 0.19 -0.15 0.00 -0.52 0.00 0.00 55.73 55.39 1ynj s ARG 154 Cb 0.17 -0.75 -0.01 0.00 0.52 0.00 0.00 34.95 34.89 1ynj s ARG 154 CO 0.69 -0.80 1.09 -2.14 0.02 0.00 0.00 175.30 174.16 1ynj s PRO 155 N 2.42 2.95 0.00 3.54 0.02 -1.26 -3.17 135.00 139.51 1ynj s PRO 155 Ca 0.10 1.31 0.00 0.00 0.02 0.00 0.00 61.00 62.43 1ynj s PRO 155 Cb -0.15 -1.98 0.00 0.00 0.02 0.00 0.00 34.50 32.40 1ynj s PRO 155 CO -0.21 -1.12 0.00 0.41 -0.33 0.00 0.00 177.00 175.75 1ynj n GLY 156 N -0.73 0.33 3.64 0.52 0.00 -1.26 -4.97 105.19 102.72 1ynj n GLY 156 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1ynj n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ynj s ARG 157 N -0.83 2.04 0.03 1.61 1.81 -1.19 -4.95 118.95 117.45 1ynj s ARG 157 Ca 0.00 -2.25 -0.06 0.00 -1.72 0.00 0.00 55.73 51.70 1ynj s ARG 157 Cb 0.00 -1.21 -0.01 0.00 -0.45 0.00 0.00 34.95 33.28 1ynj s ARG 157 CO 0.00 -0.34 0.10 0.71 -0.68 0.00 0.00 175.30 175.09 1ynj s TYR 158 N -2.99 0.15 0.37 -0.53 1.51 -1.26 -2.65 117.35 111.96 1ynj s TYR 158 Ca 0.18 -0.39 0.08 0.00 -1.01 0.00 0.00 57.07 55.93 1ynj s TYR 158 Cb 0.04 -0.11 -0.02 0.00 -0.11 0.00 0.00 41.96 41.75 1ynj s TYR 158 CO 0.10 -0.33 0.36 0.96 -1.11 0.00 0.00 175.55 175.53 1ynj s ILE 159 N -2.15 3.18 -0.06 2.71 -4.36 -1.17 -4.21 121.20 115.14 1ynj s ILE 159 Ca -0.09 -1.30 0.00 0.00 -0.26 0.00 0.00 60.65 59.00 1ynj s ILE 159 Cb -0.04 -3.11 0.02 0.00 1.25 0.00 0.00 42.46 40.58 1ynj s ILE 159 CO -0.02 -0.09 -0.04 0.00 0.24 0.00 0.00 174.94 175.03 1ynj s ALA 160 N -2.37 0.81 -0.23 2.27 0.00 0.63 -3.70 121.76 119.18 1ynj s ALA 160 Ca 0.45 -0.17 -0.04 0.00 0.00 0.00 0.00 51.96 52.20 1ynj s ALA 160 Cb -0.05 -0.61 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 1ynj s ALA 160 CO 0.28 -0.22 -0.02 -1.12 0.00 0.00 0.00 175.76 174.68 1ynj s SER 161 N 1.38 4.45 -0.68 0.00 0.01 -1.25 0.21 113.70 117.81 1ynj s SER 161 Ca -0.03 -0.37 -0.11 0.00 1.31 0.00 0.00 55.95 56.74 1ynj s SER 161 Cb -0.13 -1.77 0.18 0.00 0.21 0.00 0.00 66.02 64.50 1ynj s SER 161 CO -0.03 -0.03 0.59 -0.63 0.41 0.00 0.00 173.24 173.56 1ynj s ILE 162 N 1.50 4.95 -0.28 1.44 1.01 0.24 -1.92 121.20 128.13 1ynj s ILE 162 Ca 0.06 -2.30 -0.04 0.00 0.00 0.00 0.00 60.65 58.36 1ynj s ILE 162 Cb -0.14 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.22 1ynj s ILE 162 CO -0.02 -0.93 0.02 -0.63 0.00 0.00 0.00 174.94 173.38 1ynj s ILE 163 N 0.55 3.47 0.70 2.92 1.01 -0.90 -2.47 121.20 126.48 1ynj s ILE 163 Ca 0.13 -0.91 -0.06 0.00 0.00 0.00 0.00 60.65 59.81 1ynj s ILE 163 Cb -0.18 -2.81 0.07 0.00 0.01 0.00 0.00 42.46 39.54 1ynj s ILE 163 CO -0.05 0.08 1.00 -2.16 0.00 0.00 0.00 174.94 173.82 1ynj s PRO 164 N 1.41 2.14 0.40 2.79 0.04 -1.26 -1.20 135.00 139.32 1ynj s PRO 164 Ca 0.01 -0.35 -0.24 0.00 0.04 0.00 0.00 61.00 60.45 1ynj s PRO 164 Cb -0.17 -2.20 -0.11 0.00 0.04 0.00 0.00 34.50 32.06 1ynj s PRO 164 CO -0.00 -1.24 0.93 1.28 0.04 0.00 0.00 177.00 178.00 1ynj n LEU 165 N -2.89 2.07 -4.77 -3.56 4.77 -1.26 -4.71 117.00 106.65 1ynj n LEU 165 Ca 0.09 1.03 -0.41 0.00 -0.03 0.00 0.00 56.01 56.68 1ynj n LEU 165 Cb 0.60 -1.30 -0.00 0.00 -2.33 0.00 0.00 43.42 40.39 1ynj n LEU 165 CO 0.51 -1.71 1.16 -0.81 -1.33 0.00 0.00 177.39 175.20 1ynj n PRO 166 N 0.28 2.69 -3.26 3.23 -0.04 -1.26 -1.66 135.00 134.98 1ynj n PRO 166 Ca 0.10 0.95 -0.23 0.00 -0.04 0.00 0.00 63.50 64.27 1ynj n PRO 166 Cb 0.38 -2.69 0.02 0.00 -0.04 0.00 0.00 33.50 31.17 1ynj n PRO 166 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ynj n LYS 167 N 0.75 -4.27 -2.74 0.54 4.76 -1.26 -4.87 118.16 111.07 1ynj n LYS 167 Ca 0.03 0.67 -0.03 0.00 -2.87 0.00 0.00 58.31 56.11 1ynj n LYS 167 Cb 0.38 -5.47 0.08 0.00 -1.84 0.00 0.00 35.03 28.19 1ynj n LYS 167 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1ynj n ARG 168 N -3.94 1.47 0.00 1.97 1.74 -0.66 -5.07 116.66 112.16 1ynj n ARG 168 Ca -0.05 -2.51 0.00 0.00 -0.77 0.00 0.00 57.85 54.51 1ynj n ARG 168 Cb 0.57 -0.70 0.00 0.00 -1.02 0.00 0.00 32.46 31.32 1ynj n ARG 168 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ynj n GLY 169 N -0.85 3.87 3.96 -0.13 0.00 -1.26 -1.26 105.19 109.53 1ynj n GLY 169 Ca -0.02 -1.65 -0.22 0.00 0.00 0.00 0.00 46.02 44.12 1ynj n GLY 169 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ynj s PRO 170 N -2.69 3.18 -0.51 1.61 0.04 -1.26 -4.83 135.00 130.54 1ynj s PRO 170 Ca 0.00 -0.56 -0.26 0.00 0.04 0.00 0.00 61.00 60.22 1ynj s PRO 170 Cb 0.00 -2.64 0.03 0.00 0.04 0.00 0.00 34.50 31.93 1ynj s PRO 170 CO 0.00 -0.09 0.98 -0.46 0.04 0.00 0.00 177.00 177.47 1ynj s TRP 171 N -2.41 2.83 -0.29 0.56 -0.11 -1.26 -4.50 118.94 113.76 1ynj s TRP 171 Ca 0.45 0.29 -0.08 0.00 1.22 0.00 0.00 56.10 57.98 1ynj s TRP 171 Cb -0.10 -4.11 -0.00 0.00 -1.50 0.00 0.00 33.47 27.76 1ynj s TRP 171 CO 0.36 -1.26 0.10 0.42 -4.62 0.00 0.00 176.95 171.95 1ynj s ILE 172 N 4.03 4.24 -0.07 5.86 1.01 -1.03 -4.21 121.20 131.02 1ynj s ILE 172 Ca 0.37 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.52 1ynj s ILE 172 Cb -0.10 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.20 1ynj s ILE 172 CO 0.24 0.12 -0.07 -1.81 0.00 0.00 0.00 174.94 173.42 1ynj s ASP 173 N 1.56 4.59 -0.14 3.58 1.11 -0.73 0.82 116.67 127.46 1ynj s ASP 173 Ca 0.04 -0.05 0.02 0.00 0.18 0.00 0.00 52.55 52.74 1ynj s ASP 173 Cb -0.17 -1.20 0.01 0.00 1.07 0.00 0.00 42.92 42.63 1ynj s ASP 173 CO 0.04 0.34 -0.21 -0.76 1.18 0.00 0.00 175.17 175.76 1ynj s LEU 174 N -0.69 2.16 -0.12 1.23 1.43 0.56 -1.46 118.68 121.80 1ynj s LEU 174 Ca 0.10 -0.58 -0.10 0.00 -1.03 0.00 0.00 54.13 52.52 1ynj s LEU 174 Cb -0.11 -1.46 0.03 0.00 0.03 0.00 0.00 46.19 44.68 1ynj s LEU 174 CO 0.02 0.08 0.31 -1.83 0.23 0.00 0.00 176.35 175.16 1ynj s GLU 175 N 0.79 0.35 -0.20 1.70 -1.05 -1.12 0.23 118.70 119.41 1ynj s GLU 175 Ca -0.07 0.45 -0.10 0.00 -0.15 0.00 0.00 54.97 55.09 1ynj s GLU 175 Cb -0.16 0.15 -0.05 0.00 -0.44 0.00 0.00 34.13 33.64 1ynj s GLU 175 CO -0.01 -0.05 0.15 0.54 0.95 0.00 0.00 175.26 176.83 1ynj s VAL 176 N 0.27 5.39 0.75 1.83 0.11 -1.25 -3.97 120.40 123.54 1ynj s VAL 176 Ca -0.01 0.22 -0.01 0.00 -2.93 0.00 0.00 61.98 59.25 1ynj s VAL 176 Cb -0.03 -3.49 0.14 0.00 -1.53 0.00 0.00 36.38 31.48 1ynj s VAL 176 CO -0.01 0.43 1.03 -1.61 -3.33 0.00 0.00 175.10 171.61 1ynj s GLU 177 N 0.44 1.52 0.07 1.54 2.02 -0.46 -4.92 118.70 118.90 1ynj s GLU 177 Ca 0.09 -1.15 0.14 0.00 0.02 0.00 0.00 54.97 54.07 1ynj s GLU 177 Cb -0.11 -2.30 0.62 0.00 0.10 0.00 0.00 34.13 32.44 1ynj s GLU 177 CO -0.01 -1.58 1.45 0.00 0.02 0.00 0.00 175.26 175.14 1ynj n ALA 178 N -2.93 1.53 0.13 5.21 0.00 -1.26 -0.72 120.51 122.47 1ynj n ALA 178 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1ynj n ALA 178 Cb 0.61 -1.23 0.12 0.00 0.00 0.00 0.00 19.45 18.94 1ynj n ALA 178 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ynj h SER 179 N 0.00 0.00 0.00 0.00 4.64 -2.03 -3.47 113.55 112.69 1ynj h SER 179 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ynj h SER 179 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1ynj h SER 179 CO 0.00 0.61 0.00 0.61 -0.87 0.00 0.00 176.83 177.18 1ynj n GLY 180 N 0.72 2.67 3.60 -0.77 0.00 0.10 -4.89 105.19 106.63 1ynj n GLY 180 Ca 0.00 -0.59 -0.45 0.00 0.00 0.00 0.00 46.02 44.98 1ynj n GLY 180 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ynj n VAL 181 N 0.00 1.68 0.01 1.61 0.31 -1.26 -4.36 118.33 116.31 1ynj n VAL 181 Ca 0.00 -0.42 -0.11 0.00 -0.01 0.00 0.00 64.34 63.80 1ynj n VAL 181 Cb 0.00 -1.03 -0.14 0.00 -0.91 0.00 0.00 33.84 31.77 1ynj n VAL 181 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1ynj h VAL 182 N 2.23 0.99 -3.83 2.52 2.07 -1.89 -1.22 116.25 117.13 1ynj h VAL 182 Ca -0.41 -2.78 0.00 0.00 0.82 0.00 0.00 66.70 64.33 1ynj h VAL 182 Cb 1.33 2.54 0.00 0.00 -1.52 0.00 0.00 31.29 33.64 1ynj h VAL 182 CO 0.64 0.65 -0.52 0.35 0.02 0.00 0.00 177.57 178.71 1ynj n THR 183 N -3.20 -7.33 -3.28 2.57 -2.24 -1.25 -2.80 114.28 96.74 1ynj n THR 183 Ca -0.16 1.85 -0.38 0.00 -2.27 0.00 0.00 64.05 63.09 1ynj n THR 183 Cb 1.03 -3.27 -0.06 0.00 -2.10 0.00 0.00 70.33 65.94 1ynj n THR 183 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1ynj s MET 184 N -0.28 4.35 -0.32 -0.78 1.75 0.95 -3.19 119.30 121.77 1ynj s MET 184 Ca 0.00 0.49 -0.06 0.00 -1.25 0.00 0.00 55.69 54.87 1ynj s MET 184 Cb 0.00 -3.44 0.03 0.00 2.84 0.00 0.00 34.83 34.26 1ynj s MET 184 CO 0.00 0.14 0.09 0.21 -0.65 0.00 0.00 175.02 174.81 1ynj s LYS 185 N 0.66 2.75 0.01 4.11 2.20 -0.54 -2.14 119.74 126.78 1ynj s LYS 185 Ca 0.27 -1.09 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 1ynj s LYS 185 Cb -0.15 -3.40 -0.01 0.00 -1.51 0.00 0.00 37.83 32.76 1ynj s LYS 185 CO 0.11 -0.59 -0.04 0.54 -0.36 0.00 0.00 175.35 175.01 1ynj s VAL 186 N 1.42 0.28 -1.41 4.02 0.11 -0.26 -1.78 120.40 122.77 1ynj s VAL 186 Ca -0.01 -0.42 -0.13 0.00 -2.93 0.00 0.00 61.98 58.49 1ynj s VAL 186 Cb -0.19 -0.29 0.11 0.00 -1.53 0.00 0.00 36.38 34.48 1ynj s VAL 186 CO 0.02 -0.10 0.60 0.59 -3.33 0.00 0.00 175.10 172.89 1ynj n ASN 187 N 2.51 -3.48 -3.77 3.54 3.02 -1.26 0.50 115.26 116.32 1ynj n ASN 187 Ca -0.16 -0.62 -0.29 0.00 -0.03 0.00 0.00 54.58 53.48 1ynj n ASN 187 Cb 0.58 -2.87 0.02 0.00 -0.61 0.00 0.00 39.78 36.90 1ynj n ASN 187 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1ynj n LYS 188 N -3.96 -5.26 -4.71 3.52 2.85 -1.26 -5.01 118.16 104.33 1ynj n LYS 188 Ca 0.03 0.61 -0.24 0.00 -1.05 0.00 0.00 58.31 57.66 1ynj n LYS 188 Cb 0.52 -5.48 -0.15 0.00 -0.65 0.00 0.00 35.03 29.27 1ynj n LYS 188 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 1ynj s ARG 189 N -6.48 1.27 -0.17 -1.58 3.03 0.18 -5.14 118.95 110.07 1ynj s ARG 189 Ca 0.61 -0.63 -0.01 0.00 2.03 0.00 0.00 55.73 57.73 1ynj s ARG 189 Cb -0.30 -1.25 0.04 0.00 -1.03 0.00 0.00 34.95 32.41 1ynj s ARG 189 CO 0.75 0.34 -0.04 0.15 -1.13 0.00 0.00 175.30 175.37 1ynj s LYS 190 N -0.54 1.31 0.25 3.89 1.02 -1.26 -1.10 119.74 123.31 1ynj s LYS 190 Ca 0.06 -0.50 0.09 0.00 0.02 0.00 0.00 55.97 55.64 1ynj s LYS 190 Cb -0.07 -1.99 -0.05 0.00 -0.52 0.00 0.00 37.83 35.20 1ynj s LYS 190 CO -0.00 -0.46 -0.14 -0.59 -0.92 0.00 0.00 175.35 173.24 1ynj s PHE 191 N 1.67 1.97 0.12 3.18 -0.12 -0.91 -4.96 117.98 118.92 1ynj s PHE 191 Ca 0.00 -0.52 -0.31 0.00 -0.05 0.00 0.00 56.93 56.05 1ynj s PHE 191 Cb -0.15 -0.96 -0.10 0.00 -0.63 0.00 0.00 43.02 41.18 1ynj s PHE 191 CO -0.07 0.46 1.82 -2.14 -0.05 0.00 0.00 175.22 175.24 1ynj s PRO 192 N -3.62 4.14 0.21 1.99 0.02 -1.26 -0.03 135.00 136.44 1ynj s PRO 192 Ca 0.27 2.58 -0.13 0.00 0.02 0.00 0.00 61.00 63.74 1ynj s PRO 192 Cb -0.01 -3.61 0.24 0.00 0.02 0.00 0.00 34.50 31.15 1ynj s PRO 192 CO 0.11 -0.84 1.63 1.25 -0.33 0.00 0.00 177.00 178.82 1ynj h LEU 193 N 8.67 -0.56 -0.66 -5.54 6.46 -1.85 -2.36 115.31 119.46 1ynj h LEU 193 Ca -0.46 0.19 0.11 0.00 -0.12 0.00 0.00 57.88 57.60 1ynj h LEU 193 Cb 1.22 0.38 -0.11 0.00 -0.73 0.00 0.00 40.66 41.42 1ynj h LEU 193 CO 0.95 -0.20 -0.23 0.52 -0.62 0.00 0.00 178.44 178.86 1ynj n VAL 194 N -5.42 -0.32 -0.29 1.05 0.31 -1.26 0.15 118.33 112.55 1ynj n VAL 194 Ca 0.08 1.54 0.09 0.00 -0.01 0.00 0.00 64.34 66.03 1ynj n VAL 194 Cb 0.33 -2.06 0.21 0.00 -0.91 0.00 0.00 33.84 31.41 1ynj n VAL 194 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1ynj h LEU 195 N 0.00 -0.33 0.09 7.52 5.85 -1.68 1.55 115.31 128.30 1ynj h LEU 195 Ca 0.26 0.22 -0.00 0.00 0.84 0.00 0.00 57.88 59.19 1ynj h LEU 195 Cb 0.42 0.37 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1ynj h LEU 195 CO -0.66 -0.22 -0.04 0.25 -0.34 0.00 0.00 178.44 177.43 1ynj h LEU 196 N 0.10 -0.10 -1.04 2.25 5.85 0.13 -2.71 115.31 119.78 1ynj h LEU 196 Ca 0.48 -0.32 0.14 0.00 0.84 0.00 0.00 57.88 59.02 1ynj h LEU 196 Cb 0.90 0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.87 1ynj h LEU 196 CO -0.73 0.28 0.62 -0.07 -0.34 0.00 0.00 178.44 178.20 1ynj h LEU 197 N -0.49 0.86 -0.53 2.25 3.38 0.06 0.34 115.31 121.18 1ynj h LEU 197 Ca -0.01 0.06 0.08 0.00 0.09 0.00 0.00 57.88 58.10 1ynj h LEU 197 Cb 0.41 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 1ynj h LEU 197 CO 0.02 0.42 0.15 -0.09 0.09 0.00 0.00 178.44 179.03 1ynj h ARG 198 N 0.90 0.30 0.41 1.13 9.65 0.21 -1.33 114.38 125.65 1ynj h ARG 198 Ca 0.51 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 59.36 1ynj h ARG 198 Cb 0.63 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.13 1ynj h ARG 198 CO -0.29 0.20 -0.25 0.28 2.80 0.00 0.00 179.97 182.71 1ynj h VAL 199 N 0.31 0.47 0.00 0.20 2.07 -0.09 -0.27 116.25 118.94 1ynj h VAL 199 Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1ynj h VAL 199 Cb 0.33 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1ynj h VAL 199 CO -0.30 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.47 1ynj n LEU 200 N -5.38 0.13 0.00 2.57 4.77 -0.12 -4.79 117.00 114.18 1ynj n LEU 200 Ca -0.11 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1ynj n LEU 200 Cb 0.29 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1ynj n LEU 200 CO 0.34 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1ynj n GLY 201 N 0.03 0.74 3.76 -0.72 0.00 -0.11 -4.52 105.19 104.38 1ynj n GLY 201 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1ynj n GLY 201 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ynj s TYR 202 N -2.80 2.60 0.05 1.61 1.51 -0.77 -4.99 117.35 114.56 1ynj s TYR 202 Ca 0.00 1.37 0.08 0.00 -1.01 0.00 0.00 57.07 57.51 1ynj s TYR 202 Cb 0.00 -3.74 -0.03 0.00 -0.11 0.00 0.00 41.96 38.07 1ynj s TYR 202 CO 0.00 -2.47 -0.20 0.16 -1.11 0.00 0.00 175.55 171.93 1ynj s ASP 203 N -0.78 3.68 0.35 2.29 -4.77 -1.26 -4.44 116.67 111.73 1ynj s ASP 203 Ca 0.62 -0.47 0.23 0.00 -3.30 0.00 0.00 52.55 49.63 1ynj s ASP 203 Cb -0.39 -0.54 1.21 0.00 -1.09 0.00 0.00 42.92 42.10 1ynj s ASP 203 CO 0.49 0.25 1.32 1.67 0.70 0.00 0.00 175.17 179.60 1ynj n GLN 204 N 1.53 -0.04 -0.01 2.11 -0.06 -1.26 -0.03 117.38 119.63 1ynj n GLN 204 Ca -0.16 1.10 -0.12 0.00 -2.00 0.00 0.00 57.00 55.81 1ynj n GLN 204 Cb 0.52 -2.08 -0.14 0.00 -4.06 0.00 0.00 30.24 24.48 1ynj n GLN 204 CO 0.00 0.00 0.00 1.05 -0.20 0.00 0.00 177.06 177.91 1ynj h GLU 205 N 0.00 0.08 -0.60 3.69 4.11 -2.01 -3.28 114.58 116.57 1ynj h GLU 205 Ca 0.73 -0.13 -0.02 0.00 0.07 0.00 0.00 59.36 60.01 1ynj h GLU 205 Cb 2.19 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 31.46 1ynj h GLU 205 CO -0.49 0.71 0.31 0.00 0.07 0.00 0.00 179.01 179.61 1ynj h THR 206 N 0.02 1.19 0.64 -1.06 1.03 -0.85 -2.09 112.91 111.79 1ynj h THR 206 Ca -0.31 -0.50 -0.03 0.00 -0.01 0.00 0.00 66.41 65.56 1ynj h THR 206 Cb 2.01 0.39 0.01 0.00 -1.07 0.00 0.00 68.15 69.49 1ynj h THR 206 CO 0.09 0.22 -0.31 -0.07 -0.01 0.00 0.00 175.52 175.43 1ynj h LEU 207 N 0.84 -0.73 -0.84 0.00 4.07 -1.51 -1.89 115.31 115.26 1ynj h LEU 207 Ca 0.21 -0.01 0.17 0.00 0.08 0.00 0.00 57.88 58.33 1ynj h LEU 207 Cb 0.05 0.19 -0.10 0.00 1.08 0.00 0.00 40.66 41.88 1ynj h LEU 207 CO -0.03 -0.37 0.39 -0.37 -1.08 0.00 0.00 178.44 176.97 1ynj h VAL 208 N -1.13 0.63 -0.87 1.22 -1.51 -1.61 0.47 116.25 113.46 1ynj h VAL 208 Ca -0.09 -0.17 0.17 0.00 -1.23 0.00 0.00 66.70 65.38 1ynj h VAL 208 Cb 0.70 0.08 -0.10 0.00 -2.13 0.00 0.00 31.29 29.84 1ynj h VAL 208 CO 0.14 0.09 0.44 -0.09 -1.23 0.00 0.00 177.57 176.93 1ynj h ARG 209 N 0.51 0.56 0.00 5.19 2.43 -1.23 -2.64 114.38 119.19 1ynj h ARG 209 Ca 0.48 -0.03 -0.24 0.00 -0.81 0.00 0.00 59.98 59.38 1ynj h ARG 209 Cb 0.76 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.15 1ynj h ARG 209 CO -0.42 0.37 -1.71 -1.91 -1.51 0.00 0.00 179.97 174.79 1ynj n GLU 210 N -4.91 0.64 -1.03 0.20 4.07 0.71 -4.59 120.64 115.73 1ynj n GLU 210 Ca 0.19 0.19 0.04 0.00 -0.06 0.00 0.00 57.16 57.52 1ynj n GLU 210 Cb 0.50 -1.74 0.08 0.00 -0.06 0.00 0.00 31.44 30.22 1ynj n GLU 210 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 1ynj n LEU 211 N -2.89 1.41 -4.79 4.31 7.94 0.13 -5.04 117.00 118.07 1ynj n LEU 211 Ca -0.16 -2.45 -0.31 0.00 -1.11 0.00 0.00 56.01 51.98 1ynj n LEU 211 Cb 0.95 -0.17 -0.06 0.00 0.53 0.00 0.00 43.42 44.67 1ynj n LEU 211 CO 0.44 0.72 -0.18 -0.55 -1.11 0.00 0.00 177.39 176.71 1ynj s SER 212 N -2.26 4.26 0.00 1.96 0.15 -1.01 -4.35 113.70 112.46 1ynj s SER 212 Ca 0.30 -1.53 0.00 0.00 0.70 0.00 0.00 55.95 55.42 1ynj s SER 212 Cb 0.32 0.45 0.00 0.00 -1.71 0.00 0.00 66.02 65.09 1ynj s SER 212 CO -0.11 -0.90 0.00 0.00 1.20 0.00 0.00 173.24 173.43 1ynj n ALA 213 N -1.38 0.00 -2.79 5.45 0.00 -1.26 -4.84 120.51 115.68 1ynj n ALA 213 Ca -0.14 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.86 1ynj n ALA 213 Cb 0.66 -0.42 -0.07 0.00 0.00 0.00 0.00 19.45 19.62 1ynj n ALA 213 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1ynj s TYR 214 N -0.83 3.17 0.08 0.00 -0.85 -1.26 -4.98 117.35 112.68 1ynj s TYR 214 Ca 0.00 -0.75 0.00 0.00 -0.52 0.00 0.00 57.07 55.80 1ynj s TYR 214 Cb 0.00 -3.25 0.00 0.00 0.38 0.00 0.00 41.96 39.09 1ynj s TYR 214 CO 0.00 -0.86 0.00 0.41 -1.52 0.00 0.00 175.55 173.58 1ynj n GLY 215 N 5.18 -2.81 1.70 5.49 0.00 -1.26 -4.45 105.19 109.04 1ynj n GLY 215 Ca -0.10 -1.34 -0.11 0.00 0.00 0.00 0.00 46.02 44.47 1ynj n GLY 215 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ynj n ASP 216 N -2.05 5.45 0.11 1.61 8.00 -1.26 -4.48 116.55 123.92 1ynj n ASP 216 Ca -0.01 -2.81 -0.23 0.00 0.71 0.00 0.00 54.79 52.46 1ynj n ASP 216 Cb 0.08 -0.96 -0.15 0.00 -0.02 0.00 0.00 41.12 40.06 1ynj n ASP 216 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1ynj h LEU 217 N 2.25 0.71 -0.84 0.64 3.38 -1.90 -3.22 115.31 116.32 1ynj h LEU 217 Ca 0.21 -0.93 0.12 0.00 0.09 0.00 0.00 57.88 57.38 1ynj h LEU 217 Cb 1.11 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.55 1ynj h LEU 217 CO 0.51 1.58 0.46 -0.37 0.09 0.00 0.00 178.44 180.71 1ynj h VAL 218 N -0.05 0.83 -1.33 1.22 -1.51 -1.79 -2.69 116.25 110.94 1ynj h VAL 218 Ca -0.21 -0.25 0.40 0.00 -1.23 0.00 0.00 66.70 65.42 1ynj h VAL 218 Cb 1.95 0.05 -0.10 0.00 -2.13 0.00 0.00 31.29 31.06 1ynj h VAL 218 CO 0.23 0.13 0.89 1.56 -1.23 0.00 0.00 177.57 179.15 1ynj h GLN 219 N 0.72 0.12 0.03 5.19 4.20 -1.90 0.29 115.11 123.76 1ynj h GLN 219 Ca 0.43 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 59.13 1ynj h GLN 219 Cb 0.49 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1ynj h GLN 219 CO -0.30 0.08 -0.02 0.78 -0.67 0.00 0.00 178.83 178.71 1ynj h GLY 220 N 0.13 -0.05 1.53 3.46 0.00 -1.66 -3.24 103.07 103.24 1ynj h GLY 220 Ca 0.75 0.02 0.00 0.00 0.00 0.00 0.00 47.33 48.09 1ynj h GLY 220 CO -0.27 -0.02 0.20 -2.00 0.00 0.00 0.00 176.54 174.45 1ynj h LEU 221 N -0.88 0.00 0.00 3.11 5.85 -0.56 -3.36 115.31 119.47 1ynj h LEU 221 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ynj h LEU 221 Cb 0.71 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.74 1ynj h LEU 221 CO 0.01 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.29 1ynj n LEU 222 N -2.50 0.00 0.00 2.25 4.32 0.07 -4.65 117.00 116.50 1ynj n LEU 222 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 1ynj n LEU 222 Cb 0.24 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.04 1ynj n LEU 222 CO 0.11 0.00 0.00 -0.67 -1.22 0.00 0.00 177.39 175.61 1ynj n ASP 223 N 0.00 0.00 -3.13 -1.43 -0.08 -1.24 -4.33 116.55 106.34 1ynj n ASP 223 Ca 0.00 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.13 1ynj n ASP 223 Cb 0.00 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.45 1ynj n ASP 223 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1ynj n GLU 224 N 0.00 1.29 -0.25 -0.67 4.07 -1.26 -4.38 120.64 119.44 1ynj n GLU 224 Ca 0.00 -1.12 0.04 0.00 -0.06 0.00 0.00 57.16 56.02 1ynj n GLU 224 Cb 0.00 -2.30 0.17 0.00 -0.06 0.00 0.00 31.44 29.24 1ynj n GLU 224 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ynj h ALA 225 N 7.01 1.02 -0.70 4.31 0.00 -1.95 0.47 119.26 129.42 1ynj h ALA 225 Ca 0.31 0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.45 1ynj h ALA 225 Cb 0.12 0.04 -0.13 0.00 0.00 0.00 0.00 17.79 17.82 1ynj h ALA 225 CO 1.31 -0.15 -0.17 0.28 0.00 0.00 0.00 179.25 180.51 1ynj h VAL 226 N 0.50 0.30 -2.12 0.00 2.07 -1.96 -1.47 116.25 113.58 1ynj h VAL 226 Ca 0.39 0.00 -0.61 0.00 0.82 0.00 0.00 66.70 67.30 1ynj h VAL 226 Cb 0.52 0.30 -0.41 0.00 -1.52 0.00 0.00 31.29 30.19 1ynj h VAL 226 CO -0.35 0.00 -0.51 0.18 0.02 0.00 0.00 177.57 176.91 1ynj n LEU 227 N -5.47 4.80 -3.37 2.57 7.99 -0.74 -4.54 117.00 118.24 1ynj n LEU 227 Ca 0.09 -5.55 -0.34 0.00 -0.01 0.00 0.00 56.01 50.19 1ynj n LEU 227 Cb 0.36 -0.59 -0.01 0.00 -0.11 0.00 0.00 43.42 43.06 1ynj n LEU 227 CO 0.02 2.30 0.80 0.00 -1.51 0.00 0.00 177.39 178.99 1ynj n ALA 228 N -0.29 5.30 -2.54 -1.18 0.00 0.08 -4.63 120.51 117.25 1ynj n ALA 228 Ca 0.34 -4.68 0.00 0.00 0.00 0.00 0.00 53.44 49.10 1ynj n ALA 228 Cb 0.44 -1.52 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1ynj n ALA 228 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1ynj n MET 229 N 0.04 3.75 -2.47 0.00 2.00 -1.26 -4.88 117.12 114.31 1ynj n MET 229 Ca 0.38 0.00 -0.42 0.00 0.00 0.00 0.00 57.70 57.65 1ynj n MET 229 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 33.22 33.53 1ynj n MET 229 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 1ynj s ARG 230 N 3.44 3.50 0.59 0.03 3.52 -1.26 -4.89 118.95 123.88 1ynj s ARG 230 Ca 0.00 0.55 0.35 0.00 -0.13 0.00 0.00 55.73 56.50 1ynj s ARG 230 Cb 0.00 -4.03 1.27 0.00 -1.56 0.00 0.00 34.95 30.63 1ynj s ARG 230 CO 0.00 -1.67 1.47 -1.35 -0.81 0.00 0.00 175.30 172.94 1ynj h PRO 231 N 10.26 0.00 -0.07 5.12 0.11 -1.91 1.39 132.00 146.90 1ynj h PRO 231 Ca -0.26 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.78 1ynj h PRO 231 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ynj h PRO 231 CO 1.15 0.00 -0.26 1.49 -0.21 0.00 0.00 178.00 180.17 1ynj h GLU 232 N 0.00 0.29 -0.67 1.05 4.81 -1.90 -2.79 114.58 115.37 1ynj h GLU 232 Ca 0.61 -0.23 -0.06 0.00 -0.13 0.00 0.00 59.36 59.56 1ynj h GLU 232 Cb 3.00 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 32.39 1ynj h GLU 232 CO -0.01 0.86 0.19 0.93 -0.73 0.00 0.00 179.01 180.26 1ynj h GLU 233 N -0.21 1.04 -0.41 1.92 4.39 0.14 -1.46 114.58 119.99 1ynj h GLU 233 Ca -0.01 -0.22 0.09 0.00 0.34 0.00 0.00 59.36 59.55 1ynj h GLU 233 Cb 0.90 -0.15 -0.09 0.00 -0.10 0.00 0.00 28.75 29.31 1ynj h GLU 233 CO 0.05 0.90 -0.22 0.00 -1.16 0.00 0.00 179.01 178.59 1ynj h ALA 234 N 1.21 0.07 -0.71 3.43 0.00 -1.27 -1.28 119.26 120.70 1ynj h ALA 234 Ca 0.22 0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.33 1ynj h ALA 234 Cb 0.31 0.52 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 1ynj h ALA 234 CO -0.00 -0.58 0.41 1.98 0.00 0.00 0.00 179.25 181.05 1ynj h MET 235 N -0.14 0.72 0.40 0.00 -1.53 -1.00 -0.83 114.93 112.55 1ynj h MET 235 Ca 0.20 -0.04 -0.02 0.00 -3.44 0.00 0.00 59.70 56.40 1ynj h MET 235 Cb 0.45 -0.16 0.00 0.00 -0.55 0.00 0.00 31.60 31.34 1ynj h MET 235 CO -0.50 0.48 -0.19 0.28 0.14 0.00 0.00 176.91 177.12 1ynj h VAL 236 N 0.74 0.61 -0.96 -5.77 2.07 -0.88 -1.27 116.25 110.79 1ynj h VAL 236 Ca 0.32 -0.05 0.07 0.00 0.82 0.00 0.00 66.70 67.85 1ynj h VAL 236 Cb 0.19 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.53 1ynj h VAL 236 CO -0.18 0.01 0.61 0.03 0.02 0.00 0.00 177.57 178.06 1ynj h ARG 237 N -0.56 1.07 -0.29 1.57 2.47 -0.70 -0.54 114.38 117.39 1ynj h ARG 237 Ca -0.05 -0.06 -0.13 0.00 -1.26 0.00 0.00 59.98 58.47 1ynj h ARG 237 Cb 0.43 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.49 1ynj h ARG 237 CO 0.09 0.71 -0.34 1.25 0.56 0.00 0.00 179.97 182.24 1ynj h LEU 238 N 1.10 0.68 -0.51 3.04 5.85 -1.06 -0.89 115.31 123.52 1ynj h LEU 238 Ca 0.42 -0.28 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1ynj h LEU 238 Cb 0.20 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1ynj h LEU 238 CO -0.18 0.97 0.05 0.15 -0.34 0.00 0.00 178.44 179.08 1ynj h PHE 239 N 0.55 0.94 -0.63 1.25 3.57 -0.18 -0.49 116.94 121.94 1ynj h PHE 239 Ca 0.06 -0.14 0.05 0.00 3.53 0.00 0.00 57.97 61.46 1ynj h PHE 239 Cb 0.85 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 1ynj h PHE 239 CO 0.04 0.86 0.42 1.15 -2.23 0.00 0.00 178.31 178.55 1ynj h THR 240 N 0.75 1.04 -0.03 4.41 2.02 -0.98 -1.14 112.91 118.98 1ynj h THR 240 Ca 0.15 -0.23 -0.17 0.00 0.77 0.00 0.00 66.41 66.92 1ynj h THR 240 Cb 0.45 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1ynj h THR 240 CO 0.02 0.12 -0.76 -0.07 0.37 0.00 0.00 175.52 175.20 1ynj h LEU 241 N 0.68 0.24 0.04 2.58 3.38 -0.77 -3.17 115.31 118.30 1ynj h LEU 241 Ca 0.27 -0.17 -0.29 0.00 0.09 0.00 0.00 57.88 57.77 1ynj h LEU 241 Cb 0.19 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1ynj h LEU 241 CO -0.08 0.91 -1.62 -0.07 0.09 0.00 0.00 178.44 177.67 1ynj h LEU 242 N 0.12 0.15 -6.70 1.67 4.07 -0.77 -3.42 115.31 110.43 1ynj h LEU 242 Ca -0.03 -0.26 -0.59 0.00 0.08 0.00 0.00 57.88 57.08 1ynj h LEU 242 Cb 1.33 -0.05 -0.39 0.00 1.08 0.00 0.00 40.66 42.63 1ynj h LEU 242 CO 0.11 1.23 -0.82 -0.13 -1.08 0.00 0.00 178.44 177.75 1ynj s ARG 243 N -2.61 0.98 -0.08 1.13 1.81 -0.46 -5.10 118.95 114.61 1ynj s ARG 243 Ca -0.07 -1.83 -0.34 0.00 -1.72 0.00 0.00 55.73 51.76 1ynj s ARG 243 Cb 0.08 -1.79 -0.12 0.00 -0.45 0.00 0.00 34.95 32.67 1ynj s ARG 243 CO 0.82 -1.24 1.87 -2.30 -0.68 0.00 0.00 175.30 173.78 1ynj n PRO 244 N 3.51 2.18 0.00 3.54 -0.02 -1.20 -4.13 135.00 138.89 1ynj n PRO 244 Ca 0.15 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 1ynj n PRO 244 Cb 0.38 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.22 1ynj n PRO 244 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ynj n GLY 245 N 4.38 0.37 3.61 -1.23 0.00 -1.26 -5.10 105.19 105.96 1ynj n GLY 245 Ca 0.22 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1ynj n GLY 245 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ynj s ASP 246 N -2.57 6.70 -0.60 1.61 -4.77 -1.26 -5.00 116.67 110.77 1ynj s ASP 246 Ca 0.00 0.66 0.01 0.00 -3.30 0.00 0.00 52.55 49.91 1ynj s ASP 246 Cb 0.00 -2.44 0.43 0.00 -1.09 0.00 0.00 42.92 39.82 1ynj s ASP 246 CO 0.00 -0.75 1.77 -0.81 0.70 0.00 0.00 175.17 176.08 1ynj n PRO 247 N 6.51 2.97 -1.49 2.11 -0.05 -1.26 -4.69 135.00 139.10 1ynj n PRO 247 Ca 0.06 -3.64 -0.07 0.00 -0.05 0.00 0.00 63.50 59.81 1ynj n PRO 247 Cb 0.48 -2.28 0.03 0.00 -0.05 0.00 0.00 33.50 31.68 1ynj n PRO 247 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 175.50 175.10 1ynj n PRO 248 N -0.76 0.68 -0.03 0.54 -0.04 -1.26 -5.04 135.00 129.09 1ynj n PRO 248 Ca 0.55 -0.96 0.12 0.00 -0.04 0.00 0.00 63.50 63.17 1ynj n PRO 248 Cb 0.65 -0.13 0.23 0.00 -0.04 0.00 0.00 33.50 34.20 1ynj n PRO 248 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1ynj n LYS 249 N -1.48 2.17 -1.66 0.54 0.00 -1.26 -4.35 118.16 112.11 1ynj n LYS 249 Ca 0.05 -1.71 -0.40 0.00 -0.00 0.00 0.00 58.31 56.25 1ynj n LYS 249 Cb 0.19 -1.47 -0.02 0.00 -0.00 0.00 0.00 35.03 33.74 1ynj n LYS 249 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1ynj n LYS 250 N 1.04 3.98 0.04 -1.58 4.76 -1.26 -4.23 118.16 120.92 1ynj n LYS 250 Ca 0.16 -2.79 0.11 0.00 -2.87 0.00 0.00 58.31 52.92 1ynj n LYS 250 Cb 0.53 -2.78 -0.05 0.00 -1.84 0.00 0.00 35.03 30.89 1ynj n LYS 250 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1ynj n ASP 251 N 3.08 0.51 -0.32 4.39 8.00 -1.26 -3.46 116.55 127.49 1ynj n ASP 251 Ca 0.68 0.01 0.20 0.00 0.71 0.00 0.00 54.79 56.40 1ynj n ASP 251 Cb 0.26 1.07 0.46 0.00 -0.02 0.00 0.00 41.12 42.89 1ynj n ASP 251 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1ynj h LYS 252 N 0.00 0.47 -0.05 -1.24 3.11 -1.92 -1.77 116.57 115.16 1ynj h LYS 252 Ca 0.00 -0.03 0.01 0.00 -2.81 0.00 0.00 60.65 57.82 1ynj h LYS 252 Cb 0.90 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 32.02 1ynj h LYS 252 CO 0.00 0.31 -0.05 0.00 -2.81 0.00 0.00 179.45 176.90 1ynj h ALA 253 N 1.64 -0.24 -0.17 5.00 0.00 -1.91 0.28 119.26 123.85 1ynj h ALA 253 Ca 0.58 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 55.32 1ynj h ALA 253 Cb 1.32 0.84 0.01 0.00 0.00 0.00 0.00 17.79 19.95 1ynj h ALA 253 CO -0.31 -0.27 -0.57 1.25 0.00 0.00 0.00 179.25 179.35 1ynj h LEU 254 N -0.02 0.79 -1.17 0.00 5.85 -1.77 -3.12 115.31 115.87 1ynj h LEU 254 Ca 0.01 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.13 1ynj h LEU 254 Cb 0.05 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.85 1ynj h LEU 254 CO -0.06 1.26 0.00 0.00 -0.34 0.00 0.00 178.44 179.29 1ynj n ALA 255 N -2.56 1.14 0.17 1.25 0.00 -0.67 0.94 120.51 120.77 1ynj n ALA 255 Ca -0.07 0.16 0.05 0.00 0.00 0.00 0.00 53.44 53.58 1ynj n ALA 255 Cb 0.63 -1.29 0.16 0.00 0.00 0.00 0.00 19.45 18.95 1ynj n ALA 255 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1ynj h TYR 256 N 0.00 0.00 0.15 0.00 3.20 -0.38 -3.29 116.97 116.65 1ynj h TYR 256 Ca 0.00 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1ynj h TYR 256 Cb 0.06 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.33 1ynj h TYR 256 CO 0.00 0.40 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.78 1ynj h LEU 257 N 0.00 -0.17 -3.09 2.82 3.38 0.45 -2.91 115.31 115.80 1ynj h LEU 257 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ynj h LEU 257 Cb 1.18 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1ynj h LEU 257 CO 0.05 -0.10 0.00 0.49 0.09 0.00 0.00 178.44 178.98 1ynj n PHE 258 N -2.65 0.00 0.00 1.13 3.01 -1.23 -4.20 117.46 113.52 1ynj n PHE 258 Ca -0.02 -0.64 0.00 0.00 1.01 0.00 0.00 57.45 57.80 1ynj n PHE 258 Cb 0.08 -0.39 0.00 0.00 -0.01 0.00 0.00 39.48 39.16 1ynj n PHE 258 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ynj n GLY 259 N 1.48 3.15 4.00 1.37 0.00 -1.20 -4.91 105.19 109.08 1ynj n GLY 259 Ca 0.00 -0.42 -0.22 0.00 0.00 0.00 0.00 46.02 45.38 1ynj n GLY 259 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ynj s LEU 260 N 0.00 3.08 0.00 0.99 2.34 -1.10 -4.08 118.68 119.91 1ynj s LEU 260 Ca 0.00 -0.43 0.00 0.00 0.06 0.00 0.00 54.13 53.76 1ynj s LEU 260 Cb 0.00 -2.06 0.00 0.00 -0.56 0.00 0.00 46.19 43.57 1ynj s LEU 260 CO 0.00 -1.59 0.00 0.00 -1.06 0.00 0.00 176.35 173.70 1ynj n LEU 261 N -2.58 0.00 -1.49 1.48 -0.00 -1.26 -4.60 117.00 108.55 1ynj n LEU 261 Ca 0.14 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 56.08 1ynj n LEU 261 Cb 0.61 0.69 0.03 0.00 -0.00 0.00 0.00 43.42 44.74 1ynj n LEU 261 CO 0.42 0.00 0.91 0.00 -0.00 0.00 0.00 177.39 178.72 1ynj n ALA 262 N -1.45 3.91 -0.48 1.47 0.00 -1.26 -4.06 120.51 118.64 1ynj n ALA 262 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1ynj n ALA 262 Cb 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1ynj n ALA 262 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ynj n ASP 263 N 0.63 0.00 0.00 0.00 -0.08 -1.26 -4.91 116.55 110.93 1ynj n ASP 263 Ca 0.13 0.27 0.00 0.00 -1.51 0.00 0.00 54.79 53.68 1ynj n ASP 263 Cb 0.62 -0.26 0.00 0.00 2.34 0.00 0.00 41.12 43.83 1ynj n ASP 263 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1ynj n PRO 264 N -1.28 0.00 -1.00 -0.67 -0.05 -1.26 -4.72 135.00 126.02 1ynj n PRO 264 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 63.50 63.34 1ynj n PRO 264 Cb 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 33.50 33.33 1ynj n PRO 264 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 175.50 176.62 1ynj n LYS 265 N 0.00 0.00 -2.64 0.54 3.00 -1.23 -4.26 118.16 113.57 1ynj n LYS 265 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.04 1ynj n LYS 265 Cb 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 35.03 34.28 1ynj n LYS 265 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1ynj n ARG 266 N 3.84 3.37 0.00 1.64 3.00 -0.39 -4.41 116.66 123.71 1ynj n ARG 266 Ca 0.35 -4.63 0.00 0.00 -0.01 0.00 0.00 57.85 53.56 1ynj n ARG 266 Cb 0.18 -2.25 0.00 0.00 0.00 0.00 0.00 32.46 30.39 1ynj n ARG 266 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1ynj n TYR 267 N -0.39 0.00 0.00 -1.55 4.01 -1.25 -4.42 117.16 113.55 1ynj n TYR 267 Ca 0.36 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.10 1ynj n TYR 267 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 1ynj n TYR 267 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1ynj n ASP 268 N -0.10 0.00 0.18 7.72 5.75 -1.26 -3.01 116.55 125.83 1ynj n ASP 268 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 54.79 54.81 1ynj n ASP 268 Cb 0.00 0.00 0.34 0.00 -1.03 0.00 0.00 41.12 40.43 1ynj n ASP 268 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1ynj h LEU 269 N 0.00 0.00 0.00 -2.12 3.38 -1.91 -3.43 115.31 111.23 1ynj h LEU 269 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ynj h LEU 269 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1ynj h LEU 269 CO 0.00 0.41 0.00 0.61 0.09 0.00 0.00 178.44 179.55 1ynj n GLY 270 N -0.16 -0.14 0.00 0.83 0.00 -1.26 -4.89 105.19 99.55 1ynj n GLY 270 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1ynj n GLY 270 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ynj n GLU 271 N 0.00 0.64 0.00 1.61 -0.58 -1.26 -4.89 120.64 116.16 1ynj n GLU 271 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1ynj n GLU 271 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1ynj n GLU 271 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ynj n ALA 272 N -3.00 1.38 -0.00 0.62 0.00 -1.26 -1.42 120.51 116.83 1ynj n ALA 272 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ynj n ALA 272 Cb 0.00 -0.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.53 1ynj n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ynj n GLY 273 N -0.89 -0.53 0.37 0.00 0.00 -1.16 -4.04 105.19 98.94 1ynj n GLY 273 Ca 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1ynj n GLY 273 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1ynj h ARG 274 N -0.04 -0.27 -0.33 1.61 -0.00 -1.67 -0.36 114.38 113.32 1ynj h ARG 274 Ca 0.00 0.02 0.04 0.00 -0.00 0.00 0.00 59.98 60.04 1ynj h ARG 274 Cb 0.03 0.06 -0.07 0.00 -0.00 0.00 0.00 29.97 29.99 1ynj h ARG 274 CO 0.00 -0.18 -0.52 -0.92 -0.00 0.00 0.00 179.97 178.35 1ynj h TYR 275 N -0.29 -1.59 0.00 4.08 -0.00 -1.49 -0.17 116.97 117.52 1ynj h TYR 275 Ca 0.16 0.07 0.00 0.00 -0.00 0.00 0.00 58.73 58.96 1ynj h TYR 275 Cb 0.57 0.74 0.00 0.00 -0.00 0.00 0.00 36.73 38.03 1ynj h TYR 275 CO -0.60 -0.47 0.00 0.87 -0.00 0.00 0.00 178.16 177.96 1ynj h LYS 276 N -0.41 0.00 0.00 1.82 1.57 -1.65 -2.31 116.57 115.59 1ynj h LYS 276 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1ynj h LYS 276 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1ynj h LYS 276 CO -0.53 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.35 1ynj h ALA 277 N 2.17 1.00 0.00 3.86 0.00 0.04 -3.08 119.26 123.25 1ynj h ALA 277 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ynj h ALA 277 Cb 0.66 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ynj h ALA 277 CO 0.00 0.00 -0.02 0.93 0.00 0.00 0.00 179.25 180.16 1ynj h GLU 278 N 0.00 0.00 0.40 0.00 5.08 -0.50 -2.94 114.58 116.62 1ynj h GLU 278 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1ynj h GLU 278 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1ynj h GLU 278 CO 0.00 0.56 -0.19 1.49 -1.00 0.00 0.00 179.01 179.87 1ynj h GLU 279 N -1.00 -0.51 0.55 2.33 4.57 -1.61 -1.57 114.58 117.34 1ynj h GLU 279 Ca -0.00 0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.19 1ynj h GLU 279 Cb 0.57 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.27 1ynj h GLU 279 CO -0.00 -0.28 -0.36 0.87 -1.18 0.00 0.00 179.01 178.06 1ynj h LYS 280 N -0.65 -0.83 0.00 1.92 1.79 -1.76 -3.45 116.57 113.58 1ynj h LYS 280 Ca -0.05 0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ynj h LYS 280 Cb 0.48 0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 1ynj h LYS 280 CO 0.09 -0.56 0.00 -0.11 -1.08 0.00 0.00 179.45 177.79 1ynj n LEU 281 N -4.65 0.00 -3.34 2.94 7.94 -1.11 -4.91 117.00 113.87 1ynj n LEU 281 Ca -0.11 0.00 -0.38 0.00 -1.11 0.00 0.00 56.01 54.41 1ynj n LEU 281 Cb 0.36 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.30 1ynj n LEU 281 CO 0.24 -0.46 2.44 0.61 -1.11 0.00 0.00 177.39 179.11 1ynj n GLY 282 N 3.26 4.98 0.12 -3.96 0.00 -1.26 -4.79 105.19 103.54 1ynj n GLY 282 Ca 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.07 1ynj n GLY 282 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ynj n VAL 283 N 1.88 0.00 -2.56 1.61 0.31 -0.60 -4.97 118.33 114.00 1ynj n VAL 283 Ca 0.63 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.94 1ynj n VAL 283 Cb 0.28 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.20 1ynj n VAL 283 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ynj n GLY 284 N -0.84 -4.49 3.28 2.92 0.00 -1.26 -4.91 105.19 99.89 1ynj n GLY 284 Ca 0.00 0.80 -0.10 0.00 0.00 0.00 0.00 46.02 46.72 1ynj n GLY 284 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ynj s LEU 285 N -1.19 1.17 0.00 0.99 1.43 -1.26 -5.06 118.68 114.75 1ynj s LEU 285 Ca -0.09 -1.09 0.00 0.00 -1.03 0.00 0.00 54.13 51.92 1ynj s LEU 285 Cb 0.01 0.82 0.00 0.00 0.03 0.00 0.00 46.19 47.04 1ynj s LEU 285 CO 0.71 -0.86 0.00 -1.20 0.23 0.00 0.00 176.35 175.23 1ynj n SER 286 N -0.21 0.00 0.00 2.29 7.64 -1.26 -5.09 113.62 116.99 1ynj n SER 286 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1ynj n SER 286 Cb 0.64 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1ynj n SER 286 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ynj n GLY 287 N 2.89 0.00 3.20 0.23 0.00 -1.26 -4.74 105.19 105.51 1ynj n GLY 287 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1ynj n GLY 287 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ynj s ARG 288 N 0.00 1.20 -0.52 1.61 1.04 -1.26 -3.96 118.95 117.06 1ynj s ARG 288 Ca 0.00 -0.85 -0.26 0.00 -1.04 0.00 0.00 55.73 53.58 1ynj s ARG 288 Cb 0.00 -1.27 -0.08 0.00 -2.04 0.00 0.00 34.95 31.56 1ynj s ARG 288 CO 0.00 0.32 2.42 2.41 -0.04 0.00 0.00 175.30 180.41 1ynj n THR 289 N 1.91 -0.08 -0.99 4.99 -1.04 -1.26 -4.61 114.28 113.20 1ynj n THR 289 Ca -0.17 -0.78 0.05 0.00 -2.04 0.00 0.00 64.05 61.11 1ynj n THR 289 Cb 0.54 -2.73 -0.03 0.00 -1.82 0.00 0.00 70.33 66.29 1ynj n THR 289 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ynj n LEU 290 N 16.17 -0.91 -4.32 -4.42 -0.00 -1.26 -4.14 117.00 118.12 1ynj n LEU 290 Ca 0.38 1.74 -0.32 0.00 -0.00 0.00 0.00 56.01 57.82 1ynj n LEU 290 Cb 0.54 -1.83 -0.16 0.00 -0.00 0.00 0.00 43.42 41.97 1ynj n LEU 290 CO 0.70 -0.92 -0.54 -0.69 -0.00 0.00 0.00 177.39 175.94 1ynj s VAL 291 N -4.46 2.29 0.00 1.47 1.01 -0.23 -3.59 120.40 116.89 1ynj s VAL 291 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.98 1ynj s VAL 291 Cb 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.54 1ynj s VAL 291 CO 0.00 0.57 0.00 -2.11 0.00 0.00 0.00 175.10 173.56 1ynj n ARG 292 N 2.73 0.00 -0.31 2.72 0.00 -1.26 0.20 116.66 120.74 1ynj n ARG 292 Ca -0.17 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.61 1ynj n ARG 292 Cb 0.52 0.00 -0.02 0.00 -0.00 0.00 0.00 32.46 32.96 1ynj n ARG 292 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1ynj n PHE 293 N 0.00 0.00 -0.09 2.89 7.35 -1.26 -3.89 117.46 122.46 1ynj n PHE 293 Ca 0.00 -0.31 -0.12 0.00 -0.76 0.00 0.00 57.45 56.26 1ynj n PHE 293 Cb 0.00 -0.50 0.01 0.00 0.35 0.00 0.00 39.48 39.33 1ynj n PHE 293 CO 0.00 0.00 0.00 1.05 -0.76 0.00 0.00 176.76 177.05 1ynj h GLU 294 N 7.32 0.85 0.00 -4.13 4.11 -1.83 -3.43 114.58 117.47 1ynj h GLU 294 Ca 0.04 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 59.01 1ynj h GLU 294 Cb 0.15 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1ynj h GLU 294 CO 0.81 1.10 0.00 -0.40 0.07 0.00 0.00 179.01 180.59 1ynj n ASP 295 N -4.05 0.00 0.00 3.06 5.75 -1.26 -4.96 116.55 115.09 1ynj n ASP 295 Ca -0.02 -0.46 0.00 0.00 -0.01 0.00 0.00 54.79 54.30 1ynj n ASP 295 Cb 0.55 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 1ynj n ASP 295 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ynj n GLY 296 N 0.00 0.00 3.44 6.12 0.00 -1.26 -5.16 105.19 108.34 1ynj n GLY 296 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1ynj n GLY 296 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ynj s GLU 297 N 0.00 0.67 0.50 1.61 -1.05 -1.26 -5.02 118.70 114.15 1ynj s GLU 297 Ca 0.00 0.68 -0.22 0.00 -0.15 0.00 0.00 54.97 55.28 1ynj s GLU 297 Cb 0.00 0.32 -0.06 0.00 -0.44 0.00 0.00 34.13 33.95 1ynj s GLU 297 CO 0.00 -0.10 1.24 -0.06 0.95 0.00 0.00 175.26 177.29 1ynj s PHE 298 N 0.10 2.63 -0.22 4.83 0.40 -1.25 -3.76 117.98 120.72 1ynj s PHE 298 Ca -0.01 1.47 -0.00 0.00 -0.60 0.00 0.00 56.93 57.78 1ynj s PHE 298 Cb -0.04 -3.54 0.06 0.00 0.51 0.00 0.00 43.02 40.01 1ynj s PHE 298 CO 0.02 -2.07 -0.03 -1.59 0.70 0.00 0.00 175.22 172.25 1ynj s LYS 299 N -2.81 1.34 0.43 0.44 -2.85 0.54 -4.80 119.74 112.02 1ynj s LYS 299 Ca 0.67 -0.79 -0.24 0.00 -1.00 0.00 0.00 55.97 54.62 1ynj s LYS 299 Cb -0.33 -2.40 -0.10 0.00 -2.06 0.00 0.00 37.83 32.93 1ynj s LYS 299 CO 0.40 -0.59 1.00 -3.47 0.10 0.00 0.00 175.35 172.78 1ynj n ASP 300 N 4.80 1.22 0.00 0.03 4.64 -1.26 -1.07 116.55 124.90 1ynj n ASP 300 Ca -0.11 1.02 0.00 0.00 -1.38 0.00 0.00 54.79 54.32 1ynj n ASP 300 Cb 0.45 -1.35 0.00 0.00 -1.04 0.00 0.00 41.12 39.18 1ynj n ASP 300 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 1ynj n GLU 301 N 0.11 3.39 0.00 -0.67 -0.58 -1.26 -4.78 120.64 116.84 1ynj n GLU 301 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1ynj n GLU 301 Cb 0.39 -0.28 0.00 0.00 -0.57 0.00 0.00 31.44 30.98 1ynj n GLU 301 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1ynj n VAL 302 N 0.00 0.00 0.47 2.62 0.31 -1.26 -4.80 118.33 115.67 1ynj n VAL 302 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.14 1ynj n VAL 302 Cb 0.00 -0.02 -0.09 0.00 -0.91 0.00 0.00 33.84 32.82 1ynj n VAL 302 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1ynj h PHE 303 N 0.00 -1.11 0.74 3.52 -1.00 -1.95 -1.95 116.94 115.19 1ynj h PHE 303 Ca 0.00 -0.03 -0.03 0.00 2.81 0.00 0.00 57.97 60.72 1ynj h PHE 303 Cb 0.02 0.37 -0.00 0.00 3.61 0.00 0.00 35.95 39.94 1ynj h PHE 303 CO 0.00 -0.69 -0.47 1.25 -1.61 0.00 0.00 178.31 176.79 1ynj h LEU 304 N -1.26 -1.20 -1.92 1.54 5.85 -1.96 -1.84 115.31 114.52 1ynj h LEU 304 Ca -0.12 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.71 1ynj h LEU 304 Cb 0.93 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1ynj h LEU 304 CO 0.20 -0.72 0.40 1.55 -0.34 0.00 0.00 178.44 179.53 1ynj h PRO 305 N -1.14 0.00 0.34 5.25 0.13 -1.91 0.25 132.00 134.93 1ynj h PRO 305 Ca -0.10 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.01 1ynj h PRO 305 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1ynj h PRO 305 CO 0.09 0.00 -0.16 1.15 -0.23 0.00 0.00 178.00 178.85 1ynj h THR 306 N 0.00 0.00 -0.98 1.56 2.02 -1.00 -3.17 112.91 111.34 1ynj h THR 306 Ca 0.07 -0.66 0.32 0.00 0.77 0.00 0.00 66.41 66.90 1ynj h THR 306 Cb 0.86 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 67.09 1ynj h THR 306 CO -0.00 0.00 0.22 -0.11 0.37 0.00 0.00 175.52 176.00 1ynj n LEU 307 N -5.08 0.06 -0.05 2.58 7.94 0.66 -0.11 117.00 123.01 1ynj n LEU 307 Ca -0.06 1.64 -0.13 0.00 -1.11 0.00 0.00 56.01 56.36 1ynj n LEU 307 Cb 0.18 -0.68 -0.09 0.00 0.53 0.00 0.00 43.42 43.37 1ynj n LEU 307 CO 0.14 -1.73 0.50 -0.09 -1.11 0.00 0.00 177.39 175.10 1ynj h ARG 308 N 0.00 -0.43 0.00 1.96 2.43 -0.97 0.34 114.38 117.72 1ynj h ARG 308 Ca 0.68 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.87 1ynj h ARG 308 Cb 1.60 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 31.25 1ynj h ARG 308 CO -0.85 -0.28 -0.05 -0.92 -1.51 0.00 0.00 179.97 176.36 1ynj h TYR 309 N -0.44 0.00 -0.03 2.20 5.03 -0.48 0.78 116.97 124.02 1ynj h TYR 309 Ca 0.04 0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.26 1ynj h TYR 309 Cb 0.56 0.00 0.01 0.00 1.55 0.00 0.00 36.73 38.84 1ynj h TYR 309 CO -0.62 0.05 -0.33 1.25 -1.32 0.00 0.00 178.16 177.18 1ynj h LEU 310 N 0.00 0.35 -0.26 2.82 5.85 0.13 -2.71 115.31 121.49 1ynj h LEU 310 Ca -0.00 -0.71 -0.08 0.00 0.84 0.00 0.00 57.88 57.94 1ynj h LEU 310 Cb 0.22 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1ynj h LEU 310 CO 0.01 1.01 -0.13 -0.26 -0.34 0.00 0.00 178.44 178.72 1ynj h PHE 311 N -0.27 0.64 0.00 1.25 0.05 0.33 -2.91 116.94 116.03 1ynj h PHE 311 Ca -0.03 -0.16 0.00 0.00 3.82 0.00 0.00 57.97 61.60 1ynj h PHE 311 Cb 1.03 -0.15 0.00 0.00 2.00 0.00 0.00 35.95 38.83 1ynj h PHE 311 CO 0.15 0.81 0.00 0.00 -0.18 0.00 0.00 178.31 179.08 1ynj n ALA 312 N -2.43 1.76 -0.02 2.45 0.00 0.26 -0.05 120.51 122.49 1ynj n ALA 312 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1ynj n ALA 312 Cb 0.36 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1ynj n ALA 312 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ynj n LEU 313 N 0.25 0.01 -1.23 0.00 7.94 -1.02 -4.21 117.00 118.75 1ynj n LEU 313 Ca 0.00 -0.20 0.07 0.00 -1.11 0.00 0.00 56.01 54.76 1ynj n LEU 313 Cb 0.13 0.00 0.26 0.00 0.53 0.00 0.00 43.42 44.34 1ynj n LEU 313 CO 0.00 0.00 0.69 0.41 -1.11 0.00 0.00 177.39 177.39 1ynj n THR 314 N -0.38 1.32 0.00 1.96 -1.04 0.93 -4.74 114.28 112.33 1ynj n THR 314 Ca 0.00 -0.84 0.00 0.00 -2.04 0.00 0.00 64.05 61.17 1ynj n THR 314 Cb 0.00 0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.52 1ynj n THR 314 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ynj n ALA 315 N 0.75 0.00 -1.87 2.41 0.00 -1.23 -4.96 120.51 115.61 1ynj n ALA 315 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1ynj n ALA 315 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.13 1ynj n ALA 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ynj n GLY 316 N -1.06 -3.92 3.73 0.00 0.00 -1.26 -4.93 105.19 97.75 1ynj n GLY 316 Ca 0.00 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 1ynj n GLY 316 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ynj s VAL 317 N -1.53 2.07 0.53 1.61 -7.23 -1.26 -4.90 120.40 109.69 1ynj s VAL 317 Ca 0.00 0.05 -0.21 0.00 -1.81 0.00 0.00 61.98 60.00 1ynj s VAL 317 Cb 0.00 -3.01 -0.07 0.00 0.56 0.00 0.00 36.38 33.86 1ynj s VAL 317 CO 0.00 -0.01 1.11 -2.65 -0.31 0.00 0.00 175.10 173.24 1ynj n PRO 318 N -1.89 1.32 0.00 4.82 -0.02 -1.26 -2.62 135.00 135.35 1ynj n PRO 318 Ca 0.16 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1ynj n PRO 318 Cb 0.48 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1ynj n PRO 318 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ynj n GLY 319 N 1.07 2.87 2.80 -1.23 0.00 -1.26 -4.98 105.19 104.46 1ynj n GLY 319 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1ynj n GLY 319 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ynj n HIS 320 N -1.32 2.81 -2.04 1.61 8.25 -1.08 -5.04 115.22 118.41 1ynj n HIS 320 Ca 0.00 -3.00 -0.28 0.00 -0.26 0.00 0.00 57.72 54.18 1ynj n HIS 320 Cb 0.00 -1.03 0.13 0.00 1.12 0.00 0.00 29.99 30.20 1ynj n HIS 320 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1ynj s GLU 321 N -3.23 1.40 0.75 -0.41 2.02 -1.26 -4.54 118.70 113.43 1ynj s GLU 321 Ca 0.37 -0.31 -0.13 0.00 0.02 0.00 0.00 54.97 54.92 1ynj s GLU 321 Cb 0.13 -1.98 0.18 0.00 0.10 0.00 0.00 34.13 32.55 1ynj s GLU 321 CO 0.00 -1.87 0.83 0.28 0.02 0.00 0.00 175.26 174.52 1ynj n VAL 322 N -3.39 0.00 -4.82 2.63 0.31 -1.26 -5.00 118.33 106.80 1ynj n VAL 322 Ca 0.12 -0.51 -0.26 0.00 -0.01 0.00 0.00 64.34 63.68 1ynj n VAL 322 Cb 0.60 -1.43 -0.16 0.00 -0.91 0.00 0.00 33.84 31.94 1ynj n VAL 322 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ynj s ASP 323 N -3.94 2.12 -1.10 4.52 -1.08 -1.26 -5.02 116.67 110.91 1ynj s ASP 323 Ca 0.50 -0.35 -0.21 0.00 -0.52 0.00 0.00 52.55 51.97 1ynj s ASP 323 Cb -0.03 -0.58 0.06 0.00 -1.46 0.00 0.00 42.92 40.91 1ynj s ASP 323 CO 0.36 0.15 1.53 -0.62 0.52 0.00 0.00 175.17 177.11 1ynj s ASP 324 N 0.03 6.61 0.67 -0.34 -1.08 -1.26 -4.83 116.67 116.46 1ynj s ASP 324 Ca -0.03 -1.78 0.29 0.00 -0.52 0.00 0.00 52.55 50.51 1ynj s ASP 324 Cb -0.11 -2.57 1.58 0.00 -1.46 0.00 0.00 42.92 40.36 1ynj s ASP 324 CO 0.02 -1.39 1.89 0.16 0.52 0.00 0.00 175.17 176.37 1ynj h ILE 325 N 6.39 0.00 -0.02 4.11 -0.00 -1.97 -0.92 117.51 125.10 1ynj h ILE 325 Ca 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 65.13 1ynj h ILE 325 Cb 0.97 0.65 0.00 0.00 -0.00 0.00 0.00 36.82 38.43 1ynj h ILE 325 CO 1.43 0.00 -0.28 0.47 -0.00 0.00 0.00 178.15 179.76 1ynj n ASP 326 N -2.87 2.32 -4.78 2.16 8.00 -1.26 -4.71 116.55 115.41 1ynj n ASP 326 Ca -0.02 -1.66 -0.41 0.00 0.71 0.00 0.00 54.79 53.41 1ynj n ASP 326 Cb 0.40 0.30 -0.00 0.00 -0.02 0.00 0.00 41.12 41.79 1ynj n ASP 326 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1ynj s HIS 327 N -2.20 2.66 -1.66 1.24 2.46 -0.35 -4.89 115.29 112.54 1ynj s HIS 327 Ca 0.21 1.22 0.24 0.00 0.47 0.00 0.00 55.06 57.20 1ynj s HIS 327 Cb 0.18 -3.95 1.28 0.00 -0.13 0.00 0.00 32.58 29.95 1ynj s HIS 327 CO 0.45 -2.78 1.78 1.28 -2.47 0.00 0.00 174.74 172.99 1ynj n LEU 328 N 0.45 0.00 -0.56 8.88 4.32 -1.26 -0.51 117.00 128.33 1ynj n LEU 328 Ca 0.01 0.17 0.04 0.00 -0.02 0.00 0.00 56.01 56.21 1ynj n LEU 328 Cb 0.40 -0.17 0.11 0.00 -1.62 0.00 0.00 43.42 42.14 1ynj n LEU 328 CO 0.62 -0.04 0.56 0.61 -1.22 0.00 0.00 177.39 177.92 1ynj n GLY 329 N 0.61 0.54 0.00 -0.72 0.00 -1.26 -3.46 105.19 100.89 1ynj n GLY 329 Ca 0.14 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1ynj n GLY 329 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ynj n ASN 330 N 0.21 0.29 -4.29 1.61 3.02 0.34 -4.98 115.26 111.46 1ynj n ASN 330 Ca 0.08 -0.82 -0.34 0.00 -0.03 0.00 0.00 54.58 53.47 1ynj n ASN 330 Cb 0.28 0.08 -0.15 0.00 -0.61 0.00 0.00 39.78 39.39 1ynj n ASN 330 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1ynj s ARG 331 N -0.08 3.29 0.33 3.52 1.81 -0.97 -0.07 118.95 126.78 1ynj s ARG 331 Ca 0.00 -0.70 0.07 0.00 -1.72 0.00 0.00 55.73 53.39 1ynj s ARG 331 Cb 0.00 -2.76 -0.03 0.00 -0.45 0.00 0.00 34.95 31.71 1ynj s ARG 331 CO 0.00 -0.04 0.27 0.50 -0.68 0.00 0.00 175.30 175.35 1ynj s ARG 332 N 1.00 2.73 -0.24 3.54 3.52 -0.82 -4.66 118.95 124.02 1ynj s ARG 332 Ca -0.01 -1.28 0.02 0.00 -0.13 0.00 0.00 55.73 54.33 1ynj s ARG 332 Cb -0.15 -2.47 0.06 0.00 -1.56 0.00 0.00 34.95 30.83 1ynj s ARG 332 CO -0.02 0.13 -0.10 0.42 -0.81 0.00 0.00 175.30 174.93 1ynj s ILE 333 N -2.29 1.94 -0.61 4.11 1.01 0.28 -3.23 121.20 122.41 1ynj s ILE 333 Ca 0.40 -1.44 -0.28 0.00 0.00 0.00 0.00 60.65 59.33 1ynj s ILE 333 Cb -0.06 -2.08 0.02 0.00 0.01 0.00 0.00 42.46 40.36 1ynj s ILE 333 CO 0.26 -0.01 1.29 -0.13 0.00 0.00 0.00 174.94 176.35 1ynj s ARG 334 N 1.22 3.37 0.65 2.79 0.52 -0.58 -4.44 118.95 122.47 1ynj s ARG 334 Ca -0.07 0.21 -0.09 0.00 -0.52 0.00 0.00 55.73 55.26 1ynj s ARG 334 Cb -0.19 -4.09 0.01 0.00 0.52 0.00 0.00 34.95 31.20 1ynj s ARG 334 CO -0.06 -1.87 1.01 0.95 0.02 0.00 0.00 175.30 175.34 1ynj s THR 335 N 5.51 3.64 0.03 0.02 -4.23 -1.26 -2.29 115.64 117.06 1ynj s THR 335 Ca 0.44 0.29 -0.06 0.00 -1.18 0.00 0.00 61.69 61.19 1ynj s THR 335 Cb -0.09 -3.49 -0.01 0.00 1.34 0.00 0.00 72.50 70.25 1ynj s THR 335 CO 0.23 -0.59 0.75 0.52 -0.54 0.00 0.00 174.62 174.99 1ynj n VAL 336 N -2.80 -0.12 -0.26 2.29 0.31 -1.26 -1.54 118.33 114.94 1ynj n VAL 336 Ca 0.06 1.14 0.01 0.00 -0.01 0.00 0.00 64.34 65.54 1ynj n VAL 336 Cb 0.57 -1.48 0.06 0.00 -0.91 0.00 0.00 33.84 32.08 1ynj n VAL 336 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ynj n GLY 337 N -1.05 -1.32 0.24 2.92 0.00 -1.26 -0.17 105.19 104.55 1ynj n GLY 337 Ca 0.00 0.77 -0.15 0.00 0.00 0.00 0.00 46.02 46.64 1ynj n GLY 337 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ynj h GLU 338 N 0.00 0.84 -0.30 1.61 4.81 -1.63 0.10 114.58 120.01 1ynj h GLU 338 Ca 0.28 -0.54 -0.04 0.00 -0.13 0.00 0.00 59.36 58.93 1ynj h GLU 338 Cb 0.46 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1ynj h GLU 338 CO -0.70 1.17 0.01 -0.07 -0.73 0.00 0.00 179.01 178.69 1ynj h LEU 339 N 0.60 0.51 -0.57 1.64 3.38 -0.21 1.88 115.31 122.54 1ynj h LEU 339 Ca 0.01 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.71 1ynj h LEU 339 Cb 1.15 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.73 1ynj h LEU 339 CO 0.12 0.68 0.35 -0.03 0.09 0.00 0.00 178.44 179.65 1ynj h MET 340 N 0.32 0.68 -0.38 1.13 4.05 -1.10 -0.71 114.93 118.93 1ynj h MET 340 Ca 0.09 -0.04 -0.15 0.00 -0.28 0.00 0.00 59.70 59.32 1ynj h MET 340 Cb 0.41 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 1ynj h MET 340 CO 0.01 0.45 -0.34 0.00 0.23 0.00 0.00 176.91 177.26 1ynj h ALA 341 N 1.24 0.55 -0.33 0.39 0.00 -0.25 -2.64 119.26 118.22 1ynj h ALA 341 Ca 0.23 -0.43 0.10 0.00 0.00 0.00 0.00 54.91 54.80 1ynj h ALA 341 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ynj h ALA 341 CO -0.09 0.62 0.24 -0.44 0.00 0.00 0.00 179.25 179.58 1ynj h ASP 342 N 0.70 0.00 0.95 0.00 3.32 0.34 -1.00 116.42 120.73 1ynj h ASP 342 Ca 0.06 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.98 1ynj h ASP 342 Cb 0.93 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.46 1ynj h ASP 342 CO 0.09 0.00 -0.62 -0.61 -1.72 0.00 0.00 179.24 176.38 1ynj h GLN 343 N 0.00 0.00 -0.31 3.56 5.75 -0.79 -2.70 115.11 120.62 1ynj h GLN 343 Ca 0.16 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.66 1ynj h GLN 343 Cb 0.64 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.18 1ynj h GLN 343 CO -0.00 0.62 0.19 0.74 -2.65 0.00 0.00 178.83 177.73 1ynj h PHE 344 N 0.00 0.37 -0.28 3.99 0.04 -0.94 -1.38 116.94 118.74 1ynj h PHE 344 Ca -0.01 0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.83 1ynj h PHE 344 Cb 1.26 -0.12 -0.08 0.00 2.20 0.00 0.00 35.95 39.21 1ynj h PHE 344 CO 0.00 0.22 -0.47 0.00 -0.60 0.00 0.00 178.31 177.46 1ynj h ARG 345 N 0.40 -0.42 -0.91 1.51 3.08 -1.14 0.94 114.38 117.84 1ynj h ARG 345 Ca 0.12 0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.33 1ynj h ARG 345 Cb -0.02 0.10 -0.09 0.00 0.08 0.00 0.00 29.97 30.03 1ynj h ARG 345 CO -0.04 -0.28 0.53 0.28 -1.07 0.00 0.00 179.97 179.39 1ynj h VAL 346 N -0.43 0.83 0.67 2.04 2.07 -1.39 0.42 116.25 120.46 1ynj h VAL 346 Ca 0.09 -0.27 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1ynj h VAL 346 Cb 0.62 -0.04 0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1ynj h VAL 346 CO -0.51 0.15 -0.32 1.23 0.02 0.00 0.00 177.57 178.14 1ynj h GLY 347 N 0.80 -0.94 1.77 2.17 0.00 0.14 -2.60 103.07 104.41 1ynj h GLY 347 Ca 0.47 0.35 -0.02 0.00 0.00 0.00 0.00 47.33 48.13 1ynj h GLY 347 CO -0.31 -0.34 0.03 1.41 0.00 0.00 0.00 176.54 177.34 1ynj h LEU 348 N -1.00 0.27 -0.43 3.11 4.07 0.11 -0.25 115.31 121.18 1ynj h LEU 348 Ca -0.09 -0.03 0.06 0.00 0.08 0.00 0.00 57.88 57.90 1ynj h LEU 348 Cb 0.69 -0.07 -0.05 0.00 1.08 0.00 0.00 40.66 42.31 1ynj h LEU 348 CO 0.15 0.30 0.14 0.00 -1.08 0.00 0.00 178.44 177.94 1ynj h ALA 349 N 1.75 0.51 -0.23 1.53 0.00 -0.14 -0.64 119.26 122.03 1ynj h ALA 349 Ca 0.07 0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 1ynj h ALA 349 Cb 0.15 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ynj h ALA 349 CO -0.00 -0.26 -0.62 0.00 0.00 0.00 0.00 179.25 178.37 1ynj h ARG 350 N 0.30 0.80 -0.43 0.00 -0.00 -0.83 -3.12 114.38 111.09 1ynj h ARG 350 Ca 0.20 -0.55 0.01 0.00 -0.50 0.00 0.00 59.98 59.14 1ynj h ARG 350 Cb 0.21 0.08 -0.02 0.00 0.00 0.00 0.00 29.97 30.24 1ynj h ARG 350 CO -0.22 1.17 0.29 1.25 0.00 0.00 0.00 179.97 182.46 1ynj h LEU 351 N 0.59 0.49 0.13 3.04 5.85 -0.54 -2.66 115.31 122.21 1ynj h LEU 351 Ca -0.01 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1ynj h LEU 351 Cb 1.23 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1ynj h LEU 351 CO 0.13 0.36 -0.06 0.00 -0.34 0.00 0.00 178.44 178.52 1ynj h ALA 352 N 1.73 -0.18 -1.00 1.25 0.00 -1.07 -2.72 119.26 117.27 1ynj h ALA 352 Ca 0.16 -0.20 0.21 0.00 0.00 0.00 0.00 54.91 55.08 1ynj h ALA 352 Cb -0.06 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 17.68 1ynj h ALA 352 CO -0.03 -0.40 0.61 -0.09 0.00 0.00 0.00 179.25 179.33 1ynj h ARG 353 N -0.58 0.68 -0.69 0.00 2.43 -1.50 0.39 114.38 115.12 1ynj h ARG 353 Ca -0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1ynj h ARG 353 Cb 0.45 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1ynj h ARG 353 CO 0.03 0.45 0.00 0.41 -1.51 0.00 0.00 179.97 179.35 1ynj n GLY 354 N -1.33 1.73 0.42 2.80 0.00 -1.02 -1.19 105.19 106.60 1ynj n GLY 354 Ca 0.24 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1ynj n GLY 354 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ynj n VAL 355 N 0.32 1.22 0.30 1.61 0.31 0.12 -4.30 118.33 117.91 1ynj n VAL 355 Ca 0.12 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.59 1ynj n VAL 355 Cb 0.57 -1.93 0.76 0.00 -0.91 0.00 0.00 33.84 32.33 1ynj n VAL 355 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1ynj h ARG 356 N -0.66 0.00 0.14 5.55 3.08 -1.06 0.77 114.38 122.19 1ynj h ARG 356 Ca -0.22 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.55 1ynj h ARG 356 Cb 1.01 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.08 1ynj h ARG 356 CO -0.13 0.00 -1.25 1.49 -1.07 0.00 0.00 179.97 179.00 1ynj h GLU 357 N 0.00 0.35 0.00 0.04 4.81 -1.38 -3.24 114.58 115.17 1ynj h GLU 357 Ca 0.00 -0.56 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 1ynj h GLU 357 Cb 0.57 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.16 1ynj h GLU 357 CO 0.00 1.26 -1.04 0.54 -0.73 0.00 0.00 179.01 179.04 1ynj n ARG 358 N -3.60 0.38 0.13 1.92 1.74 0.21 -2.87 116.66 114.56 1ynj n ARG 358 Ca -0.10 0.02 0.01 0.00 -0.77 0.00 0.00 57.85 57.00 1ynj n ARG 358 Cb 1.02 -1.65 0.31 0.00 -1.02 0.00 0.00 32.46 31.12 1ynj n ARG 358 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 1ynj h MET 359 N 0.00 0.18 0.04 5.56 2.86 -0.01 -2.80 114.93 120.76 1ynj h MET 359 Ca 0.00 -0.06 -0.25 0.00 -2.06 0.00 0.00 59.70 57.32 1ynj h MET 359 Cb 0.80 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.43 1ynj h MET 359 CO 0.00 0.48 -1.28 0.28 1.06 0.00 0.00 176.91 177.45 1ynj h VAL 360 N 0.16 1.40 0.00 -2.22 2.07 -1.57 -3.34 116.25 112.74 1ynj h VAL 360 Ca 0.02 -3.11 0.00 0.00 0.82 0.00 0.00 66.70 64.44 1ynj h VAL 360 Cb 0.64 2.76 0.00 0.00 -1.52 0.00 0.00 31.29 33.17 1ynj h VAL 360 CO 0.05 0.84 -0.22 0.24 0.02 0.00 0.00 177.57 178.50 1ynj h MET 361 N 0.02 0.00 -6.33 1.57 2.07 -1.55 -3.47 114.93 107.25 1ynj h MET 361 Ca -0.13 0.00 -0.60 0.00 -2.07 0.00 0.00 59.70 56.90 1ynj h MET 361 Cb 1.90 0.00 -0.11 0.00 -1.87 0.00 0.00 31.60 31.52 1ynj h MET 361 CO 0.14 0.00 -0.66 0.20 1.07 0.00 0.00 176.91 177.66 1ynj s GLY 362 N -4.23 1.71 -0.20 8.32 0.00 -1.06 -5.09 107.32 106.77 1ynj s GLY 362 Ca 0.05 -1.43 -0.29 0.00 0.00 0.00 0.00 44.72 43.06 1ynj s GLY 362 CO 0.70 -1.45 1.42 -0.56 0.00 0.00 0.00 173.10 173.20 1ynj s SER 363 N -3.06 6.69 0.58 1.64 0.01 -1.26 -4.91 113.70 113.39 1ynj s SER 363 Ca 0.28 1.62 0.39 0.00 1.31 0.00 0.00 55.95 59.55 1ynj s SER 363 Cb -0.09 -2.54 2.10 0.00 0.21 0.00 0.00 66.02 65.71 1ynj s SER 363 CO 0.18 -1.00 2.19 -0.65 0.41 0.00 0.00 173.24 174.38 1ynj h PRO 364 N 9.33 0.00 -0.56 12.44 0.11 -1.97 -2.22 132.00 149.14 1ynj h PRO 364 Ca -0.30 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.79 1ynj h PRO 364 Cb 1.12 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 1ynj h PRO 364 CO 0.99 0.00 0.27 -0.44 -0.21 0.00 0.00 178.00 178.62 1ynj h ASP 365 N 0.00 0.70 0.00 -2.05 3.45 -2.02 -3.34 116.42 113.15 1ynj h ASP 365 Ca 0.00 -0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.40 1ynj h ASP 365 Cb 0.02 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 38.62 1ynj h ASP 365 CO 0.00 0.59 -0.79 0.35 -1.57 0.00 0.00 179.24 177.82 1ynj n THR 366 N -4.37 0.00 -1.67 0.35 -2.24 -0.84 -5.02 114.28 100.48 1ynj n THR 366 Ca 0.05 -0.24 -0.48 0.00 -2.27 0.00 0.00 64.05 61.11 1ynj n THR 366 Cb 0.12 0.67 -0.05 0.00 -2.10 0.00 0.00 70.33 68.97 1ynj n THR 366 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ynj n LEU 367 N -1.43 3.14 -4.34 3.22 4.77 -1.16 -4.99 117.00 116.21 1ynj n LEU 367 Ca -0.00 1.03 -0.21 0.00 -0.03 0.00 0.00 56.01 56.81 1ynj n LEU 367 Cb 0.12 -1.37 -0.11 0.00 -2.33 0.00 0.00 43.42 39.73 1ynj n LEU 367 CO 0.12 -0.23 -0.47 0.42 -1.33 0.00 0.00 177.39 175.90 1ynj s THR 368 N 2.46 1.81 0.34 -5.08 -4.23 -1.26 -5.03 115.64 104.65 1ynj s THR 368 Ca 0.86 -2.02 -0.29 0.00 -1.18 0.00 0.00 61.69 59.07 1ynj s THR 368 Cb -0.72 -1.91 -0.12 0.00 1.34 0.00 0.00 72.50 71.09 1ynj s THR 368 CO 0.46 -0.40 1.46 -0.81 -0.54 0.00 0.00 174.62 174.79 1ynj n PRO 369 N 0.07 2.49 0.00 3.99 -0.04 -1.26 -0.25 135.00 140.00 1ynj n PRO 369 Ca -0.11 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 1ynj n PRO 369 Cb 0.58 -2.58 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 1ynj n PRO 369 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ynj n ALA 370 N 0.98 0.00 0.77 0.55 0.00 -1.26 -4.71 120.51 116.84 1ynj n ALA 370 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.57 1ynj n ALA 370 Cb 0.37 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.72 1ynj n ALA 370 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ynj n LYS 371 N 0.00 1.34 -0.08 0.00 4.81 0.65 -4.51 118.16 120.37 1ynj n LYS 371 Ca 0.00 -0.01 -0.10 0.00 -0.87 0.00 0.00 58.31 57.33 1ynj n LYS 371 Cb 0.00 -1.31 -0.10 0.00 0.02 0.00 0.00 35.03 33.64 1ynj n LYS 371 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1ynj n LEU 372 N -1.43 1.61 -4.80 3.14 4.77 0.11 -4.81 117.00 115.59 1ynj n LEU 372 Ca 0.03 -0.05 -0.37 0.00 -0.03 0.00 0.00 56.01 55.58 1ynj n LEU 372 Cb 0.27 -0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.12 1ynj n LEU 372 CO 0.35 0.60 0.46 -0.69 -1.33 0.00 0.00 177.39 176.78 1ynj s VAL 373 N -2.36 4.46 -0.13 4.08 1.01 -1.26 -4.44 120.40 121.76 1ynj s VAL 373 Ca -0.17 1.48 0.09 0.00 0.00 0.00 0.00 61.98 63.38 1ynj s VAL 373 Cb 0.05 -3.96 -0.14 0.00 0.00 0.00 0.00 36.38 32.33 1ynj s VAL 373 CO 0.51 0.30 0.01 0.59 0.00 0.00 0.00 175.10 176.51 1ynj n ASN 374 N 0.99 2.16 -0.13 3.32 3.02 -1.26 -4.61 115.26 118.76 1ynj n ASN 374 Ca -0.03 -0.01 -0.02 0.00 -0.03 0.00 0.00 54.58 54.49 1ynj n ASN 374 Cb 0.50 0.61 -0.01 0.00 -0.61 0.00 0.00 39.78 40.28 1ynj n ASN 374 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1ynj n SER 375 N -2.54 -3.53 0.00 6.41 2.88 -1.26 -4.88 113.62 110.70 1ynj n SER 375 Ca -0.21 0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1ynj n SER 375 Cb 0.87 -1.18 0.00 0.00 -0.75 0.00 0.00 64.21 63.15 1ynj n SER 375 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ynj n ARG 376 N -2.51 1.94 0.10 -1.46 5.12 -1.26 -4.31 116.66 114.29 1ynj n ARG 376 Ca -0.02 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 55.88 1ynj n ARG 376 Cb 0.11 -0.84 0.01 0.00 -1.16 0.00 0.00 32.46 30.58 1ynj n ARG 376 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1ynj h PRO 377 N 0.00 0.00 -0.14 5.56 0.11 -1.88 -1.50 132.00 134.15 1ynj h PRO 377 Ca 0.00 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.93 1ynj h PRO 377 Cb 0.02 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 1ynj h PRO 377 CO 0.00 0.76 -0.66 1.25 -0.21 0.00 0.00 178.00 179.14 1ynj h LEU 378 N 0.00 0.63 0.50 2.35 5.85 -1.74 -3.06 115.31 119.84 1ynj h LEU 378 Ca -0.01 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.31 1ynj h LEU 378 Cb 1.48 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1ynj h LEU 378 CO 0.10 1.12 -0.24 -0.08 -0.34 0.00 0.00 178.44 179.00 1ynj h GLU 379 N 0.39 -0.65 0.00 1.25 4.57 -1.71 -2.82 114.58 115.61 1ynj h GLU 379 Ca -0.02 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 1ynj h GLU 379 Cb 1.23 0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.97 1ynj h GLU 379 CO 0.12 -0.42 -0.02 0.00 -1.18 0.00 0.00 179.01 177.51 1ynj h ALA 380 N -1.13 1.30 0.00 2.92 0.00 -1.41 1.08 119.26 122.02 1ynj h ALA 380 Ca -0.07 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1ynj h ALA 380 Cb 0.53 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1ynj h ALA 380 CO 0.11 0.03 -0.72 0.00 0.00 0.00 0.00 179.25 178.67 1ynj h ALA 381 N 1.98 0.69 0.00 0.00 0.00 -1.59 -3.05 119.26 117.28 1ynj h ALA 381 Ca -0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1ynj h ALA 381 Cb 0.09 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ynj h ALA 381 CO 0.00 0.58 -0.66 -0.11 0.00 0.00 0.00 179.25 179.06 1ynj n LEU 382 N -3.08 0.38 0.00 0.00 7.94 0.02 -3.71 117.00 118.55 1ynj n LEU 382 Ca -0.01 -0.41 -0.18 0.00 -1.11 0.00 0.00 56.01 54.31 1ynj n LEU 382 Cb 0.72 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.57 1ynj n LEU 382 CO 0.40 0.10 0.25 -0.09 -1.11 0.00 0.00 177.39 176.94 1ynj h ARG 383 N 0.00 0.46 -0.95 1.96 2.43 0.96 -3.32 114.38 115.93 1ynj h ARG 383 Ca 0.00 -0.48 0.08 0.00 -0.81 0.00 0.00 59.98 58.77 1ynj h ARG 383 Cb 0.28 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 29.89 1ynj h ARG 383 CO 0.00 1.12 0.61 1.49 -1.51 0.00 0.00 179.97 181.69 1ynj h GLU 384 N -0.01 1.01 0.00 0.20 4.57 -1.68 -2.20 114.58 116.47 1ynj h GLU 384 Ca -0.08 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1ynj h GLU 384 Cb 1.34 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.70 1ynj h GLU 384 CO 0.13 0.67 0.00 0.34 -1.18 0.00 0.00 179.01 178.96 1ynj n PHE 385 N -4.52 0.00 -0.03 0.92 7.35 -1.24 0.28 117.46 120.21 1ynj n PHE 385 Ca 0.15 0.00 0.24 0.00 -0.76 0.00 0.00 57.45 57.08 1ynj n PHE 385 Cb 0.24 -0.27 0.70 0.00 0.35 0.00 0.00 39.48 40.50 1ynj n PHE 385 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1ynj h PHE 386 N 0.00 0.00 0.00 -5.13 -1.00 -1.65 -0.98 116.94 108.18 1ynj h PHE 386 Ca 0.00 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.64 1ynj h PHE 386 Cb 0.00 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 1ynj h PHE 386 CO 0.10 0.00 -0.93 1.03 -1.61 0.00 0.00 178.31 176.90 1ynj h SER 387 N 0.00 0.00 -0.06 2.17 0.87 -1.45 -3.45 113.55 111.63 1ynj h SER 387 Ca 0.30 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1ynj h SER 387 Cb 1.53 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.49 1ynj h SER 387 CO -0.00 1.20 0.00 0.54 -0.53 0.00 0.00 176.83 178.04 1ynj n ARG 388 N -4.51 0.74 -2.81 2.24 1.74 0.14 -4.99 116.66 109.22 1ynj n ARG 388 Ca -0.22 -1.14 -0.39 0.00 -0.77 0.00 0.00 57.85 55.32 1ynj n ARG 388 Cb 0.52 -1.13 -0.06 0.00 -1.02 0.00 0.00 32.46 30.77 1ynj n ARG 388 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ynj s SER 389 N -0.66 7.55 0.51 0.55 0.15 -0.43 -4.94 113.70 116.43 1ynj s SER 389 Ca 0.09 1.87 0.30 0.00 0.70 0.00 0.00 55.95 58.91 1ynj s SER 389 Cb 0.06 -2.58 1.42 0.00 -1.71 0.00 0.00 66.02 63.20 1ynj s SER 389 CO 0.08 0.14 1.84 1.56 1.20 0.00 0.00 173.24 178.06 1ynj h GLN 390 N 4.06 0.09 0.00 5.44 4.20 -1.94 -0.09 115.11 126.88 1ynj h GLN 390 Ca -0.46 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.25 1ynj h GLN 390 Cb 1.20 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.96 1ynj h GLN 390 CO 0.67 0.06 0.00 -0.07 -0.67 0.00 0.00 178.83 178.82 1ynj h LEU 391 N 0.09 0.00 -7.68 1.46 4.07 -1.92 -3.37 115.31 107.97 1ynj h LEU 391 Ca 0.50 0.00 -0.77 0.00 0.08 0.00 0.00 57.88 57.69 1ynj h LEU 391 Cb 1.83 0.00 -0.24 0.00 1.08 0.00 0.00 40.66 43.33 1ynj h LEU 391 CO -0.07 0.00 0.70 -0.55 -1.08 0.00 0.00 178.44 177.45 1ynj s SER 392 N -4.82 7.12 1.05 -0.43 0.15 -0.05 -0.66 113.70 116.07 1ynj s SER 392 Ca 0.06 -3.18 -0.13 0.00 0.70 0.00 0.00 55.95 53.40 1ynj s SER 392 Cb 0.10 -2.28 0.22 0.00 -1.71 0.00 0.00 66.02 62.34 1ynj s SER 392 CO 0.51 -0.52 1.08 -1.10 1.20 0.00 0.00 173.24 174.40 1ynj s GLN 393 N 0.08 -0.00 0.00 5.44 -1.52 -0.74 -4.82 119.66 118.09 1ynj s GLN 393 Ca 0.33 0.55 0.00 0.00 -1.95 0.00 0.00 55.36 54.28 1ynj s GLN 393 Cb -0.07 -1.68 0.00 0.00 -0.22 0.00 0.00 33.01 31.03 1ynj s GLN 393 CO -0.06 -3.03 0.00 1.19 -0.25 0.00 0.00 175.29 173.14 1ynj n PHE 394 N -4.39 0.00 -3.37 0.91 3.01 -1.26 -2.32 117.46 110.03 1ynj n PHE 394 Ca 0.04 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.39 1ynj n PHE 394 Cb 0.57 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.95 1ynj n PHE 394 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1ynj s LYS 395 N 0.00 0.32 -0.34 -1.08 2.20 -1.14 -2.40 119.74 117.31 1ynj s LYS 395 Ca 0.00 0.39 -0.27 0.00 -0.36 0.00 0.00 55.97 55.73 1ynj s LYS 395 Cb 0.00 -0.61 -0.05 0.00 -1.51 0.00 0.00 37.83 35.66 1ynj s LYS 395 CO 0.00 -0.71 2.25 0.34 -0.36 0.00 0.00 175.35 176.88 1ynj s ASP 396 N 2.49 5.09 0.00 1.43 -1.08 -1.26 -4.72 116.67 118.62 1ynj s ASP 396 Ca 0.11 1.49 0.02 0.00 -0.52 0.00 0.00 52.55 53.66 1ynj s ASP 396 Cb -0.15 -2.51 0.03 0.00 -1.46 0.00 0.00 42.92 38.84 1ynj s ASP 396 CO -0.18 -2.31 0.78 -0.62 0.52 0.00 0.00 175.17 173.36 1ynj n GLU 397 N 8.85 0.88 -0.17 4.34 1.02 -1.26 -1.66 120.64 132.65 1ynj n GLU 397 Ca 0.32 -1.05 -0.09 0.00 -0.02 0.00 0.00 57.16 56.31 1ynj n GLU 397 Cb 0.49 -1.05 -0.07 0.00 -0.02 0.00 0.00 31.44 30.79 1ynj n GLU 397 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1ynj h THR 398 N 0.41 0.00 -3.54 2.62 2.02 -1.86 -3.43 112.91 109.13 1ynj h THR 398 Ca 0.00 0.00 -0.33 0.00 0.77 0.00 0.00 66.41 66.85 1ynj h THR 398 Cb 0.29 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.55 1ynj h THR 398 CO 0.00 0.00 -0.67 0.54 0.37 0.00 0.00 175.52 175.76 1ynj s ASN 399 N -4.54 1.54 0.27 4.18 6.03 -1.26 -4.52 114.94 116.63 1ynj s ASN 399 Ca -0.10 -1.16 -0.07 0.00 -1.03 0.00 0.00 52.86 50.51 1ynj s ASN 399 Cb 0.07 0.06 0.46 0.00 -3.03 0.00 0.00 41.25 38.81 1ynj s ASN 399 CO 0.44 -0.51 1.48 -2.65 -2.03 0.00 0.00 177.10 173.84 1ynj n PRO 400 N -0.29 -0.08 0.06 3.55 -0.01 -1.26 -1.44 135.00 135.52 1ynj n PRO 400 Ca -0.07 1.47 -0.13 0.00 -0.01 0.00 0.00 63.50 64.77 1ynj n PRO 400 Cb 0.63 -2.21 -0.08 0.00 -0.01 0.00 0.00 33.50 31.83 1ynj n PRO 400 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 175.50 176.74 1ynj h LEU 401 N 0.00 -0.07 -0.98 2.45 5.85 -1.93 -1.39 115.31 119.23 1ynj h LEU 401 Ca 0.47 -0.10 0.23 0.00 0.84 0.00 0.00 57.88 59.32 1ynj h LEU 401 Cb 0.74 0.02 -0.12 0.00 0.37 0.00 0.00 40.66 41.67 1ynj h LEU 401 CO -0.97 0.06 0.56 0.77 -0.34 0.00 0.00 178.44 178.52 1ynj h SER 402 N -0.19 0.64 0.26 1.25 4.64 -1.52 0.77 113.55 119.39 1ynj h SER 402 Ca -0.01 0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.43 1ynj h SER 402 Cb 0.17 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1ynj h SER 402 CO 0.01 0.12 -0.12 -1.28 -0.87 0.00 0.00 176.83 174.69 1ynj h SER 403 N 0.58 -0.29 -0.80 4.97 0.87 -0.97 -2.63 113.55 115.29 1ynj h SER 403 Ca 0.62 0.01 0.15 0.00 -1.23 0.00 0.00 61.79 61.34 1ynj h SER 403 Cb 1.14 0.08 -0.15 0.00 -0.44 0.00 0.00 62.40 63.03 1ynj h SER 403 CO -0.47 -0.08 -0.22 -0.11 -0.53 0.00 0.00 176.83 175.42 1ynj n LEU 404 N -3.65 -0.33 0.18 2.23 7.94 -0.54 0.47 117.00 123.30 1ynj n LEU 404 Ca -0.04 1.37 0.03 0.00 -1.11 0.00 0.00 56.01 56.26 1ynj n LEU 404 Cb 0.14 -0.40 0.39 0.00 0.53 0.00 0.00 43.42 44.08 1ynj n LEU 404 CO 0.10 -1.30 0.78 -0.09 -1.11 0.00 0.00 177.39 175.78 1ynj h ARG 405 N 0.00 0.04 -0.37 1.96 1.12 -0.93 -2.90 114.38 113.30 1ynj h ARG 405 Ca 0.36 -0.01 0.06 0.00 -1.11 0.00 0.00 59.98 59.28 1ynj h ARG 405 Cb 0.56 -0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.47 1ynj h ARG 405 CO -0.82 0.33 0.07 1.25 -3.11 0.00 0.00 179.97 177.70 1ynj h HIS 406 N 0.03 0.11 0.00 2.20 2.76 0.41 -2.45 115.15 118.21 1ynj h HIS 406 Ca 0.00 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.16 1ynj h HIS 406 Cb 0.55 0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.51 1ynj h HIS 406 CO 0.00 0.01 -0.15 0.87 -1.30 0.00 0.00 177.93 177.36 1ynj h LYS 407 N 0.19 0.00 -0.70 5.26 1.57 -1.38 -2.28 116.57 119.23 1ynj h LYS 407 Ca 0.18 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.92 1ynj h LYS 407 Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1ynj h LYS 407 CO -0.24 0.15 0.05 0.54 -0.57 0.00 0.00 179.45 179.38 1ynj n ARG 408 N -3.99 3.95 -2.53 3.15 1.74 -0.93 -4.74 116.66 113.31 1ynj n ARG 408 Ca -0.02 -2.52 -0.30 0.00 -0.77 0.00 0.00 57.85 54.23 1ynj n ARG 408 Cb 0.24 -2.11 -0.02 0.00 -1.02 0.00 0.00 32.46 29.56 1ynj n ARG 408 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1ynj s ARG 409 N -2.44 3.72 -0.03 5.56 1.81 -0.86 -0.42 118.95 126.29 1ynj s ARG 409 Ca 0.44 0.55 -0.00 0.00 -1.72 0.00 0.00 55.73 55.00 1ynj s ARG 409 Cb 0.34 -2.28 0.03 0.00 -0.45 0.00 0.00 34.95 32.59 1ynj s ARG 409 CO 0.12 -0.22 0.01 0.42 -0.68 0.00 0.00 175.30 174.96 1ynj s ILE 410 N -2.65 0.11 -0.01 1.52 1.01 0.87 -3.49 121.20 118.55 1ynj s ILE 410 Ca 0.52 0.15 0.00 0.00 0.00 0.00 0.00 60.65 61.33 1ynj s ILE 410 Cb -0.10 -0.23 0.01 0.00 0.01 0.00 0.00 42.46 42.15 1ynj s ILE 410 CO 0.39 0.14 0.01 -0.55 0.00 0.00 0.00 174.94 174.93 1ynj s SER 411 N 1.20 0.09 0.29 3.58 0.15 -0.88 0.36 113.70 118.49 1ynj s SER 411 Ca -0.07 0.01 0.25 0.00 0.70 0.00 0.00 55.95 56.84 1ynj s SER 411 Cb -0.13 -0.05 0.70 0.00 -1.71 0.00 0.00 66.02 64.82 1ynj s SER 411 CO -0.02 -0.06 1.73 0.00 1.20 0.00 0.00 173.24 176.09 1ynj h ALA 412 N 6.71 1.00 -3.00 5.45 0.00 -1.34 -1.42 119.26 126.66 1ynj h ALA 412 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ynj h ALA 412 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ynj h ALA 412 CO 0.49 0.00 0.00 1.28 0.00 0.00 0.00 179.25 181.02 1ynj n LEU 413 N -2.54 0.00 0.00 0.00 4.77 -1.26 -3.25 117.00 114.72 1ynj n LEU 413 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1ynj n LEU 413 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1ynj n LEU 413 CO 0.31 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1ynj n GLY 414 N 5.00 -0.02 3.84 -0.72 0.00 -1.26 -4.72 105.19 107.30 1ynj n GLY 414 Ca 0.00 -2.01 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 1ynj n GLY 414 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ynj s PRO 415 N 0.00 4.07 0.00 1.61 0.04 -1.26 -4.75 135.00 134.71 1ynj s PRO 415 Ca 0.00 0.93 0.00 0.00 0.04 0.00 0.00 61.00 61.97 1ynj s PRO 415 Cb 0.00 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1ynj s PRO 415 CO 0.00 -0.07 0.00 0.41 0.04 0.00 0.00 177.00 177.38 1ynj n GLY 416 N -0.93 0.24 3.56 0.56 0.00 -1.26 -3.56 105.19 103.80 1ynj n GLY 416 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1ynj n GLY 416 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ynj s GLY 417 N 0.00 -0.88 0.00 -0.02 0.00 -1.26 -4.66 107.32 100.50 1ynj s GLY 417 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 44.72 43.83 1ynj s GLY 417 CO 0.00 4.25 0.00 1.04 0.00 0.00 0.00 173.10 178.39 1ynj n LEU 418 N 18.90 0.00 -4.80 0.66 4.77 -1.23 -4.84 117.00 130.46 1ynj n LEU 418 Ca 0.46 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 56.10 1ynj n LEU 418 Cb 0.44 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.47 1ynj n LEU 418 CO 0.55 0.00 0.69 -0.89 -1.33 0.00 0.00 177.39 176.40 1ynj s THR 419 N -0.12 4.06 1.13 -5.08 2.01 -1.20 -4.88 115.64 111.55 1ynj s THR 419 Ca 0.00 1.36 -0.19 0.00 0.31 0.00 0.00 61.69 63.17 1ynj s THR 419 Cb 0.00 -3.60 0.27 0.00 0.01 0.00 0.00 72.50 69.18 1ynj s THR 419 CO 0.00 -0.20 1.20 0.00 -0.69 0.00 0.00 174.62 174.93 1ynj s ARG 420 N -2.99 -0.71 -0.29 4.92 3.03 -1.26 -4.50 118.95 117.15 1ynj s ARG 420 Ca 0.62 -0.27 -0.03 0.00 2.03 0.00 0.00 55.73 58.08 1ynj s ARG 420 Cb -0.14 -1.68 0.04 0.00 -1.03 0.00 0.00 34.95 32.14 1ynj s ARG 420 CO 0.19 -3.34 2.64 0.39 -1.13 0.00 0.00 175.30 174.05 1ynj n GLU 421 N -4.45 2.02 -0.97 3.89 1.02 -1.26 -3.70 120.64 117.19 1ynj n GLU 421 Ca 0.15 -1.65 -0.04 0.00 -0.02 0.00 0.00 57.16 55.60 1ynj n GLU 421 Cb 0.60 -1.86 -0.03 0.00 -0.02 0.00 0.00 31.44 30.13 1ynj n GLU 421 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1ynj n ARG 422 N 1.08 0.09 -3.52 3.49 1.85 -1.26 -5.14 116.66 113.25 1ynj n ARG 422 Ca 0.38 -0.67 -0.16 0.00 -1.00 0.00 0.00 57.85 56.40 1ynj n ARG 422 Cb 0.62 0.48 -0.05 0.00 -1.05 0.00 0.00 32.46 32.46 1ynj n ARG 422 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ynj s ALA 423 N 0.01 -1.64 0.00 2.89 0.00 -1.24 -5.13 121.76 116.64 1ynj s ALA 423 Ca 0.01 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1ynj s ALA 423 Cb 0.03 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.37 1ynj s ALA 423 CO -0.01 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.70 1ynj n GLY 424 N 0.62 -0.58 0.00 0.00 0.00 -1.26 -4.77 105.19 99.20 1ynj n GLY 424 Ca -0.19 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1ynj n GLY 424 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1ynj n PHE 425 N 1.84 0.00 0.03 1.61 7.35 -1.26 -4.55 117.46 122.48 1ynj n PHE 425 Ca 0.00 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.70 1ynj n PHE 425 Cb 0.00 0.00 0.33 0.00 0.35 0.00 0.00 39.48 40.16 1ynj n PHE 425 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1ynj h ASP 426 N 0.00 0.42 0.59 -2.13 5.19 -1.98 -3.03 116.42 115.49 1ynj h ASP 426 Ca 0.00 -0.07 -0.03 0.00 -0.62 0.00 0.00 57.03 56.31 1ynj h ASP 426 Cb 0.57 -0.11 0.01 0.00 0.18 0.00 0.00 39.33 39.97 1ynj h ASP 426 CO 0.00 0.50 -0.28 0.58 -3.12 0.00 0.00 179.24 176.92 1ynj h VAL 427 N 0.44 0.41 -0.72 -1.35 2.07 -1.98 -3.33 116.25 111.79 1ynj h VAL 427 Ca 0.10 -0.04 0.15 0.00 0.82 0.00 0.00 66.70 67.73 1ynj h VAL 427 Cb 0.31 0.43 -0.11 0.00 -1.52 0.00 0.00 31.29 30.40 1ynj h VAL 427 CO 0.01 0.01 0.16 0.03 0.02 0.00 0.00 177.57 177.80 1ynj h ARG 428 N -0.82 0.25 -6.69 1.57 3.08 -1.77 -3.44 114.38 106.56 1ynj h ARG 428 Ca -0.08 -0.01 -0.58 0.00 0.07 0.00 0.00 59.98 59.38 1ynj h ARG 428 Cb 0.62 -0.06 0.12 0.00 0.08 0.00 0.00 29.97 30.73 1ynj h ARG 428 CO 0.13 0.16 0.33 -0.25 -1.07 0.00 0.00 179.97 179.28 1ynj n ASP 429 N -5.16 1.98 -4.56 7.04 8.00 -1.23 -4.57 116.55 118.05 1ynj n ASP 429 Ca 0.13 1.12 -0.27 0.00 0.71 0.00 0.00 54.79 56.49 1ynj n ASP 429 Cb 0.44 -1.41 -0.05 0.00 -0.02 0.00 0.00 41.12 40.08 1ynj n ASP 429 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ynj s VAL 430 N -1.17 3.39 0.38 2.53 0.11 -1.26 -4.93 120.40 119.44 1ynj s VAL 430 Ca 0.60 -0.26 -0.27 0.00 -2.93 0.00 0.00 61.98 59.12 1ynj s VAL 430 Cb -0.57 -3.90 -0.09 0.00 -1.53 0.00 0.00 36.38 30.29 1ynj s VAL 430 CO 0.59 -0.85 1.28 -2.28 -3.33 0.00 0.00 175.10 170.52 1ynj s HIS 431 N 10.41 2.93 0.30 1.54 2.46 -1.26 -4.95 115.29 126.72 1ynj s HIS 431 Ca 0.72 1.43 -0.28 0.00 0.47 0.00 0.00 55.06 57.40 1ynj s HIS 431 Cb -0.08 -3.63 -0.14 0.00 -0.13 0.00 0.00 32.58 28.60 1ynj s HIS 431 CO 0.03 -1.91 1.07 -2.13 -2.47 0.00 0.00 174.74 169.34 1ynj n ARG 432 N 0.33 1.53 0.00 2.88 0.63 -1.26 -2.23 116.66 118.54 1ynj n ARG 432 Ca 0.03 0.54 0.00 0.00 -0.92 0.00 0.00 57.85 57.49 1ynj n ARG 432 Cb 0.43 -1.96 0.00 0.00 0.45 0.00 0.00 32.46 31.39 1ynj n ARG 432 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1ynj n THR 433 N 0.23 0.00 0.20 5.15 -1.04 -1.26 -4.81 114.28 112.75 1ynj n THR 433 Ca 0.08 0.00 0.16 0.00 -2.04 0.00 0.00 64.05 62.25 1ynj n THR 433 Cb 0.33 0.00 0.79 0.00 -1.82 0.00 0.00 70.33 69.63 1ynj n THR 433 CO 0.00 0.00 0.00 0.45 -0.64 0.00 0.00 175.07 174.88 1ynj h HIS 434 N 0.00 0.00 -0.36 -1.42 3.86 -1.76 -3.42 115.15 112.05 1ynj h HIS 434 Ca 0.00 0.00 -0.76 0.00 -1.16 0.00 0.00 60.37 58.45 1ynj h HIS 434 Cb 0.00 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1ynj h HIS 434 CO 0.00 0.00 1.01 0.98 0.86 0.00 0.00 177.93 180.78 1ynj n TYR 435 N -4.01 1.30 0.00 2.45 9.36 -1.26 -0.29 117.16 124.71 1ynj n TYR 435 Ca 0.01 0.86 0.00 0.00 3.32 0.00 0.00 57.90 62.09 1ynj n TYR 435 Cb 0.29 -2.12 0.00 0.00 -0.63 0.00 0.00 39.34 36.87 1ynj n TYR 435 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ynj n GLY 436 N 5.77 2.81 0.00 2.98 0.00 -1.25 -4.77 105.19 110.73 1ynj n GLY 436 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1ynj n GLY 436 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ynj n ARG 437 N -0.71 0.00 -3.27 1.61 1.74 0.07 -3.73 116.66 112.37 1ynj n ARG 437 Ca 0.00 0.05 -0.23 0.00 -0.77 0.00 0.00 57.85 56.89 1ynj n ARG 437 Cb 0.00 -0.30 -0.00 0.00 -1.02 0.00 0.00 32.46 31.13 1ynj n ARG 437 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ynj s ILE 438 N -0.33 4.73 -0.07 0.55 1.01 0.61 -0.15 121.20 127.55 1ynj s ILE 438 Ca 0.00 -0.50 -0.19 0.00 0.00 0.00 0.00 60.65 59.96 1ynj s ILE 438 Cb 0.00 -3.73 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 1ynj s ILE 438 CO 0.00 -0.47 0.52 0.00 0.00 0.00 0.00 174.94 174.99 1ynj n PRO 440 N 3.23 0.40 -3.30 0.00 -0.04 -1.26 -4.53 135.00 129.50 1ynj n PRO 440 Ca -0.07 0.01 -0.04 0.00 -0.04 0.00 0.00 63.50 63.37 1ynj n PRO 440 Cb 0.51 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 1ynj n PRO 440 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ynj s VAL 441 N -2.05 -0.77 0.00 0.52 -7.23 -1.26 -4.97 120.40 104.64 1ynj s VAL 441 Ca 0.20 -0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.34 1ynj s VAL 441 Cb 0.09 -0.88 0.00 0.00 0.56 0.00 0.00 36.38 36.15 1ynj s VAL 441 CO 0.16 -0.06 0.00 1.21 -0.31 0.00 0.00 175.10 176.10 1ynj n GLU 442 N 5.39 0.00 -1.29 4.82 4.07 -1.26 -4.52 120.64 127.85 1ynj n GLU 442 Ca -0.03 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 56.64 1ynj n GLU 442 Cb 0.50 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.87 1ynj n GLU 442 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 1ynj n THR 443 N -0.04 1.41 -2.03 6.31 5.66 -1.26 -4.78 114.28 119.56 1ynj n THR 443 Ca 0.00 -0.48 -0.40 0.00 -3.05 0.00 0.00 64.05 60.12 1ynj n THR 443 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 1ynj n THR 443 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1ynj s PRO 444 N -0.95 4.18 0.37 1.09 0.04 -1.26 -4.95 135.00 133.52 1ynj s PRO 444 Ca 0.59 2.28 0.05 0.00 0.04 0.00 0.00 61.00 63.96 1ynj s PRO 444 Cb -0.78 -2.95 0.74 0.00 0.04 0.00 0.00 34.50 31.56 1ynj s PRO 444 CO 0.56 -0.36 2.00 1.49 0.04 0.00 0.00 177.00 180.72 1ynj h GLU 445 N 3.07 0.71 -4.52 4.56 4.57 -1.94 -3.15 114.58 117.89 1ynj h GLU 445 Ca -0.50 -0.04 -0.19 0.00 -1.18 0.00 0.00 59.36 57.45 1ynj h GLU 445 Cb 1.24 -0.16 -0.15 0.00 -0.16 0.00 0.00 28.75 29.52 1ynj h GLU 445 CO 0.64 0.47 -0.68 0.20 -1.18 0.00 0.00 179.01 178.46 1ynj s GLY 446 N -3.57 0.75 0.00 1.92 0.00 -1.26 -4.78 107.32 100.38 1ynj s GLY 446 Ca -0.09 -1.35 0.00 0.00 0.00 0.00 0.00 44.72 43.28 1ynj s GLY 446 CO 0.76 -1.41 0.00 0.00 0.00 0.00 0.00 173.10 172.45 1ynj n ALA 447 N -0.02 0.00 -0.82 3.20 0.00 -1.26 -3.84 120.51 117.77 1ynj n ALA 447 Ca -0.11 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.36 1ynj n ALA 447 Cb 0.61 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.42 1ynj n ALA 447 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ynj n ASN 448 N 2.49 5.24 -4.68 0.00 3.02 -1.26 -4.93 115.26 115.14 1ynj n ASN 448 Ca 0.00 -2.95 -0.59 0.00 -0.03 0.00 0.00 54.58 51.01 1ynj n ASN 448 Cb 0.00 -0.69 -0.08 0.00 -0.61 0.00 0.00 39.78 38.40 1ynj n ASN 448 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ynj n ILE 449 N 0.39 0.17 0.00 2.41 3.06 -1.19 -1.05 119.36 123.14 1ynj n ILE 449 Ca 0.30 -0.03 0.00 0.00 -2.50 0.00 0.00 62.75 60.52 1ynj n ILE 449 Cb 1.20 -0.93 0.00 0.00 0.54 0.00 0.00 39.64 40.45 1ynj n ILE 449 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1ynj n GLY 450 N 3.70 2.66 0.00 4.50 0.00 -1.26 -4.74 105.19 110.04 1ynj n GLY 450 Ca 0.26 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.42 1ynj n GLY 450 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ynj n LEU 451 N 0.00 0.02 -3.97 0.99 4.77 -0.22 -4.69 117.00 113.90 1ynj n LEU 451 Ca 0.00 0.40 -0.13 0.00 -0.03 0.00 0.00 56.01 56.25 1ynj n LEU 451 Cb 0.00 -0.41 -0.13 0.00 -2.33 0.00 0.00 43.42 40.56 1ynj n LEU 451 CO 0.00 0.00 -0.38 -0.63 -1.33 0.00 0.00 177.39 175.05 1ynj s ILE 452 N -2.83 0.28 0.26 -0.08 1.01 -1.17 -1.20 121.20 117.47 1ynj s ILE 452 Ca 0.20 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 60.12 1ynj s ILE 452 Cb 0.19 -0.32 0.01 0.00 0.01 0.00 0.00 42.46 42.35 1ynj s ILE 452 CO 0.51 -0.19 0.56 0.28 0.00 0.00 0.00 174.94 176.10 1ynj s THR 453 N -0.76 0.00 -0.07 2.92 -1.32 0.16 -4.49 115.64 112.08 1ynj s THR 453 Ca -0.06 -1.24 -0.12 0.00 -1.21 0.00 0.00 61.69 59.06 1ynj s THR 453 Cb -0.06 -2.10 -0.05 0.00 -1.51 0.00 0.00 72.50 68.78 1ynj s THR 453 CO -0.00 -0.01 0.31 -0.44 -2.21 0.00 0.00 174.62 172.27 1ynj s SER 454 N -2.98 6.60 0.32 8.08 0.01 -1.26 -0.09 113.70 124.39 1ynj s SER 454 Ca 0.18 0.71 -0.28 0.00 1.31 0.00 0.00 55.95 57.87 1ynj s SER 454 Cb -0.03 -2.18 -0.10 0.00 0.21 0.00 0.00 66.02 63.92 1ynj s SER 454 CO 0.08 0.29 1.20 -0.22 0.41 0.00 0.00 173.24 175.00 1ynj s LEU 455 N -0.67 4.44 0.53 2.44 2.96 0.43 -2.17 118.68 126.64 1ynj s LEU 455 Ca 0.20 2.47 -0.17 0.00 -0.22 0.00 0.00 54.13 56.41 1ynj s LEU 455 Cb -0.14 -3.70 -0.07 0.00 0.50 0.00 0.00 46.19 42.78 1ynj s LEU 455 CO 0.08 -0.40 1.01 0.00 -1.32 0.00 0.00 176.35 175.72 1ynj s ALA 456 N -1.19 2.95 0.19 5.97 0.00 0.79 -4.49 121.76 125.98 1ynj s ALA 456 Ca 0.48 0.31 -0.20 0.00 0.00 0.00 0.00 51.96 52.55 1ynj s ALA 456 Cb -0.35 -3.17 0.15 0.00 0.00 0.00 0.00 23.12 19.74 1ynj s ALA 456 CO 0.46 -0.38 1.58 0.00 0.00 0.00 0.00 175.76 177.42 1ynj h ALA 457 N 0.92 0.00 0.00 0.00 0.00 -1.75 -1.79 119.26 116.65 1ynj h ALA 457 Ca -0.47 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ynj h ALA 457 Cb 1.20 0.81 0.00 0.00 0.00 0.00 0.00 17.79 19.80 1ynj h ALA 457 CO 0.60 -0.66 -0.63 0.66 0.00 0.00 0.00 179.25 179.21 1ynj n TYR 458 N -5.44 0.10 -1.15 0.00 4.02 -1.26 -4.40 117.16 109.02 1ynj n TYR 458 Ca 0.05 0.03 -0.34 0.00 -0.01 0.00 0.00 57.90 57.63 1ynj n TYR 458 Cb 0.36 -0.30 0.11 0.00 -0.02 0.00 0.00 39.34 39.50 1ynj n TYR 458 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1ynj n ALA 459 N -1.58 -0.54 -3.71 -0.72 0.00 -0.67 -4.55 120.51 108.74 1ynj n ALA 459 Ca 0.05 -0.31 -0.12 0.00 0.00 0.00 0.00 53.44 53.05 1ynj n ALA 459 Cb 0.36 -2.12 -0.13 0.00 0.00 0.00 0.00 19.45 17.56 1ynj n ALA 459 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ynj s ARG 460 N -3.70 0.22 0.25 0.00 0.52 -0.33 -4.89 118.95 111.01 1ynj s ARG 460 Ca 0.71 0.59 -0.23 0.00 -0.52 0.00 0.00 55.73 56.28 1ynj s ARG 460 Cb -0.30 -0.09 -0.09 0.00 0.52 0.00 0.00 34.95 34.98 1ynj s ARG 460 CO 0.53 -0.18 0.83 0.08 0.02 0.00 0.00 175.30 176.58 1ynj s VAL 461 N 1.45 4.37 0.31 3.52 1.01 -1.26 0.20 120.40 130.00 1ynj s VAL 461 Ca -0.08 1.60 0.09 0.00 0.00 0.00 0.00 61.98 63.58 1ynj s VAL 461 Cb -0.10 -3.98 -0.06 0.00 0.00 0.00 0.00 36.38 32.24 1ynj s VAL 461 CO -0.09 0.24 -0.10 1.51 0.00 0.00 0.00 175.10 176.66 1ynj s ASP 462 N -1.54 3.30 0.00 3.32 -4.77 -0.61 -4.92 116.67 111.45 1ynj s ASP 462 Ca 0.45 -1.16 0.00 0.00 -3.30 0.00 0.00 52.55 48.53 1ynj s ASP 462 Cb -0.19 -0.27 0.00 0.00 -1.09 0.00 0.00 42.92 41.38 1ynj s ASP 462 CO 0.23 -0.22 0.00 0.00 0.70 0.00 0.00 175.17 175.88 1ynj n ALA 463 N -0.67 0.00 -3.31 2.11 0.00 -1.26 0.12 120.51 117.50 1ynj n ALA 463 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 1ynj n ALA 463 Cb 0.63 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.01 1ynj n ALA 463 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ynj n LEU 464 N 0.00 4.24 -1.04 0.00 7.94 -1.26 -4.95 117.00 121.93 1ynj n LEU 464 Ca 0.00 -5.44 -0.14 0.00 -1.11 0.00 0.00 56.01 49.32 1ynj n LEU 464 Cb 0.00 -0.74 -0.06 0.00 0.53 0.00 0.00 43.42 43.15 1ynj n LEU 464 CO 0.00 2.04 -0.13 0.61 -1.11 0.00 0.00 177.39 178.80 1ynj n GLY 465 N 0.79 1.33 3.74 -3.96 0.00 0.33 -4.74 105.19 102.69 1ynj n GLY 465 Ca 0.30 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 1ynj n GLY 465 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ynj s PHE 466 N -2.25 3.41 0.14 1.61 2.99 -1.25 0.10 117.98 122.72 1ynj s PHE 466 Ca 0.00 0.32 -0.29 0.00 0.00 0.00 0.00 56.93 56.96 1ynj s PHE 466 Cb 0.00 -2.08 -0.07 0.00 0.00 0.00 0.00 43.02 40.87 1ynj s PHE 466 CO 0.00 0.37 0.92 0.42 -0.00 0.00 0.00 175.22 176.94 1ynj s ILE 467 N 0.00 4.41 -0.07 0.64 1.01 -1.26 -1.57 121.20 124.36 1ynj s ILE 467 Ca 0.09 2.01 0.04 0.00 0.00 0.00 0.00 60.65 62.78 1ynj s ILE 467 Cb -0.11 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.07 1ynj s ILE 467 CO -0.00 0.38 -0.19 -0.13 0.00 0.00 0.00 174.94 175.00 1ynj s ARG 468 N -0.36 2.29 -0.06 2.79 0.52 0.54 -4.29 118.95 120.38 1ynj s ARG 468 Ca 0.44 -0.66 -0.03 0.00 -0.52 0.00 0.00 55.73 54.96 1ynj s ARG 468 Cb -0.24 -1.83 -0.04 0.00 0.52 0.00 0.00 34.95 33.37 1ynj s ARG 468 CO 0.29 0.15 0.08 0.99 0.02 0.00 0.00 175.30 176.83 1ynj s THR 469 N 0.37 4.84 0.36 0.02 2.01 -1.23 -1.19 115.64 120.82 1ynj s THR 469 Ca -0.14 -0.19 -0.26 0.00 0.31 0.00 0.00 61.69 61.41 1ynj s THR 469 Cb -0.16 -3.14 -0.09 0.00 0.01 0.00 0.00 72.50 69.12 1ynj s THR 469 CO 0.05 0.50 1.11 -2.16 -0.69 0.00 0.00 174.62 173.43 1ynj s PRO 470 N -1.31 4.30 0.14 4.92 0.04 -1.26 -1.95 135.00 139.88 1ynj s PRO 470 Ca 0.18 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.96 1ynj s PRO 470 Cb -0.12 -2.82 -0.04 0.00 0.04 0.00 0.00 34.50 31.56 1ynj s PRO 470 CO 0.08 -0.08 0.02 0.71 0.04 0.00 0.00 177.00 177.77 1ynj s TYR 471 N -1.40 0.97 -0.34 0.56 4.12 -0.71 -4.40 117.35 116.15 1ynj s TYR 471 Ca 0.53 -1.12 -0.04 0.00 0.02 0.00 0.00 57.07 56.45 1ynj s TYR 471 Cb -0.29 -0.56 0.06 0.00 -1.52 0.00 0.00 41.96 39.65 1ynj s TYR 471 CO 0.36 -0.37 0.10 0.50 0.02 0.00 0.00 175.55 176.16 1ynj s ARG 472 N -3.97 2.45 0.09 -0.62 3.52 0.11 0.11 118.95 120.64 1ynj s ARG 472 Ca 0.22 -1.34 -0.31 0.00 -0.13 0.00 0.00 55.73 54.17 1ynj s ARG 472 Cb 0.07 -3.41 -0.09 0.00 -1.56 0.00 0.00 34.95 29.96 1ynj s ARG 472 CO 0.01 -0.74 1.70 0.50 -0.81 0.00 0.00 175.30 175.96 1ynj s ARG 473 N 1.31 4.18 -0.43 5.12 3.52 -1.18 0.16 118.95 131.63 1ynj s ARG 473 Ca -0.01 2.42 -0.05 0.00 -0.13 0.00 0.00 55.73 57.96 1ynj s ARG 473 Cb -0.20 -3.57 0.11 0.00 -1.56 0.00 0.00 34.95 29.73 1ynj s ARG 473 CO 0.00 -0.76 0.24 0.14 -0.81 0.00 0.00 175.30 174.11 1ynj s VAL 474 N 2.58 3.53 -0.90 7.11 -7.23 0.78 -2.23 120.40 124.04 1ynj s VAL 474 Ca 0.76 -1.99 -0.26 0.00 -1.81 0.00 0.00 61.98 58.68 1ynj s VAL 474 Cb -0.42 -3.39 -0.13 0.00 0.56 0.00 0.00 36.38 32.99 1ynj s VAL 474 CO 0.33 -0.72 2.22 -0.75 -0.31 0.00 0.00 175.10 175.88 1ynj s LYS 475 N 1.20 1.77 -0.39 4.82 2.20 -0.68 -4.27 119.74 124.38 1ynj s LYS 475 Ca 0.08 0.03 -0.11 0.00 -0.36 0.00 0.00 55.97 55.60 1ynj s LYS 475 Cb -0.24 -4.91 0.02 0.00 -1.51 0.00 0.00 37.83 31.19 1ynj s LYS 475 CO -0.03 -4.42 0.22 0.27 -0.36 0.00 0.00 175.35 171.03 1ynj n ASN 476 N 17.64 -1.35 0.00 1.43 6.94 -1.26 -2.78 115.26 135.89 1ynj n ASN 476 Ca 0.44 -0.43 0.00 0.00 -0.02 0.00 0.00 54.58 54.58 1ynj n ASN 476 Cb 0.45 -0.52 0.00 0.00 -2.36 0.00 0.00 39.78 37.35 1ynj n ASN 476 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ynj n GLY 477 N -1.30 3.47 3.77 4.83 0.00 -1.26 -4.89 105.19 109.81 1ynj n GLY 477 Ca -0.04 -0.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 1ynj n GLY 477 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ynj s VAL 478 N 0.00 4.98 -0.69 1.61 -7.23 -1.12 -2.65 120.40 115.31 1ynj s VAL 478 Ca 0.00 1.09 -0.26 0.00 -1.81 0.00 0.00 61.98 61.00 1ynj s VAL 478 Cb 0.00 -3.86 0.04 0.00 0.56 0.00 0.00 36.38 33.13 1ynj s VAL 478 CO 0.00 0.45 1.15 -0.69 -0.31 0.00 0.00 175.10 175.70 1ynj s VAL 479 N -0.30 3.98 0.66 1.32 1.01 0.31 -1.69 120.40 125.69 1ynj s VAL 479 Ca 0.28 0.20 -0.14 0.00 0.00 0.00 0.00 61.98 62.32 1ynj s VAL 479 Cb -0.17 -4.80 -0.00 0.00 0.00 0.00 0.00 36.38 31.40 1ynj s VAL 479 CO 0.15 -1.64 1.09 -0.89 0.00 0.00 0.00 175.10 173.81 1ynj s THR 480 N 5.03 3.50 -0.81 3.92 2.01 -0.95 -4.79 115.64 123.55 1ynj s THR 480 Ca 0.31 0.65 0.25 0.00 0.31 0.00 0.00 61.69 63.21 1ynj s THR 480 Cb -0.11 -3.19 0.24 0.00 0.01 0.00 0.00 72.50 69.46 1ynj s THR 480 CO 0.15 -0.48 1.77 -1.84 -0.69 0.00 0.00 174.62 173.53 1ynj n GLU 481 N -2.52 0.13 -2.35 4.92 0.28 -1.26 -4.64 120.64 115.20 1ynj n GLU 481 Ca 0.09 0.19 -0.41 0.00 -0.16 0.00 0.00 57.16 56.87 1ynj n GLU 481 Cb 0.52 -1.68 -0.03 0.00 1.43 0.00 0.00 31.44 31.68 1ynj n GLU 481 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 1ynj s GLU 482 N -3.09 4.46 -0.16 3.44 -1.05 -1.26 -5.01 118.70 116.02 1ynj s GLU 482 Ca 0.10 1.88 -0.01 0.00 -0.15 0.00 0.00 54.97 56.80 1ynj s GLU 482 Cb 0.13 -3.26 -0.01 0.00 -0.44 0.00 0.00 34.13 30.56 1ynj s GLU 482 CO 0.49 -0.16 -0.13 0.08 0.95 0.00 0.00 175.26 176.49 1ynj s VAL 483 N 0.29 2.88 -0.31 1.83 1.01 -1.26 -3.11 120.40 121.72 1ynj s VAL 483 Ca 0.55 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1ynj s VAL 483 Cb -0.33 -2.23 0.09 0.00 0.00 0.00 0.00 36.38 33.91 1ynj s VAL 483 CO 0.35 0.50 -0.00 -0.69 0.00 0.00 0.00 175.10 175.26 1ynj s VAL 484 N 0.79 2.15 0.19 2.92 1.01 0.30 -4.86 120.40 122.91 1ynj s VAL 484 Ca -0.05 -2.05 -0.30 0.00 0.00 0.00 0.00 61.98 59.59 1ynj s VAL 484 Cb -0.15 -2.48 -0.08 0.00 0.00 0.00 0.00 36.38 33.66 1ynj s VAL 484 CO 0.01 -0.41 1.15 -0.31 0.00 0.00 0.00 175.10 175.53 1ynj s TYR 485 N 1.01 3.51 -0.02 5.22 1.51 -1.26 -1.74 117.35 125.59 1ynj s TYR 485 Ca 0.04 1.53 -0.18 0.00 -1.01 0.00 0.00 57.07 57.45 1ynj s TYR 485 Cb -0.19 -3.35 0.03 0.00 -0.11 0.00 0.00 41.96 38.34 1ynj s TYR 485 CO -0.08 -0.88 0.38 0.00 -1.11 0.00 0.00 175.55 173.85 1ynj s MET 486 N -0.42 0.74 1.03 -0.62 0.23 -0.82 -4.90 119.30 114.54 1ynj s MET 486 Ca 0.50 -0.12 -0.14 0.00 -1.03 0.00 0.00 55.69 54.91 1ynj s MET 486 Cb -0.31 0.33 0.11 0.00 -1.53 0.00 0.00 34.83 33.44 1ynj s MET 486 CO 0.36 -0.21 0.49 2.41 -2.03 0.00 0.00 175.02 176.04 1ynj n THR 487 N 1.19 0.00 0.25 3.16 -1.04 -1.26 -3.48 114.28 113.10 1ynj n THR 487 Ca -0.21 -0.23 0.10 0.00 -2.04 0.00 0.00 64.05 61.67 1ynj n THR 487 Cb 0.56 -0.73 0.63 0.00 -1.82 0.00 0.00 70.33 68.97 1ynj n THR 487 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ynj h ALA 488 N -1.94 1.39 0.08 2.41 0.00 -1.85 -3.14 119.26 116.20 1ynj h ALA 488 Ca -0.49 -0.15 -0.34 0.00 0.00 0.00 0.00 54.91 53.93 1ynj h ALA 488 Cb 1.31 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1ynj h ALA 488 CO 0.39 0.20 -1.89 -1.13 0.00 0.00 0.00 179.25 176.82 1ynj n SER 489 N -3.84 2.04 -0.75 0.00 3.41 -1.26 -4.14 113.62 109.07 1ynj n SER 489 Ca -0.02 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 1ynj n SER 489 Cb 0.26 -0.85 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 1ynj n SER 489 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ynj n GLU 490 N -3.74 0.42 0.00 4.33 1.02 -1.19 -1.90 120.64 119.59 1ynj n GLU 490 Ca -0.35 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.79 1ynj n GLU 490 Cb 0.94 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 31.11 1ynj n GLU 490 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1ynj n GLU 491 N 0.54 1.81 0.00 3.49 2.13 -1.20 -4.60 120.64 122.81 1ynj n GLU 491 Ca 0.00 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.88 1ynj n GLU 491 Cb 0.16 -0.74 0.34 0.00 0.27 0.00 0.00 31.44 31.47 1ynj n GLU 491 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1ynj n ASP 492 N -1.25 0.00 -0.01 4.31 10.43 -0.80 -2.54 116.55 126.69 1ynj n ASP 492 Ca 0.00 -0.80 0.00 0.00 2.57 0.00 0.00 54.79 56.56 1ynj n ASP 492 Cb 0.24 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.20 1ynj n ASP 492 CO 0.00 0.00 0.00 -2.11 -1.07 0.00 0.00 177.20 174.02 1ynj n ARG 493 N -0.81 1.29 -4.64 -1.24 1.85 -1.26 -4.24 116.66 107.61 1ynj n ARG 493 Ca 0.09 -1.08 -0.29 0.00 -1.00 0.00 0.00 57.85 55.57 1ynj n ARG 493 Cb 0.04 -1.01 -0.10 0.00 -1.05 0.00 0.00 32.46 30.34 1ynj n ARG 493 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1ynj s TYR 494 N -0.58 2.41 -0.33 2.89 1.51 -1.05 -5.08 117.35 117.12 1ynj s TYR 494 Ca 0.00 -0.72 0.03 0.00 -1.01 0.00 0.00 57.07 55.38 1ynj s TYR 494 Cb 0.00 -1.75 0.09 0.00 -0.11 0.00 0.00 41.96 40.20 1ynj s TYR 494 CO 0.00 0.41 0.04 0.99 -1.11 0.00 0.00 175.55 175.88 1ynj s THR 495 N -2.74 2.35 -0.22 -0.71 2.01 -1.26 -4.30 115.64 110.76 1ynj s THR 495 Ca 0.30 -2.21 -0.09 0.00 0.31 0.00 0.00 61.69 60.01 1ynj s THR 495 Cb 0.09 -2.67 -0.04 0.00 0.01 0.00 0.00 72.50 69.88 1ynj s THR 495 CO 0.16 -0.51 0.12 -0.63 -0.69 0.00 0.00 174.62 173.06 1ynj s ILE 496 N 0.95 5.04 0.17 1.82 1.09 -0.71 -1.77 121.20 127.79 1ynj s ILE 496 Ca 0.08 0.07 -0.22 0.00 -1.10 0.00 0.00 60.65 59.47 1ynj s ILE 496 Cb -0.19 -3.33 -0.08 0.00 -1.06 0.00 0.00 42.46 37.80 1ynj s ILE 496 CO -0.07 0.38 0.73 0.00 -0.10 0.00 0.00 174.94 175.87 1ynj s ALA 497 N 0.94 3.46 0.87 9.38 0.00 0.26 -1.62 121.76 135.05 1ynj s ALA 497 Ca 0.06 0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.15 1ynj s ALA 497 Cb -0.13 -2.86 0.12 0.00 0.00 0.00 0.00 23.12 20.24 1ynj s ALA 497 CO 0.03 0.32 1.10 -1.14 0.00 0.00 0.00 175.76 176.07 1ynj s GLN 498 N -1.44 1.42 0.03 0.00 2.00 -1.16 0.16 119.66 120.67 1ynj s GLN 498 Ca 0.37 1.06 0.01 0.00 -2.00 0.00 0.00 55.36 54.80 1ynj s GLN 498 Cb -0.20 -1.81 -0.26 0.00 0.80 0.00 0.00 33.01 31.54 1ynj s GLN 498 CO 0.23 -2.19 0.94 0.00 -0.50 0.00 0.00 175.29 173.77 1ynj h ALA 499 N -1.53 0.34 -0.93 1.58 0.00 -1.90 -3.29 119.26 113.54 1ynj h ALA 499 Ca -0.47 -1.10 0.27 0.00 0.00 0.00 0.00 54.91 53.61 1ynj h ALA 499 Cb 1.27 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 1ynj h ALA 499 CO 0.51 1.21 0.70 -0.91 0.00 0.00 0.00 179.25 180.76 1ynj h ASN 500 N 0.05 0.00 -2.07 0.00 4.21 -1.94 -3.42 115.58 112.41 1ynj h ASN 500 Ca -0.19 0.00 -0.64 0.00 1.21 0.00 0.00 56.30 56.68 1ynj h ASN 500 Cb 1.96 0.00 0.09 0.00 -1.12 0.00 0.00 38.32 39.25 1ynj h ASN 500 CO 0.15 0.00 0.26 0.41 -1.29 0.00 0.00 177.43 176.95 1ynj n THR 501 N -4.13 1.11 -0.57 2.81 -1.04 -1.24 -5.02 114.28 106.21 1ynj n THR 501 Ca 0.19 -0.28 -0.11 0.00 -2.04 0.00 0.00 64.05 61.81 1ynj n THR 501 Cb 1.03 -0.90 0.10 0.00 -1.82 0.00 0.00 70.33 68.73 1ynj n THR 501 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1ynj n PRO 502 N 1.58 -2.09 -3.56 -2.82 -0.02 -1.26 -5.04 135.00 121.78 1ynj n PRO 502 Ca 0.14 -0.64 -0.09 0.00 -2.02 0.00 0.00 63.50 60.89 1ynj n PRO 502 Cb 0.26 -0.64 -0.04 0.00 -0.02 0.00 0.00 33.50 33.06 1ynj n PRO 502 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ynj s LEU 503 N 0.00 -0.35 -0.28 2.45 1.43 -1.26 -4.32 118.68 116.36 1ynj s LEU 503 Ca 0.27 0.25 -0.01 0.00 -1.03 0.00 0.00 54.13 53.61 1ynj s LEU 503 Cb -0.03 1.86 0.04 0.00 0.03 0.00 0.00 46.19 48.09 1ynj s LEU 503 CO 0.21 -0.41 -0.04 -1.83 0.23 0.00 0.00 176.35 174.51 1ynj s GLU 504 N -1.78 2.55 1.31 1.70 -1.05 0.19 -4.76 118.70 116.86 1ynj s GLU 504 Ca 0.01 -1.17 0.00 0.00 -0.15 0.00 0.00 54.97 53.66 1ynj s GLU 504 Cb -0.01 -3.07 0.00 0.00 -0.44 0.00 0.00 34.13 30.62 1ynj s GLU 504 CO -0.02 -0.53 0.00 0.41 0.95 0.00 0.00 175.26 176.07 1ynj n GLY 505 N 4.61 0.93 0.18 -3.83 0.00 -1.26 -1.65 105.19 104.18 1ynj n GLY 505 Ca -0.14 0.49 0.02 0.00 0.00 0.00 0.00 46.02 46.39 1ynj n GLY 505 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ynj n ASP 506 N 3.44 0.89 -3.88 1.61 8.00 -1.26 -5.09 116.55 120.26 1ynj n ASP 506 Ca 0.00 -1.99 -0.10 0.00 0.71 0.00 0.00 54.79 53.41 1ynj n ASP 506 Cb 0.00 -0.17 -0.09 0.00 -0.02 0.00 0.00 41.12 40.85 1ynj n ASP 506 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ynj s ARG 507 N -0.84 0.68 0.34 -1.24 1.70 -0.66 0.12 118.95 119.05 1ynj s ARG 507 Ca 0.07 -0.75 -0.29 0.00 -0.47 0.00 0.00 55.73 54.30 1ynj s ARG 507 Cb 0.06 0.27 -0.12 0.00 -0.57 0.00 0.00 34.95 34.60 1ynj s ARG 507 CO 0.01 -0.19 1.47 -0.89 -1.08 0.00 0.00 175.30 174.61 1ynj n ILE 508 N 0.57 1.66 -0.05 4.99 5.41 -1.08 0.57 119.36 131.42 1ynj n ILE 508 Ca -0.18 -0.41 -0.06 0.00 1.00 0.00 0.00 62.75 63.10 1ynj n ILE 508 Cb 0.59 -1.84 -0.08 0.00 -0.71 0.00 0.00 39.64 37.60 1ynj n ILE 508 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ynj n ALA 509 N 0.98 1.74 -1.97 -1.39 0.00 -1.26 -4.60 120.51 114.01 1ynj n ALA 509 Ca 0.05 -0.68 -0.22 0.00 0.00 0.00 0.00 53.44 52.58 1ynj n ALA 509 Cb 0.37 0.05 0.06 0.00 0.00 0.00 0.00 19.45 19.92 1ynj n ALA 509 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1ynj s THR 510 N -2.26 2.50 -0.19 0.00 -1.32 -1.26 -4.98 115.64 108.14 1ynj s THR 510 Ca -0.07 -0.59 0.18 0.00 -1.21 0.00 0.00 61.69 60.01 1ynj s THR 510 Cb 0.03 -2.91 -0.27 0.00 -1.51 0.00 0.00 72.50 67.85 1ynj s THR 510 CO 0.42 0.00 0.47 0.47 -2.21 0.00 0.00 174.62 173.77 1ynj n ASP 511 N -2.53 0.81 -3.60 8.08 8.00 -1.26 -4.72 116.55 121.32 1ynj n ASP 511 Ca 0.09 -0.18 -0.29 0.00 0.71 0.00 0.00 54.79 55.13 1ynj n ASP 511 Cb 0.60 1.67 -0.08 0.00 -0.02 0.00 0.00 41.12 43.29 1ynj n ASP 511 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ynj n ARG 512 N -2.00 2.48 -2.20 -1.24 3.00 -1.26 -4.41 116.66 111.02 1ynj n ARG 512 Ca -0.02 -4.62 -0.42 0.00 -0.01 0.00 0.00 57.85 52.78 1ynj n ARG 512 Cb 0.44 -2.29 -0.03 0.00 0.00 0.00 0.00 32.46 30.59 1ynj n ARG 512 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1ynj s VAL 513 N -2.20 3.81 0.30 1.55 1.01 -0.06 -4.72 120.40 120.09 1ynj s VAL 513 Ca 0.35 1.08 -0.26 0.00 0.00 0.00 0.00 61.98 63.15 1ynj s VAL 513 Cb 0.09 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.68 1ynj s VAL 513 CO -0.05 -0.06 0.91 -0.69 0.00 0.00 0.00 175.10 175.22 1ynj s VAL 514 N 3.23 4.24 -0.14 2.92 1.01 -1.26 -0.69 120.40 129.72 1ynj s VAL 514 Ca 0.65 1.78 -0.34 0.00 0.00 0.00 0.00 61.98 64.07 1ynj s VAL 514 Cb -0.30 -4.02 0.13 0.00 0.00 0.00 0.00 36.38 32.19 1ynj s VAL 514 CO 0.24 0.19 1.24 0.00 0.00 0.00 0.00 175.10 176.77 1ynj s ALA 515 N -1.56 -2.13 0.37 5.51 0.00 -0.23 -2.99 121.76 120.75 1ynj s ALA 515 Ca 0.48 1.32 0.08 0.00 0.00 0.00 0.00 51.96 53.84 1ynj s ALA 515 Cb -0.19 0.03 -0.07 0.00 0.00 0.00 0.00 23.12 22.89 1ynj s ALA 515 CO 0.24 -0.74 -0.00 -0.98 0.00 0.00 0.00 175.76 174.28 1ynj s ARG 516 N -2.41 1.97 -0.17 0.00 1.70 -0.64 0.10 118.95 119.50 1ynj s ARG 516 Ca 0.11 -1.94 -0.10 0.00 -0.47 0.00 0.00 55.73 53.33 1ynj s ARG 516 Cb 0.01 -1.77 0.06 0.00 -0.57 0.00 0.00 34.95 32.68 1ynj s ARG 516 CO -0.04 0.04 0.42 -0.98 -1.08 0.00 0.00 175.30 173.66 1ynj s ARG 517 N -3.70 0.42 0.00 3.89 1.70 -1.03 -1.74 118.95 118.48 1ynj s ARG 517 Ca 0.35 0.79 0.00 0.00 -0.47 0.00 0.00 55.73 56.40 1ynj s ARG 517 Cb 0.05 0.01 0.00 0.00 -0.57 0.00 0.00 34.95 34.43 1ynj s ARG 517 CO 0.18 -0.15 0.00 0.54 -1.08 0.00 0.00 175.30 174.79 1ynj n ARG 518 N 4.15 0.00 0.00 3.89 1.74 -1.26 -2.91 116.66 122.27 1ynj n ARG 518 Ca -0.22 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 1ynj n ARG 518 Cb 0.56 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.00 1ynj n ARG 518 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ynj n GLY 519 N 0.00 0.18 3.69 -0.13 0.00 -1.26 -4.83 105.19 102.84 1ynj n GLY 519 Ca 0.00 -0.11 -0.44 0.00 0.00 0.00 0.00 46.02 45.46 1ynj n GLY 519 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ynj n GLU 520 N -1.56 2.39 -1.92 1.61 -0.58 -1.14 -4.95 120.64 114.48 1ynj n GLU 520 Ca 0.00 0.86 -0.42 0.00 -0.42 0.00 0.00 57.16 57.18 1ynj n GLU 520 Cb 0.00 -2.66 -0.03 0.00 -0.57 0.00 0.00 31.44 28.18 1ynj n GLU 520 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 1ynj s PRO 521 N 0.99 4.20 -0.01 3.49 0.02 -1.26 -2.47 135.00 139.95 1ynj s PRO 521 Ca 0.77 2.35 0.03 0.00 0.02 0.00 0.00 61.00 64.17 1ynj s PRO 521 Cb -0.61 -3.43 -0.00 0.00 0.02 0.00 0.00 34.50 30.47 1ynj s PRO 521 CO 0.36 -0.69 -0.09 0.08 -0.33 0.00 0.00 177.00 176.33 1ynj s VAL 522 N 2.07 0.71 -0.13 3.83 1.01 0.29 -4.97 120.40 123.21 1ynj s VAL 522 Ca 0.73 -0.37 -0.14 0.00 0.00 0.00 0.00 61.98 62.20 1ynj s VAL 522 Cb -0.41 -0.61 -0.05 0.00 0.00 0.00 0.00 36.38 35.31 1ynj s VAL 522 CO 0.32 0.21 0.32 0.27 0.00 0.00 0.00 175.10 176.21 1ynj s ILE 523 N -0.12 5.27 -0.03 2.22 -5.25 -1.26 -1.06 121.20 120.97 1ynj s ILE 523 Ca 0.02 0.61 -0.09 0.00 -0.99 0.00 0.00 60.65 60.20 1ynj s ILE 523 Cb -0.04 -3.64 0.01 0.00 2.95 0.00 0.00 42.46 41.73 1ynj s ILE 523 CO -0.00 0.43 0.19 -0.69 -1.79 0.00 0.00 174.94 173.08 1ynj s VAL 524 N 0.15 0.05 0.29 8.37 1.01 0.14 -4.99 120.40 125.42 1ynj s VAL 524 Ca 0.18 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.46 1ynj s VAL 524 Cb -0.14 -0.42 -0.10 0.00 0.00 0.00 0.00 36.38 35.73 1ynj s VAL 524 CO 0.06 -0.23 1.29 0.00 0.00 0.00 0.00 175.10 176.22 1ynj s ALA 525 N -0.85 3.50 0.22 5.51 0.00 -1.26 -0.88 121.76 128.00 1ynj s ALA 525 Ca -0.09 1.18 -0.14 0.00 0.00 0.00 0.00 51.96 52.91 1ynj s ALA 525 Cb -0.05 -3.46 0.26 0.00 0.00 0.00 0.00 23.12 19.86 1ynj s ALA 525 CO 0.02 -0.56 1.60 -1.35 0.00 0.00 0.00 175.76 175.47 1ynj h PRO 526 N 3.99 -0.04 0.00 0.00 0.11 -1.87 0.37 132.00 134.56 1ynj h PRO 526 Ca -0.47 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ynj h PRO 526 Cb 1.22 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ynj h PRO 526 CO 0.69 -0.02 -0.01 0.93 -0.21 0.00 0.00 178.00 179.37 1ynj h GLU 527 N -0.04 0.00 -0.58 1.05 3.07 -1.93 -2.23 114.58 113.93 1ynj h GLU 527 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1ynj h GLU 527 Cb 0.54 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 1ynj h GLU 527 CO -0.75 0.01 0.00 -1.91 -1.40 0.00 0.00 179.01 174.97 1ynj n GLU 528 N -3.16 2.52 -4.57 2.33 2.13 0.13 -4.82 120.64 115.20 1ynj n GLU 528 Ca -0.02 -1.62 -0.33 0.00 0.66 0.00 0.00 57.16 55.86 1ynj n GLU 528 Cb 0.17 -1.60 -0.11 0.00 0.27 0.00 0.00 31.44 30.17 1ynj n GLU 528 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1ynj s VAL 529 N -1.69 3.54 -0.09 6.31 1.01 -0.84 -4.78 120.40 123.86 1ynj s VAL 529 Ca 0.29 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1ynj s VAL 529 Cb 0.19 -2.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 1ynj s VAL 529 CO 0.14 0.47 -0.08 -1.84 0.00 0.00 0.00 175.10 173.80 1ynj n GLU 530 N 1.83 0.21 -4.35 2.72 0.28 -0.73 -4.57 120.64 116.03 1ynj n GLU 530 Ca -0.16 0.05 -0.18 0.00 -0.16 0.00 0.00 57.16 56.71 1ynj n GLU 530 Cb 0.53 -1.14 -0.10 0.00 1.43 0.00 0.00 31.44 32.16 1ynj n GLU 530 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1ynj s PHE 531 N -2.17 1.64 -0.02 -1.84 2.99 -1.16 -0.16 117.98 117.27 1ynj s PHE 531 Ca -0.12 -0.99 -0.01 0.00 0.00 0.00 0.00 56.93 55.81 1ynj s PHE 531 Cb 0.03 -0.99 0.01 0.00 0.00 0.00 0.00 43.02 42.07 1ynj s PHE 531 CO 0.19 -0.10 0.05 1.41 -0.00 0.00 0.00 175.22 176.77 1ynj s MET 532 N -3.91 0.04 0.41 0.44 -2.45 0.41 0.91 119.30 115.15 1ynj s MET 532 Ca 0.32 0.08 -0.26 0.00 -1.25 0.00 0.00 55.69 54.58 1ynj s MET 532 Cb 0.07 -0.00 -0.10 0.00 1.25 0.00 0.00 34.83 36.04 1ynj s MET 532 CO 0.11 -0.02 1.35 -0.25 1.05 0.00 0.00 175.02 177.26 1ynj n ASP 533 N 3.18 3.00 0.03 1.11 9.92 0.12 0.09 116.55 134.01 1ynj n ASP 533 Ca -0.14 1.15 -0.11 0.00 -0.53 0.00 0.00 54.79 55.16 1ynj n ASP 533 Cb 0.59 -1.54 -0.14 0.00 -0.64 0.00 0.00 41.12 39.39 1ynj n ASP 533 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 1ynj h VAL 534 N 2.38 1.15 -2.85 2.53 2.07 -1.92 -3.40 116.25 116.22 1ynj h VAL 534 Ca -0.49 -2.90 0.03 0.00 0.82 0.00 0.00 66.70 64.17 1ynj h VAL 534 Cb 1.28 2.64 -0.11 0.00 -1.52 0.00 0.00 31.29 33.57 1ynj h VAL 534 CO 0.61 0.74 0.27 -0.55 0.02 0.00 0.00 177.57 178.66 1ynj s SER 535 N -6.57 -0.45 0.45 0.57 0.15 -1.26 -4.59 113.70 101.99 1ynj s SER 535 Ca -0.06 -0.14 0.17 0.00 0.70 0.00 0.00 55.95 56.63 1ynj s SER 535 Cb 0.08 0.59 1.07 0.00 -1.71 0.00 0.00 66.02 66.04 1ynj s SER 535 CO 0.83 -0.99 1.99 1.55 1.20 0.00 0.00 173.24 177.82 1ynj h PRO 536 N 2.00 0.00 -0.55 5.44 0.13 -1.91 -3.07 132.00 134.03 1ynj h PRO 536 Ca -0.29 0.00 0.16 0.00 -0.87 0.00 0.00 66.00 65.00 1ynj h PRO 536 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1ynj h PRO 536 CO 0.33 0.20 0.50 0.87 -0.23 0.00 0.00 178.00 179.67 1ynj h LYS 537 N 0.00 0.00 -1.24 0.86 1.57 -1.95 0.31 116.57 116.12 1ynj h LYS 537 Ca -0.00 0.00 0.39 0.00 -1.87 0.00 0.00 60.65 59.17 1ynj h LYS 537 Cb 0.38 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.57 1ynj h LYS 537 CO 0.03 0.00 0.79 1.96 -0.57 0.00 0.00 179.45 181.66 1ynj h GLN 538 N 0.00 0.16 0.00 3.15 4.20 -1.91 -3.14 115.11 117.57 1ynj h GLN 538 Ca 0.26 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 58.81 1ynj h GLN 538 Cb 1.26 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.97 1ynj h GLN 538 CO -0.00 0.11 -1.06 0.28 -0.67 0.00 0.00 178.83 177.48 1ynj h VAL 539 N 0.17 0.72 -1.94 -0.54 2.07 -0.63 -3.31 116.25 112.79 1ynj h VAL 539 Ca 0.76 -2.19 -0.58 0.00 0.82 0.00 0.00 66.70 65.51 1ynj h VAL 539 Cb 2.28 2.24 -0.10 0.00 -1.52 0.00 0.00 31.29 34.18 1ynj h VAL 539 CO -0.39 0.41 -0.61 -0.36 0.02 0.00 0.00 177.57 176.64 1ynj s PHE 540 N -2.91 2.57 1.21 1.57 0.40 -1.19 -4.24 117.98 115.39 1ynj s PHE 540 Ca -0.00 -0.42 -0.16 0.00 -0.60 0.00 0.00 56.93 55.75 1ynj s PHE 540 Cb 0.08 -1.48 0.29 0.00 0.51 0.00 0.00 43.02 42.43 1ynj s PHE 540 CO 0.79 0.48 1.02 0.45 0.70 0.00 0.00 175.22 178.65 1ynj s SER 541 N -3.72 0.66 0.08 1.36 0.15 -1.26 -2.86 113.70 108.10 1ynj s SER 541 Ca 0.35 1.17 -0.35 0.00 0.70 0.00 0.00 55.95 57.82 1ynj s SER 541 Cb -0.01 -1.78 -0.17 0.00 -1.71 0.00 0.00 66.02 62.35 1ynj s SER 541 CO 0.20 -4.35 1.59 -0.07 1.20 0.00 0.00 173.24 171.81 1ynj h LEU 542 N -2.73 -1.13 -0.61 3.45 -0.00 -1.92 0.07 115.31 112.45 1ynj h LEU 542 Ca -0.55 0.07 -0.05 0.00 -0.00 0.00 0.00 57.88 57.36 1ynj h LEU 542 Cb 1.33 0.35 -0.03 0.00 -0.00 0.00 0.00 40.66 42.31 1ynj h LEU 542 CO 0.45 -0.65 0.20 0.78 -0.00 0.00 0.00 178.44 179.22 1ynj h ASN 543 N -1.01 0.88 0.29 -0.43 4.21 -1.94 -0.89 115.58 116.69 1ynj h ASN 543 Ca -0.08 -0.20 -0.01 0.00 1.21 0.00 0.00 56.30 57.23 1ynj h ASN 543 Cb 0.84 -0.23 -0.00 0.00 -1.12 0.00 0.00 38.32 37.81 1ynj h ASN 543 CO 0.04 0.85 -0.03 0.74 -1.29 0.00 0.00 177.43 177.74 1ynj h THR 544 N 0.87 0.19 0.00 2.81 2.02 -1.84 -0.68 112.91 116.28 1ynj h THR 544 Ca 0.20 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1ynj h THR 544 Cb 0.28 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1ynj h THR 544 CO -0.01 0.03 0.00 -3.20 0.37 0.00 0.00 175.52 172.71 1ynj n ASN 545 N -3.30 0.26 -0.22 4.18 2.85 0.01 -3.70 115.26 115.34 1ynj n ASN 545 Ca -0.02 0.53 0.14 0.00 -0.11 0.00 0.00 54.58 55.11 1ynj n ASN 545 Cb 0.16 -0.59 0.52 0.00 1.24 0.00 0.00 39.78 41.10 1ynj n ASN 545 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1ynj n LEU 546 N -1.74 0.82 -4.53 1.20 4.77 -0.26 -4.79 117.00 112.46 1ynj n LEU 546 Ca 0.06 -0.17 -0.43 0.00 -0.03 0.00 0.00 56.01 55.44 1ynj n LEU 546 Cb 0.36 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.29 1ynj n LEU 546 CO 0.28 0.15 0.85 -0.63 -1.33 0.00 0.00 177.39 176.71 1ynj s ILE 547 N -2.39 4.26 0.60 -0.08 1.01 -1.24 -4.63 121.20 118.72 1ynj s ILE 547 Ca 0.29 0.42 0.30 0.00 0.00 0.00 0.00 60.65 61.66 1ynj s ILE 547 Cb 0.20 -4.61 0.36 0.00 0.01 0.00 0.00 42.46 38.42 1ynj s ILE 547 CO 0.47 -1.22 2.13 1.55 0.00 0.00 0.00 174.94 177.86 1ynj h PRO 548 N 9.41 0.00 -0.61 2.79 0.13 -1.83 -2.49 132.00 139.40 1ynj h PRO 548 Ca -0.26 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.46 1ynj h PRO 548 Cb 1.07 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.78 1ynj h PRO 548 CO 1.13 0.00 -0.96 1.19 -0.23 0.00 0.00 178.00 179.13 1ynj n PHE 549 N -3.70 2.05 -0.28 1.56 0.99 -1.26 -4.49 117.46 112.33 1ynj n PHE 549 Ca 0.01 -2.19 0.06 0.00 -0.00 0.00 0.00 57.45 55.33 1ynj n PHE 549 Cb 0.29 -0.29 0.17 0.00 -1.00 0.00 0.00 39.48 38.65 1ynj n PHE 549 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1ynj h LEU 550 N 2.39 -0.43 -0.82 4.37 5.85 -1.80 0.74 115.31 125.60 1ynj h LEU 550 Ca 0.13 0.22 0.30 0.00 0.84 0.00 0.00 57.88 59.37 1ynj h LEU 550 Cb 1.41 0.39 -0.10 0.00 0.37 0.00 0.00 40.66 42.73 1ynj h LEU 550 CO 0.49 -0.22 0.50 -0.62 -0.34 0.00 0.00 178.44 178.25 1ynj n GLU 551 N -5.40 -0.03 -0.11 1.25 1.02 -1.26 0.11 120.64 116.22 1ynj n GLU 551 Ca 0.15 0.86 0.12 0.00 -0.02 0.00 0.00 57.16 58.27 1ynj n GLU 551 Cb 0.51 -1.64 0.17 0.00 -0.02 0.00 0.00 31.44 30.46 1ynj n GLU 551 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1ynj n HIS 552 N -4.19 0.30 -4.15 -0.32 8.25 0.26 -4.89 115.22 110.48 1ynj n HIS 552 Ca 0.26 -0.16 -0.34 0.00 -0.26 0.00 0.00 57.72 57.22 1ynj n HIS 552 Cb 0.97 -0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.97 1ynj n HIS 552 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1ynj s ASP 553 N -1.65 5.23 0.33 0.41 1.01 0.12 -2.45 116.67 119.67 1ynj s ASP 553 Ca 0.34 -0.03 -0.28 0.00 0.71 0.00 0.00 52.55 53.29 1ynj s ASP 553 Cb 0.21 -1.88 -0.13 0.00 1.01 0.00 0.00 42.92 42.13 1ynj s ASP 553 CO 0.30 0.15 1.14 -0.67 0.21 0.00 0.00 175.17 176.31 1ynj n ASP 554 N 3.66 1.97 0.28 0.27 -0.08 0.09 -4.77 116.55 117.97 1ynj n ASP 554 Ca -0.17 1.17 0.16 0.00 -1.51 0.00 0.00 54.79 54.45 1ynj n ASP 554 Cb 0.52 -1.39 0.75 0.00 2.34 0.00 0.00 41.12 43.34 1ynj n ASP 554 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ynj h ALA 555 N 2.18 1.05 0.40 -1.67 0.00 -1.92 -1.73 119.26 117.57 1ynj h ALA 555 Ca -0.43 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1ynj h ALA 555 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ynj h ALA 555 CO 0.61 0.07 -0.19 -0.91 0.00 0.00 0.00 179.25 178.82 1ynj h ASN 556 N 0.00 -0.46 0.44 0.00 2.35 -1.99 -2.52 115.58 113.40 1ynj h ASN 556 Ca -0.00 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.62 1ynj h ASN 556 Cb 0.44 0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 1ynj h ASN 556 CO 0.01 -0.16 -0.17 -0.09 -1.65 0.00 0.00 177.43 175.37 1ynj h ARG 557 N -0.77 0.00 -0.15 0.81 9.65 -1.79 -1.91 114.38 120.22 1ynj h ARG 557 Ca -0.06 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.82 1ynj h ARG 557 Cb 0.52 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.10 1ynj h ARG 557 CO 0.09 0.17 0.07 0.00 2.80 0.00 0.00 179.97 183.10 1ynj h ALA 558 N 1.83 0.20 -0.28 2.80 0.00 -1.32 -0.80 119.26 121.69 1ynj h ALA 558 Ca -0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1ynj h ALA 558 Cb 0.43 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1ynj h ALA 558 CO 0.02 -0.24 0.05 1.37 0.00 0.00 0.00 179.25 180.46 1ynj h LEU 559 N 0.12 0.36 -0.37 0.00 8.10 -0.90 0.42 115.31 123.03 1ynj h LEU 559 Ca 0.05 -0.04 -0.03 0.00 0.11 0.00 0.00 57.88 57.97 1ynj h LEU 559 Cb 0.12 -0.09 -0.02 0.00 -0.44 0.00 0.00 40.66 40.23 1ynj h LEU 559 CO -0.01 0.39 0.12 0.24 -4.11 0.00 0.00 178.44 175.07 1ynj h MET 560 N 0.40 0.58 0.00 0.17 2.86 -1.10 -2.60 114.93 115.24 1ynj h MET 560 Ca 0.09 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1ynj h MET 560 Cb 0.18 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1ynj h MET 560 CO -0.00 0.58 0.00 0.41 1.06 0.00 0.00 176.91 178.96 1ynj n GLY 561 N -0.67 -1.47 0.08 8.32 0.00 -0.34 -3.48 105.19 107.64 1ynj n GLY 561 Ca -0.01 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 1ynj n GLY 561 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1ynj h SER 562 N 0.00 -0.04 -0.92 1.61 0.87 0.10 -3.34 113.55 111.83 1ynj h SER 562 Ca 0.00 -0.50 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 1ynj h SER 562 Cb 0.50 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1ynj h SER 562 CO 0.00 0.68 0.00 0.59 -0.53 0.00 0.00 176.83 177.57 1ynj n ASN 563 N -4.74 -0.81 0.00 6.23 3.02 -1.01 -3.73 115.26 114.22 1ynj n ASN 563 Ca -0.06 -0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.23 1ynj n ASN 563 Cb 0.26 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1ynj n ASN 563 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1ynj n MET 564 N -1.06 0.00 0.23 3.52 2.81 -1.23 -4.26 117.12 117.13 1ynj n MET 564 Ca 0.00 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 55.98 1ynj n MET 564 Cb 0.00 -0.29 0.54 0.00 -0.71 0.00 0.00 33.22 32.76 1ynj n MET 564 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1ynj h GLN 565 N 0.00 0.00 0.00 0.03 4.20 -1.68 -2.57 115.11 115.09 1ynj h GLN 565 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ynj h GLN 565 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1ynj h GLN 565 CO 0.00 0.23 -0.22 2.41 -0.67 0.00 0.00 178.83 180.58 1ynj n THR 566 N -3.67 0.14 1.01 -0.54 -1.04 -1.26 -2.39 114.28 106.54 1ynj n THR 566 Ca -0.01 -0.08 0.11 0.00 -2.04 0.00 0.00 64.05 62.02 1ynj n THR 566 Cb 0.35 -0.26 0.03 0.00 -1.82 0.00 0.00 70.33 68.62 1ynj n THR 566 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ynj n GLN 567 N -1.70 0.16 -2.19 -2.82 6.02 -0.98 -4.56 117.38 111.31 1ynj n GLN 567 Ca 0.06 -0.13 -0.42 0.00 -0.01 0.00 0.00 57.00 56.50 1ynj n GLN 567 Cb 0.37 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.10 1ynj n GLN 567 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ynj s ALA 568 N -2.92 2.82 0.46 -1.58 0.00 -1.00 -0.81 121.76 118.72 1ynj s ALA 568 Ca 0.11 -0.17 -0.23 0.00 0.00 0.00 0.00 51.96 51.68 1ynj s ALA 568 Cb 0.17 -4.04 -0.08 0.00 0.00 0.00 0.00 23.12 19.17 1ynj s ALA 568 CO 0.77 -2.78 1.13 0.14 0.00 0.00 0.00 175.76 175.03 1ynj s VAL 569 N 6.56 3.26 0.56 0.00 -7.23 -0.27 -4.44 120.40 118.85 1ynj s VAL 569 Ca 0.67 0.93 -0.18 0.00 -1.81 0.00 0.00 61.98 61.59 1ynj s VAL 569 Cb -0.16 -3.46 -0.05 0.00 0.56 0.00 0.00 36.38 33.27 1ynj s VAL 569 CO 0.30 -0.03 1.08 -2.16 -0.31 0.00 0.00 175.10 173.98 1ynj s PRO 570 N -2.73 3.38 0.21 4.82 0.04 -1.26 -4.69 135.00 134.77 1ynj s PRO 570 Ca 0.63 1.38 0.10 0.00 0.04 0.00 0.00 61.00 63.15 1ynj s PRO 570 Cb -0.26 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 1ynj s PRO 570 CO 0.32 -0.79 -0.20 -0.51 0.04 0.00 0.00 177.00 175.86 1ynj s LEU 571 N -4.11 2.50 0.13 -3.56 1.02 -1.26 -4.62 118.68 108.78 1ynj s LEU 571 Ca 0.67 -0.94 -0.16 0.00 0.02 0.00 0.00 54.13 53.72 1ynj s LEU 571 Cb -0.19 -0.99 -0.01 0.00 0.02 0.00 0.00 46.19 45.02 1ynj s LEU 571 CO 0.30 0.02 1.69 0.40 0.02 0.00 0.00 176.35 178.78 1ynj h ILE 572 N 2.85 1.18 -0.98 -0.59 2.04 -1.76 -1.63 117.51 118.61 1ynj h ILE 572 Ca -0.42 -0.53 -0.67 0.00 1.00 0.00 0.00 64.86 64.24 1ynj h ILE 572 Cb 1.22 0.84 -0.30 0.00 -0.74 0.00 0.00 36.82 37.85 1ynj h ILE 572 CO 0.54 0.19 0.78 0.54 0.00 0.00 0.00 178.15 180.21 1ynj n ARG 573 N -4.69 2.72 -1.61 2.37 1.74 -1.26 -5.03 116.66 110.90 1ynj n ARG 573 Ca -0.01 -3.33 -0.42 0.00 -0.77 0.00 0.00 57.85 53.33 1ynj n ARG 573 Cb 0.12 -2.28 0.01 0.00 -1.02 0.00 0.00 32.46 29.29 1ynj n ARG 573 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ynj n ALA 574 N -0.92 0.14 -3.47 7.54 0.00 -0.62 -4.95 120.51 118.23 1ynj n ALA 574 Ca 0.62 0.25 -0.13 0.00 0.00 0.00 0.00 53.44 54.18 1ynj n ALA 574 Cb 0.71 -2.07 -0.14 0.00 0.00 0.00 0.00 19.45 17.95 1ynj n ALA 574 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1ynj s GLN 575 N -1.94 0.12 0.32 0.00 -2.07 -0.79 -4.66 119.66 110.64 1ynj s GLN 575 Ca 0.62 0.31 -0.29 0.00 -1.82 0.00 0.00 55.36 54.18 1ynj s GLN 575 Cb -0.58 -0.08 -0.10 0.00 -1.09 0.00 0.00 33.01 31.16 1ynj s GLN 575 CO 0.57 -0.11 1.38 0.00 -1.32 0.00 0.00 175.29 175.81 1ynj s ALA 576 N 0.77 3.54 0.66 2.60 0.00 -1.26 -4.28 121.76 123.79 1ynj s ALA 576 Ca -0.06 1.34 -0.17 0.00 0.00 0.00 0.00 51.96 53.07 1ynj s ALA 576 Cb -0.08 -3.52 -0.00 0.00 0.00 0.00 0.00 23.12 19.52 1ynj s ALA 576 CO -0.04 -0.75 1.23 -1.25 0.00 0.00 0.00 175.76 174.95 1ynj s PRO 577 N -1.50 2.57 0.44 0.00 0.04 -1.26 -4.84 135.00 130.45 1ynj s PRO 577 Ca 0.52 1.85 0.11 0.00 0.04 0.00 0.00 61.00 63.52 1ynj s PRO 577 Cb -0.42 -1.87 0.96 0.00 0.04 0.00 0.00 34.50 33.21 1ynj s PRO 577 CO 0.53 -1.53 2.04 -0.39 0.04 0.00 0.00 177.00 177.69 1ynj h VAL 578 N 0.37 1.09 -3.36 -0.36 -1.51 -1.91 -3.38 116.25 107.19 1ynj h VAL 578 Ca -0.50 -0.32 -0.63 0.00 -1.23 0.00 0.00 66.70 64.03 1ynj h VAL 578 Cb 1.31 0.88 -0.40 0.00 -2.13 0.00 0.00 31.29 30.94 1ynj h VAL 578 CO 0.53 0.11 -0.72 -0.69 -1.23 0.00 0.00 177.57 175.57 1ynj s VAL 579 N -5.12 1.81 0.68 7.19 1.01 -1.26 -0.08 120.40 124.63 1ynj s VAL 579 Ca -0.06 -2.32 0.04 0.00 0.00 0.00 0.00 61.98 59.63 1ynj s VAL 579 Cb 0.17 -2.31 0.12 0.00 0.00 0.00 0.00 36.38 34.36 1ynj s VAL 579 CO 0.71 -0.71 0.94 -0.04 0.00 0.00 0.00 175.10 176.00 1ynj s MET 580 N 0.77 1.84 0.00 2.72 1.00 0.45 -4.60 119.30 121.47 1ynj s MET 580 Ca 0.13 -1.39 0.00 0.00 0.00 0.00 0.00 55.69 54.43 1ynj s MET 580 Cb -0.21 -2.45 0.00 0.00 0.00 0.00 0.00 34.83 32.17 1ynj s MET 580 CO -0.09 -1.29 0.08 0.25 0.00 0.00 0.00 175.02 173.96 1ynj n THR 581 N -2.64 0.00 0.00 2.05 -2.24 -1.26 0.11 114.28 110.30 1ynj n THR 581 Ca 0.16 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1ynj n THR 581 Cb 0.61 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 1ynj n THR 581 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ynj n GLY 582 N 0.57 3.38 0.01 3.38 0.00 -1.26 -4.25 105.19 107.03 1ynj n GLY 582 Ca 0.00 -0.99 0.09 0.00 0.00 0.00 0.00 46.02 45.13 1ynj n GLY 582 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ynj n LEU 583 N 0.00 0.08 0.04 0.99 4.77 -1.26 -3.87 117.00 117.76 1ynj n LEU 583 Ca 0.00 0.52 0.15 0.00 -0.03 0.00 0.00 56.01 56.65 1ynj n LEU 583 Cb 0.00 -0.50 0.63 0.00 -2.33 0.00 0.00 43.42 41.22 1ynj n LEU 583 CO 0.00 -0.21 1.16 1.05 -1.33 0.00 0.00 177.39 178.05 1ynj h GLU 584 N 0.00 0.09 0.12 3.23 9.09 -1.96 0.69 114.58 125.84 1ynj h GLU 584 Ca 0.00 -0.01 -0.23 0.00 0.05 0.00 0.00 59.36 59.18 1ynj h GLU 584 Cb 0.34 -0.02 0.02 0.00 -1.65 0.00 0.00 28.75 27.44 1ynj h GLU 584 CO 0.00 0.06 -0.97 1.49 0.05 0.00 0.00 179.01 179.64 1ynj h GLU 585 N 0.09 0.45 -0.12 1.06 4.22 -1.79 0.20 114.58 118.69 1ynj h GLU 585 Ca 0.20 -0.64 -0.19 0.00 0.08 0.00 0.00 59.36 58.80 1ynj h GLU 585 Cb 0.66 0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1ynj h GLU 585 CO -0.02 1.28 -0.72 -0.09 -2.18 0.00 0.00 179.01 177.28 1ynj h ARG 586 N -0.07 0.57 -0.47 1.92 9.65 -1.11 -2.33 114.38 122.54 1ynj h ARG 586 Ca -0.16 -0.45 0.07 0.00 -1.10 0.00 0.00 59.98 58.35 1ynj h ARG 586 Cb 1.71 0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 30.32 1ynj h ARG 586 CO 0.18 1.07 0.14 0.28 2.80 0.00 0.00 179.97 184.44 1ynj h VAL 587 N 0.40 0.81 -0.30 0.20 2.07 0.12 0.83 116.25 120.37 1ynj h VAL 587 Ca -0.03 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 1ynj h VAL 587 Cb 1.31 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1ynj h VAL 587 CO 0.13 0.05 -0.00 0.58 0.02 0.00 0.00 177.57 178.35 1ynj h VAL 588 N 0.30 1.18 0.19 2.57 2.07 -1.63 -2.65 116.25 118.28 1ynj h VAL 588 Ca 0.23 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1ynj h VAL 588 Cb 0.25 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1ynj h VAL 588 CO -0.25 0.24 -0.09 -0.09 0.02 0.00 0.00 177.57 177.40 1ynj h ARG 589 N 0.44 -0.25 0.00 1.57 9.65 -0.36 -3.21 114.38 122.21 1ynj h ARG 589 Ca 0.10 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1ynj h ARG 589 Cb 0.30 0.06 0.00 0.00 -1.39 0.00 0.00 29.97 28.93 1ynj h ARG 589 CO 0.01 0.08 0.00 -0.25 2.80 0.00 0.00 179.97 182.61 1ynj n ASP 590 N -5.05 0.19 0.18 -3.80 9.92 -0.01 -2.27 116.55 115.72 1ynj n ASP 590 Ca -0.09 0.54 0.12 0.00 -0.53 0.00 0.00 54.79 54.83 1ynj n ASP 590 Cb 0.24 -0.58 0.14 0.00 -0.64 0.00 0.00 41.12 40.28 1ynj n ASP 590 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 1ynj h SER 591 N 0.00 0.00 -5.05 -2.24 4.64 -1.48 -3.45 113.55 105.97 1ynj h SER 591 Ca 0.00 -0.01 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 1ynj h SER 591 Cb 0.38 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.42 1ynj h SER 591 CO 0.00 0.00 -0.51 0.18 -0.87 0.00 0.00 176.83 175.64 1ynj n LEU 592 N -2.93 -1.55 0.06 5.97 4.77 -0.96 -4.84 117.00 117.51 1ynj n LEU 592 Ca 0.03 -0.26 -0.02 0.00 -0.03 0.00 0.00 56.01 55.74 1ynj n LEU 592 Cb 0.53 -2.19 -0.06 0.00 -2.33 0.00 0.00 43.42 39.37 1ynj n LEU 592 CO 0.35 0.11 -0.03 0.00 -1.33 0.00 0.00 177.39 176.49 1ynj h ALA 593 N 0.98 0.63 -2.60 -1.18 0.00 -1.86 -3.46 119.26 111.77 1ynj h ALA 593 Ca -0.41 -0.82 -0.55 0.00 0.00 0.00 0.00 54.91 53.13 1ynj h ALA 593 Cb 1.28 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 1ynj h ALA 593 CO 0.49 0.97 -0.21 0.00 0.00 0.00 0.00 179.25 180.50 1ynj s ALA 594 N -2.86 3.68 -0.22 0.00 0.00 -1.26 -4.10 121.76 117.00 1ynj s ALA 594 Ca -0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 51.96 51.40 1ynj s ALA 594 Cb 0.08 -2.27 -0.05 0.00 0.00 0.00 0.00 23.12 20.89 1ynj s ALA 594 CO 0.80 0.55 0.14 -1.17 0.00 0.00 0.00 175.76 176.08 1ynj s LEU 595 N -2.84 4.12 0.11 0.00 2.96 -1.11 -4.96 118.68 116.96 1ynj s LEU 595 Ca 0.44 0.14 0.08 0.00 -0.22 0.00 0.00 54.13 54.57 1ynj s LEU 595 Cb -0.12 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 1ynj s LEU 595 CO 0.24 0.11 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.87 1ynj s TYR 596 N 0.79 1.76 0.85 5.38 1.51 -1.26 -0.68 117.35 125.70 1ynj s TYR 596 Ca 0.07 -0.43 -0.13 0.00 -1.01 0.00 0.00 57.07 55.57 1ynj s TYR 596 Cb -0.13 -0.95 0.07 0.00 -0.11 0.00 0.00 41.96 40.84 1ynj s TYR 596 CO 0.02 0.22 0.93 0.00 -1.11 0.00 0.00 175.55 175.61 1ynj n ALA 597 N 0.93 -0.93 -0.13 3.71 0.00 -0.97 -4.85 120.51 118.28 1ynj n ALA 597 Ca -0.18 -0.42 -0.26 0.00 0.00 0.00 0.00 53.44 52.58 1ynj n ALA 597 Cb 0.54 -2.09 -0.11 0.00 0.00 0.00 0.00 19.45 17.80 1ynj n ALA 597 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ynj n GLU 598 N -2.74 0.61 -3.31 0.00 1.02 -1.26 -4.38 120.64 110.58 1ynj n GLU 598 Ca 0.11 0.28 -0.08 0.00 -0.02 0.00 0.00 57.16 57.45 1ynj n GLU 598 Cb 0.51 -1.54 -0.06 0.00 -0.02 0.00 0.00 31.44 30.33 1ynj n GLU 598 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1ynj s GLU 599 N -2.50 0.40 -0.08 3.49 2.56 -1.21 -4.79 118.70 116.57 1ynj s GLU 599 Ca -0.36 0.32 -0.03 0.00 0.00 0.00 0.00 54.97 54.90 1ynj s GLU 599 Cb 0.12 -0.32 -0.02 0.00 2.00 0.00 0.00 34.13 35.92 1ynj s GLU 599 CO 0.54 -0.88 0.23 -0.40 -0.56 0.00 0.00 175.26 174.20 1ynj n ASP 600 N 5.36 0.03 0.00 -1.70 5.75 -1.08 -4.11 116.55 120.80 1ynj n ASP 600 Ca -0.01 0.03 0.00 0.00 -0.01 0.00 0.00 54.79 54.80 1ynj n ASP 600 Cb 0.50 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.50 1ynj n ASP 600 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ynj n GLY 601 N 0.61 5.48 2.94 6.12 0.00 -1.25 -3.71 105.19 115.38 1ynj n GLY 601 Ca 0.06 -1.21 -0.14 0.00 0.00 0.00 0.00 46.02 44.72 1ynj n GLY 601 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ynj s GLU 602 N 4.82 0.11 0.25 1.61 2.12 0.14 -1.38 118.70 126.37 1ynj s GLU 602 Ca 0.00 0.49 -0.30 0.00 0.36 0.00 0.00 54.97 55.52 1ynj s GLU 602 Cb 0.00 -0.18 -0.11 0.00 0.26 0.00 0.00 34.13 34.11 1ynj s GLU 602 CO 0.00 -0.21 1.54 0.08 -0.54 0.00 0.00 175.26 176.13 1ynj s VAL 603 N 1.59 2.37 -0.12 3.70 1.01 -0.09 0.58 120.40 129.44 1ynj s VAL 603 Ca -0.05 0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.15 1ynj s VAL 603 Cb -0.11 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.02 1ynj s VAL 603 CO -0.07 0.04 -0.18 0.52 0.00 0.00 0.00 175.10 175.41 1ynj n VAL 604 N 2.58 0.91 -5.17 2.92 0.31 0.97 -2.70 118.33 118.15 1ynj n VAL 604 Ca 0.09 -0.10 -0.31 0.00 -0.01 0.00 0.00 64.34 64.02 1ynj n VAL 604 Cb 0.38 -1.76 -0.16 0.00 -0.91 0.00 0.00 33.84 31.40 1ynj n VAL 604 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1ynj s LYS 605 N -2.30 2.00 -0.23 5.55 1.02 0.14 -4.32 119.74 121.59 1ynj s LYS 605 Ca -0.19 -0.99 -0.03 0.00 0.02 0.00 0.00 55.97 54.78 1ynj s LYS 605 Cb 0.06 -2.02 0.12 0.00 -0.52 0.00 0.00 37.83 35.48 1ynj s LYS 605 CO 0.24 0.54 0.34 0.08 -0.92 0.00 0.00 175.35 175.64 1ynj s VAL 606 N -0.68 -0.54 0.17 3.17 1.01 -1.26 0.11 120.40 122.39 1ynj s VAL 606 Ca 0.11 -0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.90 1ynj s VAL 606 Cb -0.10 -0.76 0.01 0.00 0.00 0.00 0.00 36.38 35.53 1ynj s VAL 606 CO 0.00 -0.12 0.40 1.51 0.00 0.00 0.00 175.10 176.89 1ynj s ASP 607 N 2.50 -0.11 0.20 3.32 -4.77 -0.12 -4.96 116.67 112.72 1ynj s ASP 607 Ca 0.10 -0.65 0.02 0.00 -3.30 0.00 0.00 52.55 48.73 1ynj s ASP 607 Cb -0.15 0.50 0.11 0.00 -1.09 0.00 0.00 42.92 42.29 1ynj s ASP 607 CO -0.15 -0.96 0.77 0.61 0.70 0.00 0.00 175.17 176.14 1ynj n GLY 608 N -0.27 -0.24 0.20 2.12 0.00 -1.26 -1.35 105.19 104.39 1ynj n GLY 608 Ca -0.09 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.85 1ynj n GLY 608 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ynj n THR 609 N -1.54 1.46 -4.28 2.61 -1.04 -1.26 -4.81 114.28 105.42 1ynj n THR 609 Ca -0.00 0.13 -0.23 0.00 -2.04 0.00 0.00 64.05 61.91 1ynj n THR 609 Cb 0.56 -2.23 -0.12 0.00 -1.82 0.00 0.00 70.33 66.72 1ynj n THR 609 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ynj s ARG 610 N -2.78 1.12 -0.14 -2.82 1.70 -0.46 -0.11 118.95 115.46 1ynj s ARG 610 Ca -0.26 -1.19 0.02 0.00 -0.47 0.00 0.00 55.73 53.83 1ynj s ARG 610 Cb 0.04 -1.32 0.01 0.00 -0.57 0.00 0.00 34.95 33.12 1ynj s ARG 610 CO 0.39 0.30 -0.22 0.42 -1.08 0.00 0.00 175.30 175.11 1ynj s ILE 611 N -1.35 2.04 -0.14 4.99 1.01 -0.62 -0.95 121.20 126.18 1ynj s ILE 611 Ca 0.07 -0.97 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1ynj s ILE 611 Cb -0.09 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 40.58 1ynj s ILE 611 CO 0.04 0.55 -0.19 0.00 0.00 0.00 0.00 174.94 175.34 1ynj s ALA 612 N 0.86 2.09 -0.01 9.38 0.00 0.12 0.20 121.76 134.40 1ynj s ALA 612 Ca -0.06 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 50.97 1ynj s ALA 612 Cb -0.15 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 21.97 1ynj s ALA 612 CO -0.03 -0.11 -0.22 0.54 0.00 0.00 0.00 175.76 175.94 1ynj s VAL 613 N 0.96 1.74 -0.64 0.00 0.11 -0.91 -0.02 120.40 121.65 1ynj s VAL 613 Ca -0.05 -0.98 -0.21 0.00 -2.93 0.00 0.00 61.98 57.82 1ynj s VAL 613 Cb -0.15 -1.45 0.09 0.00 -1.53 0.00 0.00 36.38 33.33 1ynj s VAL 613 CO -0.04 0.46 0.86 -0.60 -3.33 0.00 0.00 175.10 172.45 1ynj s ARG 614 N -0.60 3.09 -0.01 1.54 3.52 0.20 -2.97 118.95 123.72 1ynj s ARG 614 Ca 0.08 -1.06 -0.30 0.00 -0.13 0.00 0.00 55.73 54.32 1ynj s ARG 614 Cb -0.09 -4.26 -0.04 0.00 -1.56 0.00 0.00 34.95 29.00 1ynj s ARG 614 CO -0.00 -1.71 1.20 0.71 -0.81 0.00 0.00 175.30 174.69 1ynj s TYR 615 N 3.46 3.28 -0.28 5.12 1.51 -1.25 0.25 117.35 129.44 1ynj s TYR 615 Ca 0.18 1.24 -0.18 0.00 -1.01 0.00 0.00 57.07 57.30 1ynj s TYR 615 Cb -0.20 -3.42 -0.09 0.00 -0.11 0.00 0.00 41.96 38.14 1ynj s TYR 615 CO 0.08 -1.32 1.02 -0.85 -1.11 0.00 0.00 175.55 173.38 1ynj n GLU 616 N 4.70 0.00 0.00 -0.62 -0.00 -1.24 -1.39 120.64 122.09 1ynj n GLU 616 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.26 1ynj n GLU 616 Cb 0.46 -0.68 0.00 0.00 -0.00 0.00 0.00 31.44 31.23 1ynj n GLU 616 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1ynj n ASP 617 N 3.70 0.00 -3.05 -1.84 5.68 -1.26 -4.80 116.55 114.99 1ynj n ASP 617 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.55 1ynj n ASP 617 Cb -0.01 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1ynj n ASP 617 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ynj n GLY 618 N 0.00 0.61 7.00 6.12 0.00 -0.49 -4.77 105.19 113.67 1ynj n GLY 618 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ynj n GLY 618 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ynj n ARG 619 N 2.97 0.00 -3.67 1.61 -4.01 -1.26 -4.69 116.66 107.61 1ynj n ARG 619 Ca 0.00 0.00 -0.09 0.00 -1.04 0.00 0.00 57.85 56.72 1ynj n ARG 619 Cb 0.00 0.00 -0.10 0.00 -3.04 0.00 0.00 32.46 29.32 1ynj n ARG 619 CO 0.00 0.00 0.00 -1.17 -3.04 0.00 0.00 177.63 173.42 1ynj s LEU 620 N 0.00 -0.46 0.04 2.89 0.20 -1.26 -3.76 118.68 116.33 1ynj s LEU 620 Ca 0.00 0.98 0.07 0.00 0.69 0.00 0.00 54.13 55.86 1ynj s LEU 620 Cb 0.00 1.39 -0.03 0.00 -0.43 0.00 0.00 46.19 47.11 1ynj s LEU 620 CO 0.00 -0.22 -0.16 -0.69 -0.29 0.00 0.00 176.35 174.99 1ynj s VAL 621 N 2.14 2.92 -0.21 1.68 1.01 -1.16 -5.03 120.40 121.75 1ynj s VAL 621 Ca -0.05 -1.16 -0.07 0.00 0.00 0.00 0.00 61.98 60.70 1ynj s VAL 621 Cb -0.10 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1ynj s VAL 621 CO -0.13 0.32 0.06 -0.70 0.00 0.00 0.00 175.10 174.65 1ynj s GLU 622 N -1.51 3.82 -0.47 2.72 2.12 -1.26 -2.14 118.70 121.98 1ynj s GLU 622 Ca 0.15 -0.41 -0.13 0.00 0.36 0.00 0.00 54.97 54.94 1ynj s GLU 622 Cb -0.11 -3.25 0.09 0.00 0.26 0.00 0.00 34.13 31.13 1ynj s GLU 622 CO 0.06 0.07 0.37 -1.01 -0.54 0.00 0.00 175.26 174.21 1ynj s HIS 623 N 0.93 3.29 0.15 5.30 3.76 0.13 -4.98 115.29 123.87 1ynj s HIS 623 Ca 0.04 -1.29 -0.30 0.00 -0.15 0.00 0.00 55.06 53.36 1ynj s HIS 623 Cb -0.14 -3.27 -0.08 0.00 1.11 0.00 0.00 32.58 30.20 1ynj s HIS 623 CO 0.03 -0.88 1.28 -1.25 -0.85 0.00 0.00 174.74 173.06 1ynj s PRO 624 N 1.54 4.41 -0.09 8.40 0.04 -1.26 -1.59 135.00 146.44 1ynj s PRO 624 Ca 0.04 1.96 -0.25 0.00 0.04 0.00 0.00 61.00 62.79 1ynj s PRO 624 Cb -0.25 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 31.01 1ynj s PRO 624 CO 0.04 -0.25 0.79 -0.51 0.04 0.00 0.00 177.00 177.10 1ynj s LEU 625 N 0.34 4.27 0.13 -3.56 1.02 0.84 -4.97 118.68 116.75 1ynj s LEU 625 Ca 0.58 1.25 -0.31 0.00 0.02 0.00 0.00 54.13 55.67 1ynj s LEU 625 Cb -0.34 -3.20 -0.08 0.00 0.02 0.00 0.00 46.19 42.59 1ynj s LEU 625 CO 0.34 -0.24 1.32 -0.13 0.02 0.00 0.00 176.35 177.67 1ynj s ARG 626 N 1.32 4.37 -0.17 1.70 0.52 -1.26 -4.91 118.95 120.52 1ynj s ARG 626 Ca 0.40 2.00 -0.04 0.00 -0.52 0.00 0.00 55.73 57.57 1ynj s ARG 626 Cb -0.18 -3.25 0.06 0.00 0.52 0.00 0.00 34.95 32.09 1ynj s ARG 626 CO 0.17 -0.34 0.07 1.03 0.02 0.00 0.00 175.30 176.25 1ynj s ARG 627 N 0.75 0.26 -1.35 3.54 1.81 -1.26 -0.60 118.95 122.09 1ynj s ARG 627 Ca 0.61 -0.15 -0.05 0.00 -1.72 0.00 0.00 55.73 54.42 1ynj s ARG 627 Cb -0.35 -1.81 0.02 0.00 -0.45 0.00 0.00 34.95 32.36 1ynj s ARG 627 CO 0.32 -0.63 0.91 0.66 -0.68 0.00 0.00 175.30 175.89 1ynj n TYR 628 N 5.20 -2.23 -3.04 -0.53 4.02 -1.20 -4.98 117.16 114.40 1ynj n TYR 628 Ca -0.07 0.91 -0.23 0.00 -0.01 0.00 0.00 57.90 58.49 1ynj n TYR 628 Cb 0.49 -4.54 0.01 0.00 -0.02 0.00 0.00 39.34 35.27 1ynj n TYR 628 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1ynj s ALA 629 N -3.46 3.71 -0.25 -0.72 0.00 -0.03 -4.93 121.76 116.08 1ynj s ALA 629 Ca 0.26 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 1ynj s ALA 629 Cb -0.13 -2.17 0.02 0.00 0.00 0.00 0.00 23.12 20.84 1ynj s ALA 629 CO 0.79 -0.30 -0.03 0.50 0.00 0.00 0.00 175.76 176.71 1ynj s ARG 630 N -4.52 2.96 0.79 0.00 3.52 -1.26 -1.19 118.95 119.24 1ynj s ARG 630 Ca 0.46 -0.90 -0.11 0.00 -0.13 0.00 0.00 55.73 55.05 1ynj s ARG 630 Cb -0.10 -3.06 0.06 0.00 -1.56 0.00 0.00 34.95 30.29 1ynj s ARG 630 CO 0.38 -0.38 1.08 -1.12 -0.81 0.00 0.00 175.30 174.46 1ynj s SER 631 N 1.38 4.51 0.49 -2.12 0.01 -1.26 -4.85 113.70 111.86 1ynj s SER 631 Ca 0.01 1.55 0.23 0.00 1.31 0.00 0.00 55.95 59.06 1ynj s SER 631 Cb -0.16 -2.30 1.28 0.00 0.21 0.00 0.00 66.02 65.04 1ynj s SER 631 CO -0.03 -1.99 1.92 0.78 0.41 0.00 0.00 173.24 174.33 1ynj h ASN 632 N -1.10 0.17 -0.67 2.44 -0.26 -1.87 0.14 115.58 114.43 1ynj h ASN 632 Ca -0.46 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.30 1ynj h ASN 632 Cb 1.25 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 38.49 1ynj h ASN 632 CO 0.56 0.08 0.00 0.00 -1.06 0.00 0.00 177.43 177.01 1ynj n GLN 633 N -4.40 3.32 -2.47 0.81 1.13 -1.26 -4.93 117.38 109.57 1ynj n GLN 633 Ca 0.15 -2.79 -0.01 0.00 -1.94 0.00 0.00 57.00 52.42 1ynj n GLN 633 Cb 0.71 -1.75 0.00 0.00 0.11 0.00 0.00 30.24 29.31 1ynj n GLN 633 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ynj n GLY 634 N 1.30 0.81 0.10 1.08 0.00 0.49 -4.99 105.19 103.97 1ynj n GLY 634 Ca 0.25 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 1ynj n GLY 634 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ynj n THR 635 N -2.82 1.30 -0.95 2.61 -1.04 -1.25 -2.40 114.28 109.72 1ynj n THR 635 Ca -0.00 -0.73 0.00 0.00 -2.04 0.00 0.00 64.05 61.28 1ynj n THR 635 Cb 0.50 -0.70 0.00 0.00 -1.82 0.00 0.00 70.33 68.32 1ynj n THR 635 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ynj n ALA 636 N -2.81 -1.42 -2.46 2.41 0.00 -1.25 -4.51 120.51 110.47 1ynj n ALA 636 Ca -0.33 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.69 1ynj n ALA 636 Cb 1.07 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.49 1ynj n ALA 636 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ynj s PHE 637 N -1.64 3.43 -0.29 0.00 5.36 -0.34 -4.86 117.98 119.63 1ynj s PHE 637 Ca 0.00 1.34 -0.14 0.00 -0.96 0.00 0.00 56.93 57.17 1ynj s PHE 637 Cb 0.00 -3.38 0.10 0.00 -0.34 0.00 0.00 43.02 39.40 1ynj s PHE 637 CO 0.00 -1.13 0.69 0.34 -1.46 0.00 0.00 175.22 173.66 1ynj s ASP 638 N 1.12 -1.01 0.07 6.13 2.15 -1.26 -0.85 116.67 123.02 1ynj s ASP 638 Ca 0.57 1.52 -0.10 0.00 0.43 0.00 0.00 52.55 54.97 1ynj s ASP 638 Cb -0.28 1.74 -0.06 0.00 -0.30 0.00 0.00 42.92 44.02 1ynj s ASP 638 CO 0.28 -0.23 0.39 -1.10 -0.17 0.00 0.00 175.17 174.34 1ynj s GLN 639 N 2.12 3.75 -0.03 4.34 -0.21 0.23 -3.79 119.66 126.07 1ynj s GLN 639 Ca -0.08 0.16 0.05 0.00 0.02 0.00 0.00 55.36 55.51 1ynj s GLN 639 Cb -0.08 -3.02 -0.01 0.00 1.00 0.00 0.00 33.01 30.91 1ynj s GLN 639 CO -0.19 0.58 -0.19 1.03 -2.12 0.00 0.00 175.29 174.39 1ynj s ARG 640 N -1.85 1.75 0.25 2.91 0.52 -1.16 -4.84 118.95 116.53 1ynj s ARG 640 Ca 0.32 -0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 54.55 1ynj s ARG 640 Cb -0.14 -1.60 -0.09 0.00 0.52 0.00 0.00 34.95 33.64 1ynj s ARG 640 CO 0.18 0.36 1.25 -2.14 0.02 0.00 0.00 175.30 174.97 1ynj s PRO 641 N -0.26 4.44 -0.15 3.54 0.02 -1.26 -0.45 135.00 140.89 1ynj s PRO 641 Ca 0.03 2.03 0.15 0.00 0.02 0.00 0.00 61.00 63.23 1ynj s PRO 641 Cb -0.10 -3.16 0.32 0.00 0.02 0.00 0.00 34.50 31.58 1ynj s PRO 641 CO 0.01 -0.12 1.17 0.54 -0.33 0.00 0.00 177.00 178.26 1ynj n ARG 642 N 1.83 1.27 -3.80 5.54 5.12 -0.88 -4.86 116.66 120.88 1ynj n ARG 642 Ca 0.03 -2.72 -0.13 0.00 -1.93 0.00 0.00 57.85 53.10 1ynj n ARG 642 Cb 0.43 -1.43 -0.11 0.00 -1.16 0.00 0.00 32.46 30.19 1ynj n ARG 642 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1ynj s VAL 643 N -2.74 0.02 0.35 1.55 1.01 -1.25 -4.93 120.40 114.42 1ynj s VAL 643 Ca 0.32 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.16 1ynj s VAL 643 Cb 0.30 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 36.26 1ynj s VAL 643 CO -0.01 -0.10 0.52 -0.60 0.00 0.00 0.00 175.10 174.91 1ynj s ARG 644 N -0.31 3.23 0.06 2.72 6.06 -1.26 -4.97 118.95 124.49 1ynj s ARG 644 Ca -0.04 -0.71 -0.31 0.00 -2.50 0.00 0.00 55.73 52.17 1ynj s ARG 644 Cb -0.03 -2.74 -0.07 0.00 0.06 0.00 0.00 34.95 32.17 1ynj s ARG 644 CO 0.01 0.06 1.49 0.08 -2.50 0.00 0.00 175.30 174.44 1ynj s VAL 645 N -2.26 3.31 -0.58 7.11 1.01 -1.26 -3.69 120.40 124.04 1ynj s VAL 645 Ca 0.43 0.81 -0.03 0.00 0.00 0.00 0.00 61.98 63.19 1ynj s VAL 645 Cb -0.10 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1ynj s VAL 645 CO 0.33 0.02 0.52 0.61 0.00 0.00 0.00 175.10 176.58 1ynj n GLY 646 N 3.73 -0.50 2.99 4.51 0.00 -1.10 -5.05 105.19 109.77 1ynj n GLY 646 Ca 0.14 0.23 -0.16 0.00 0.00 0.00 0.00 46.02 46.23 1ynj n GLY 646 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ynj s GLN 647 N -3.59 0.50 0.04 1.61 -2.07 -1.23 -4.95 119.66 109.96 1ynj s GLN 647 Ca 0.19 -0.33 -0.30 0.00 -1.82 0.00 0.00 55.36 53.10 1ynj s GLN 647 Cb -0.03 -0.44 -0.04 0.00 -1.09 0.00 0.00 33.01 31.41 1ynj s GLN 647 CO 0.45 0.11 1.07 -0.98 -1.32 0.00 0.00 175.29 174.62 1ynj s ARG 648 N -0.45 4.52 -0.14 9.60 1.70 -1.26 -0.91 118.95 132.00 1ynj s ARG 648 Ca -0.00 1.58 -0.07 0.00 -0.47 0.00 0.00 55.73 56.76 1ynj s ARG 648 Cb -0.04 -3.40 -0.04 0.00 -0.57 0.00 0.00 34.95 30.90 1ynj s ARG 648 CO -0.00 -0.11 0.13 0.14 -1.08 0.00 0.00 175.30 174.38 1ynj s VAL 649 N 0.90 5.39 -0.96 4.99 -7.23 -0.48 -4.96 120.40 118.05 1ynj s VAL 649 Ca 0.54 0.17 -0.24 0.00 -1.81 0.00 0.00 61.98 60.64 1ynj s VAL 649 Cb -0.25 -3.38 -0.00 0.00 0.56 0.00 0.00 36.38 33.31 1ynj s VAL 649 CO 0.29 0.57 1.72 -0.54 -0.31 0.00 0.00 175.10 176.82 1ynj s LYS 650 N -0.61 3.04 0.00 4.82 1.02 -1.26 -3.89 119.74 122.86 1ynj s LYS 650 Ca 0.13 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.41 1ynj s LYS 650 Cb -0.12 -5.21 0.00 0.00 -0.52 0.00 0.00 37.83 31.99 1ynj s LYS 650 CO 0.02 -2.84 0.00 1.17 -0.92 0.00 0.00 175.35 172.78 1ynj n LYS 651 N 8.86 0.00 -3.19 1.68 3.00 -1.26 0.15 118.16 127.40 1ynj n LYS 651 Ca 0.37 0.00 -0.20 0.00 -0.00 0.00 0.00 58.31 58.48 1ynj n LYS 651 Cb 0.49 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.45 1ynj n LYS 651 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ynj n GLY 652 N 0.00 1.45 3.47 3.14 0.00 -1.26 -2.65 105.19 109.34 1ynj n GLY 652 Ca 0.00 -0.84 -0.23 0.00 0.00 0.00 0.00 46.02 44.95 1ynj n GLY 652 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ynj s ASP 653 N 0.04 3.33 -0.45 1.61 -1.08 0.12 -4.64 116.67 115.60 1ynj s ASP 653 Ca 0.32 -1.12 -0.37 0.00 -0.52 0.00 0.00 52.55 50.87 1ynj s ASP 653 Cb 0.05 -0.27 -0.14 0.00 -1.46 0.00 0.00 42.92 41.10 1ynj s ASP 653 CO -0.16 -0.15 2.23 0.00 0.52 0.00 0.00 175.17 177.62 1ynj n LEU 654 N -0.64 1.59 0.04 -1.34 -0.00 -1.26 -2.30 117.00 113.09 1ynj n LEU 654 Ca -0.05 0.42 -0.14 0.00 -0.00 0.00 0.00 56.01 56.23 1ynj n LEU 654 Cb 0.62 -1.15 -0.14 0.00 -0.00 0.00 0.00 43.42 42.75 1ynj n LEU 654 CO 0.40 -0.79 -0.39 -0.07 -0.00 0.00 0.00 177.39 176.54 1ynj h LEU 655 N 11.79 0.26 -7.54 1.47 4.07 -1.23 -3.44 115.31 120.69 1ynj h LEU 655 Ca -0.20 -0.41 -0.08 0.00 0.08 0.00 0.00 57.88 57.27 1ynj h LEU 655 Cb 1.35 -0.09 -0.16 0.00 1.08 0.00 0.00 40.66 42.84 1ynj h LEU 655 CO 1.08 1.35 -0.21 0.00 -1.08 0.00 0.00 178.44 179.58 1ynj s ALA 656 N -2.61 -0.71 0.38 1.53 0.00 -0.44 -2.07 121.76 117.84 1ynj s ALA 656 Ca -0.09 -0.06 0.01 0.00 0.00 0.00 0.00 51.96 51.82 1ynj s ALA 656 Cb 0.07 0.43 -0.02 0.00 0.00 0.00 0.00 23.12 23.60 1ynj s ALA 656 CO 0.83 -0.48 0.58 -0.51 0.00 0.00 0.00 175.76 176.18 1ynj s ASP 657 N -2.33 6.07 0.00 0.00 1.01 0.40 -2.75 116.67 119.07 1ynj s ASP 657 Ca -0.02 0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.54 1ynj s ASP 657 Cb 0.01 -1.73 0.00 0.00 1.01 0.00 0.00 42.92 42.20 1ynj s ASP 657 CO -0.06 -0.47 0.00 0.61 0.21 0.00 0.00 175.17 175.46 1ynj n GLY 658 N -1.88 0.88 0.10 0.21 0.00 -1.26 -3.00 105.19 100.24 1ynj n GLY 658 Ca -0.02 -1.79 -0.15 0.00 0.00 0.00 0.00 46.02 44.06 1ynj n GLY 658 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ynj h PRO 659 N 0.00 0.19 -2.60 1.61 0.13 -1.82 -3.38 132.00 126.12 1ynj h PRO 659 Ca 0.00 -0.21 -0.69 0.00 -0.87 0.00 0.00 66.00 64.23 1ynj h PRO 659 Cb 0.00 0.06 -0.36 0.00 0.13 0.00 0.00 31.00 30.83 1ynj h PRO 659 CO 0.00 0.95 0.00 0.00 -0.23 0.00 0.00 178.00 178.72 1ynj n ALA 660 N -2.55 4.49 -3.36 -0.56 0.00 -1.26 -4.33 120.51 112.94 1ynj n ALA 660 Ca -0.10 -4.77 -0.12 0.00 0.00 0.00 0.00 53.44 48.44 1ynj n ALA 660 Cb 0.53 -1.55 -0.11 0.00 0.00 0.00 0.00 19.45 18.31 1ynj n ALA 660 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ynj s SER 661 N -1.98 -0.34 -0.16 0.00 0.15 -1.26 -1.49 113.70 108.62 1ynj s SER 661 Ca 0.35 0.65 0.01 0.00 0.70 0.00 0.00 55.95 57.66 1ynj s SER 661 Cb 0.09 0.62 0.03 0.00 -1.71 0.00 0.00 66.02 65.05 1ynj s SER 661 CO 0.02 -0.13 -0.14 -0.70 1.20 0.00 0.00 173.24 173.49 1ynj s GLU 662 N 0.53 2.35 -0.81 5.44 2.12 -0.23 -4.61 118.70 123.48 1ynj s GLU 662 Ca -0.03 -0.66 -0.07 0.00 0.36 0.00 0.00 54.97 54.57 1ynj s GLU 662 Cb -0.04 -2.24 0.01 0.00 0.26 0.00 0.00 34.13 32.11 1ynj s GLU 662 CO -0.03 -0.27 0.14 0.39 -0.54 0.00 0.00 175.26 174.94 1ynj n GLU 663 N 4.73 -0.82 0.00 4.30 1.02 -1.26 -0.75 120.64 127.86 1ynj n GLU 663 Ca -0.17 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 56.93 1ynj n GLU 663 Cb 0.49 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 1ynj n GLU 663 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ynj n GLY 664 N -1.79 3.20 3.92 0.62 0.00 -1.26 -5.02 105.19 104.86 1ynj n GLY 664 Ca -0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1ynj n GLY 664 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ynj s PHE 665 N -2.04 3.51 0.18 1.61 0.40 0.07 -4.49 117.98 117.22 1ynj s PHE 665 Ca 0.00 0.59 -0.30 0.00 -0.60 0.00 0.00 56.93 56.62 1ynj s PHE 665 Cb 0.00 -2.09 -0.08 0.00 0.51 0.00 0.00 43.02 41.36 1ynj s PHE 665 CO 0.00 0.02 1.31 -1.17 0.70 0.00 0.00 175.22 176.08 1ynj s LEU 666 N -4.18 4.41 -0.51 -0.37 2.96 0.69 -1.07 118.68 120.61 1ynj s LEU 666 Ca 0.44 2.37 0.06 0.00 -0.22 0.00 0.00 54.13 56.78 1ynj s LEU 666 Cb -0.10 -3.61 0.22 0.00 0.50 0.00 0.00 46.19 43.20 1ynj s LEU 666 CO 0.36 -0.54 0.53 0.00 -1.32 0.00 0.00 176.35 175.38 1ynj n ALA 667 N 2.86 3.11 1.64 5.97 0.00 -0.55 -4.08 120.51 129.45 1ynj n ALA 667 Ca 0.07 -3.86 0.14 0.00 0.00 0.00 0.00 53.44 49.80 1ynj n ALA 667 Cb 0.43 -0.86 0.81 0.00 0.00 0.00 0.00 19.45 19.83 1ynj n ALA 667 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ynj n LEU 668 N 1.73 0.00 0.00 0.00 4.77 -1.26 -4.35 117.00 117.89 1ynj n LEU 668 Ca 0.25 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1ynj n LEU 668 Cb 0.46 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1ynj n LEU 668 CO 0.23 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1ynj n GLY 669 N 0.94 1.92 3.29 -0.72 0.00 -1.26 -4.30 105.19 105.06 1ynj n GLY 669 Ca 0.19 -0.21 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 1ynj n GLY 669 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ynj s GLN 670 N 3.10 1.55 -0.12 1.61 -0.21 -0.22 -1.88 119.66 123.49 1ynj s GLN 670 Ca 0.00 -1.01 -0.06 0.00 0.02 0.00 0.00 55.36 54.32 1ynj s GLN 670 Cb 0.00 -1.69 -0.04 0.00 1.00 0.00 0.00 33.01 32.29 1ynj s GLN 670 CO 0.00 0.43 0.10 0.54 -2.12 0.00 0.00 175.29 174.24 1ynj s ASN 671 N -1.20 6.03 -0.10 5.90 2.20 -1.26 0.91 114.94 127.42 1ynj s ASN 671 Ca 0.09 0.35 -0.30 0.00 -0.94 0.00 0.00 52.86 52.06 1ynj s ASN 671 Cb -0.09 -1.90 0.09 0.00 -2.00 0.00 0.00 41.25 37.34 1ynj s ASN 671 CO 0.02 0.38 0.78 0.54 -2.94 0.00 0.00 177.10 175.88 1ynj s VAL 672 N -0.87 0.00 -0.37 3.54 0.11 -1.19 -4.93 120.40 116.68 1ynj s VAL 672 Ca 0.14 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.90 1ynj s VAL 672 Cb -0.12 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 1ynj s VAL 672 CO 0.03 0.00 1.08 -0.22 -3.33 0.00 0.00 175.10 172.67 1ynj s LEU 673 N -1.04 3.84 0.22 2.54 2.96 -1.26 -1.73 118.68 124.22 1ynj s LEU 673 Ca -0.07 0.83 0.10 0.00 -0.22 0.00 0.00 54.13 54.76 1ynj s LEU 673 Cb -0.01 -3.52 -0.04 0.00 0.50 0.00 0.00 46.19 43.12 1ynj s LEU 673 CO 0.07 -1.00 -0.10 0.54 -1.32 0.00 0.00 176.35 174.54 1ynj s VAL 674 N 3.90 3.06 -0.07 1.68 0.11 0.22 0.14 120.40 129.45 1ynj s VAL 674 Ca 0.46 -1.89 -0.03 0.00 -2.93 0.00 0.00 61.98 57.59 1ynj s VAL 674 Cb -0.10 -2.56 0.04 0.00 -1.53 0.00 0.00 36.38 32.22 1ynj s VAL 674 CO 0.21 -0.23 0.14 0.00 -3.33 0.00 0.00 175.10 171.88 1ynj s ALA 675 N -2.01 -0.15 -0.58 1.54 0.00 -0.99 -0.89 121.76 118.68 1ynj s ALA 675 Ca 0.27 0.55 -0.17 0.00 0.00 0.00 0.00 51.96 52.62 1ynj s ALA 675 Cb -0.07 -0.62 0.13 0.00 0.00 0.00 0.00 23.12 22.56 1ynj s ALA 675 CO 0.16 -0.37 0.58 0.42 0.00 0.00 0.00 175.76 176.56 1ynj s ILE 676 N 1.76 5.12 0.17 0.00 1.01 -0.81 0.01 121.20 128.45 1ynj s ILE 676 Ca -0.02 -1.42 -0.22 0.00 0.00 0.00 0.00 60.65 58.98 1ynj s ILE 676 Cb -0.12 -4.40 0.06 0.00 0.01 0.00 0.00 42.46 38.02 1ynj s ILE 676 CO -0.05 -0.96 0.59 0.00 0.00 0.00 0.00 174.94 174.52 1ynj s MET 677 N 1.83 1.31 0.28 2.79 0.23 0.22 -4.42 119.30 121.53 1ynj s MET 677 Ca 0.07 -0.54 -0.29 0.00 -1.03 0.00 0.00 55.69 53.90 1ynj s MET 677 Cb -0.27 0.58 -0.10 0.00 -1.53 0.00 0.00 34.83 33.52 1ynj s MET 677 CO 0.03 -0.57 1.10 -2.14 -2.03 0.00 0.00 175.02 171.41 1ynj s PRO 678 N -3.77 4.63 0.00 3.16 0.02 -1.26 -3.80 135.00 133.98 1ynj s PRO 678 Ca 0.02 1.81 0.00 0.00 0.02 0.00 0.00 61.00 62.85 1ynj s PRO 678 Cb -0.01 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 31.32 1ynj s PRO 678 CO -0.11 0.20 0.00 0.34 -0.33 0.00 0.00 177.00 177.10 1ynj n PHE 679 N 1.23 0.00 -1.59 6.54 7.35 -1.26 -4.97 117.46 124.75 1ynj n PHE 679 Ca -0.01 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.48 1ynj n PHE 679 Cb 0.45 0.00 0.11 0.00 0.35 0.00 0.00 39.48 40.39 1ynj n PHE 679 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1ynj n ASP 680 N 0.00 4.67 0.00 -2.13 8.00 -1.26 -4.71 116.55 121.12 1ynj n ASP 680 Ca 0.00 -3.77 0.00 0.00 0.71 0.00 0.00 54.79 51.73 1ynj n ASP 680 Cb 0.00 -0.65 0.00 0.00 -0.02 0.00 0.00 41.12 40.45 1ynj n ASP 680 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ynj n GLY 681 N -0.94 0.59 0.18 0.44 0.00 -1.26 -4.96 105.19 99.24 1ynj n GLY 681 Ca 0.46 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.60 1ynj n GLY 681 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1ynj h TYR 682 N 0.00 0.00 -0.36 1.61 0.05 -1.97 -3.16 116.97 113.14 1ynj h TYR 682 Ca 0.00 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 1ynj h TYR 682 Cb 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 37.66 1ynj h TYR 682 CO 0.00 0.00 -0.01 0.27 -1.05 0.00 0.00 178.16 177.37 1ynj n ASN 683 N -2.88 3.03 -4.70 3.88 0.23 -1.26 -4.42 115.26 109.14 1ynj n ASN 683 Ca 0.03 -3.50 -0.38 0.00 -0.53 0.00 0.00 54.58 50.20 1ynj n ASN 683 Cb 0.52 -0.62 0.06 0.00 -2.08 0.00 0.00 39.78 37.66 1ynj n ASN 683 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 1ynj n PHE 684 N -0.92 1.72 0.00 -2.53 7.35 -1.20 -4.25 117.46 117.63 1ynj n PHE 684 Ca 0.31 0.43 0.00 0.00 -0.76 0.00 0.00 57.45 57.42 1ynj n PHE 684 Cb 1.03 -2.25 0.00 0.00 0.35 0.00 0.00 39.48 38.60 1ynj n PHE 684 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1ynj n GLU 685 N -1.49 0.00 0.00 -4.13 -0.58 -1.26 -2.12 120.64 111.06 1ynj n GLU 685 Ca 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 1ynj n GLU 685 Cb 0.47 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 1ynj n GLU 685 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1ynj n ASP 686 N 3.43 0.75 -4.70 1.62 10.43 -1.26 -4.78 116.55 122.04 1ynj n ASP 686 Ca 0.00 -1.12 -0.40 0.00 2.57 0.00 0.00 54.79 55.84 1ynj n ASP 686 Cb 0.00 0.00 0.03 0.00 1.84 0.00 0.00 41.12 42.99 1ynj n ASP 686 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1ynj n ALA 687 N -0.06 1.20 -2.66 2.24 0.00 -0.90 -3.92 120.51 116.42 1ynj n ALA 687 Ca 0.00 0.19 -0.28 0.00 0.00 0.00 0.00 53.44 53.35 1ynj n ALA 687 Cb 0.14 -2.27 -0.08 0.00 0.00 0.00 0.00 19.45 17.24 1ynj n ALA 687 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ynj s ILE 688 N -1.27 3.75 -0.13 0.00 -1.09 0.14 -4.30 121.20 118.30 1ynj s ILE 688 Ca 0.66 -1.26 -0.04 0.00 -2.23 0.00 0.00 60.65 57.77 1ynj s ILE 688 Cb -0.47 -2.83 -0.03 0.00 -1.58 0.00 0.00 42.46 37.54 1ynj s ILE 688 CO 0.54 -0.00 0.02 -0.69 -1.23 0.00 0.00 174.94 173.58 1ynj s VAL 689 N -1.51 4.45 0.11 2.92 1.01 -1.22 -0.60 120.40 125.57 1ynj s VAL 689 Ca 0.26 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.14 1ynj s VAL 689 Cb -0.10 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 1ynj s VAL 689 CO 0.18 0.53 -0.09 -0.63 0.00 0.00 0.00 175.10 175.09 1ynj s ILE 690 N -0.21 3.39 -0.23 2.22 1.09 0.12 -1.52 121.20 126.07 1ynj s ILE 690 Ca 0.06 -1.30 -0.14 0.00 -1.10 0.00 0.00 60.65 58.17 1ynj s ILE 690 Cb -0.12 -2.60 -0.04 0.00 -1.06 0.00 0.00 42.46 38.64 1ynj s ILE 690 CO 0.02 0.08 0.33 -0.55 -0.10 0.00 0.00 174.94 174.72 1ynj s SER 691 N -2.30 6.31 0.46 3.58 0.15 0.22 0.40 113.70 122.51 1ynj s SER 691 Ca 0.22 0.36 0.35 0.00 0.70 0.00 0.00 55.95 57.58 1ynj s SER 691 Cb -0.11 -2.19 1.54 0.00 -1.71 0.00 0.00 66.02 63.54 1ynj s SER 691 CO 0.14 -0.06 1.58 -0.08 1.20 0.00 0.00 173.24 176.02 1ynj h GLU 692 N 7.60 0.00 -0.71 5.44 4.81 -0.87 0.79 114.58 131.64 1ynj h GLU 692 Ca -0.36 -0.00 0.23 0.00 -0.13 0.00 0.00 59.36 59.10 1ynj h GLU 692 Cb 1.16 -0.00 -0.13 0.00 0.63 0.00 0.00 28.75 30.41 1ynj h GLU 692 CO 0.68 0.00 0.12 -1.91 -0.73 0.00 0.00 179.01 177.18 1ynj n GLU 693 N -4.63 -0.05 0.04 1.92 4.07 -1.26 0.54 120.64 121.27 1ynj n GLU 693 Ca 0.41 1.04 0.01 0.00 -0.06 0.00 0.00 57.16 58.56 1ynj n GLU 693 Cb 1.64 -1.71 0.33 0.00 -0.06 0.00 0.00 31.44 31.63 1ynj n GLU 693 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1ynj h LEU 694 N 0.00 0.40 -0.04 4.31 3.38 0.25 -0.88 115.31 122.73 1ynj h LEU 694 Ca 0.48 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.29 1ynj h LEU 694 Cb 1.10 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1ynj h LEU 694 CO -0.63 0.51 -0.29 -0.07 0.09 0.00 0.00 178.44 178.04 1ynj h LEU 695 N 0.41 0.33 -1.71 1.67 3.38 -0.06 -0.11 115.31 119.21 1ynj h LEU 695 Ca 0.09 -0.68 0.16 0.00 0.09 0.00 0.00 57.88 57.54 1ynj h LEU 695 Cb 0.35 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1ynj h LEU 695 CO 0.01 0.96 0.48 0.11 0.09 0.00 0.00 178.44 180.09 1ynj h LYS 696 N -0.27 0.28 -0.45 1.13 1.57 -1.00 0.42 116.57 118.24 1ynj h LYS 696 Ca -0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1ynj h LYS 696 Cb 0.96 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1ynj h LYS 696 CO 0.06 0.18 0.00 -2.13 -0.57 0.00 0.00 179.45 176.99 1ynj n ARG 697 N -4.44 2.20 -4.14 3.15 0.63 -0.37 -4.93 116.66 108.76 1ynj n ARG 697 Ca 0.13 -1.86 -0.33 0.00 -0.92 0.00 0.00 57.85 54.87 1ynj n ARG 697 Cb 0.58 -1.43 -0.02 0.00 0.45 0.00 0.00 32.46 32.03 1ynj n ARG 697 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1ynj n ASP 698 N 1.02 -2.79 0.00 6.15 4.64 0.15 -4.90 116.55 120.83 1ynj n ASP 698 Ca 0.18 -0.99 0.00 0.00 -1.38 0.00 0.00 54.79 52.60 1ynj n ASP 698 Cb 0.46 -2.91 0.00 0.00 -1.04 0.00 0.00 41.12 37.63 1ynj n ASP 698 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 1ynj n PHE 699 N -4.42 0.00 0.46 -0.67 3.01 -0.14 -3.99 117.46 111.71 1ynj n PHE 699 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1ynj n PHE 699 Cb 0.54 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.01 1ynj n PHE 699 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1ynj n TYR 700 N -0.30 0.00 -3.91 1.38 4.02 -1.26 -4.59 117.16 112.50 1ynj n TYR 700 Ca 0.00 -0.21 -0.35 0.00 -0.01 0.00 0.00 57.90 57.33 1ynj n TYR 700 Cb 0.00 -0.16 -0.06 0.00 -0.02 0.00 0.00 39.34 39.11 1ynj n TYR 700 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1ynj s THR 701 N 0.42 5.43 0.01 -0.72 -4.23 -1.26 -4.01 115.64 111.29 1ynj s THR 701 Ca 0.00 0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.42 1ynj s THR 701 Cb 0.00 -3.44 0.01 0.00 1.34 0.00 0.00 72.50 70.41 1ynj s THR 701 CO 0.00 0.49 0.23 -0.94 -0.54 0.00 0.00 174.62 173.86 1ynj s SER 702 N -1.44 -0.07 -0.34 3.99 1.04 -1.26 -2.44 113.70 113.19 1ynj s SER 702 Ca 0.20 -0.14 -0.07 0.00 0.48 0.00 0.00 55.95 56.42 1ynj s SER 702 Cb -0.12 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.31 1ynj s SER 702 CO 0.11 -0.47 0.12 -0.63 0.98 0.00 0.00 173.24 173.34 1ynj s ILE 703 N -1.78 3.98 0.02 -1.02 1.01 -1.26 0.16 121.20 122.29 1ynj s ILE 703 Ca -0.11 -0.98 -0.06 0.00 0.00 0.00 0.00 60.65 59.51 1ynj s ILE 703 Cb -0.04 -3.20 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 1ynj s ILE 703 CO 0.01 -0.13 0.26 -2.28 0.00 0.00 0.00 174.94 172.80 1ynj s HIS 704 N 1.45 3.56 -0.20 3.97 5.65 -0.26 -4.06 115.29 125.41 1ynj s HIS 704 Ca -0.00 0.53 0.00 0.00 0.25 0.00 0.00 55.06 55.84 1ynj s HIS 704 Cb -0.19 -1.96 0.05 0.00 -1.18 0.00 0.00 32.58 29.30 1ynj s HIS 704 CO 0.03 0.60 -0.06 0.42 -0.65 0.00 0.00 174.74 175.08 1ynj s ILE 705 N -1.34 1.40 0.96 0.89 1.01 -1.01 -1.60 121.20 121.52 1ynj s ILE 705 Ca 0.29 -0.97 -0.15 0.00 0.00 0.00 0.00 60.65 59.82 1ynj s ILE 705 Cb -0.13 -1.60 0.18 0.00 0.01 0.00 0.00 42.46 40.92 1ynj s ILE 705 CO 0.18 0.03 1.23 -0.70 0.00 0.00 0.00 174.94 175.68 1ynj s GLU 706 N 1.48 0.71 -0.11 2.79 2.56 -0.53 -4.61 118.70 120.99 1ynj s GLU 706 Ca -0.03 -0.12 -0.04 0.00 0.00 0.00 0.00 54.97 54.78 1ynj s GLU 706 Cb -0.17 -1.83 0.06 0.00 2.00 0.00 0.00 34.13 34.19 1ynj s GLU 706 CO -0.07 -2.41 0.22 0.50 -0.56 0.00 0.00 175.26 172.94 1ynj s ARG 707 N -5.64 0.12 0.04 4.30 3.52 -1.26 -2.71 118.95 117.31 1ynj s ARG 707 Ca 0.69 0.65 0.05 0.00 -0.13 0.00 0.00 55.73 57.00 1ynj s ARG 707 Cb -0.08 -0.12 -0.03 0.00 -1.56 0.00 0.00 34.95 33.15 1ynj s ARG 707 CO 0.53 -0.27 -0.11 0.71 -0.81 0.00 0.00 175.30 175.35 1ynj s TYR 708 N 2.20 2.76 -0.01 5.12 1.51 -0.01 -4.97 117.35 123.95 1ynj s TYR 708 Ca 0.00 -0.13 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 1ynj s TYR 708 Cb -0.12 -1.53 -0.00 0.00 -0.11 0.00 0.00 41.96 40.20 1ynj s TYR 708 CO -0.08 0.35 -0.04 -2.00 -1.11 0.00 0.00 175.55 172.67 1ynj s GLU 709 N -1.61 0.38 0.01 -0.62 2.12 -1.26 -0.96 118.70 116.76 1ynj s GLU 709 Ca 0.17 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.36 1ynj s GLU 709 Cb -0.11 -0.37 -0.01 0.00 0.26 0.00 0.00 34.13 33.89 1ynj s GLU 709 CO 0.08 0.08 -0.02 -1.50 -0.54 0.00 0.00 175.26 173.36 1ynj s ILE 710 N -0.03 0.10 0.13 -3.70 2.07 -0.42 -4.99 121.20 114.35 1ynj s ILE 710 Ca 0.01 -0.60 0.09 0.00 -1.41 0.00 0.00 60.65 58.74 1ynj s ILE 710 Cb -0.03 -0.19 -0.04 0.00 0.13 0.00 0.00 42.46 42.33 1ynj s ILE 710 CO -0.00 -0.32 -0.16 -1.61 -1.91 0.00 0.00 174.94 170.94 1ynj s GLU 711 N -0.95 1.84 -0.18 3.50 2.02 -1.26 0.20 118.70 123.86 1ynj s GLU 711 Ca -0.10 -1.19 -0.00 0.00 0.02 0.00 0.00 54.97 53.69 1ynj s GLU 711 Cb -0.07 -2.12 0.01 0.00 0.10 0.00 0.00 34.13 32.05 1ynj s GLU 711 CO -0.01 0.47 -0.16 0.00 0.02 0.00 0.00 175.26 175.59 1ynj s ALA 712 N -1.26 2.46 0.29 5.21 0.00 -0.55 -5.00 121.76 122.92 1ynj s ALA 712 Ca 0.19 -1.17 0.09 0.00 0.00 0.00 0.00 51.96 51.08 1ynj s ALA 712 Cb -0.10 -1.29 -0.04 0.00 0.00 0.00 0.00 23.12 21.68 1ynj s ALA 712 CO 0.11 -0.29 0.05 1.03 0.00 0.00 0.00 175.76 176.66 1ynj s ARG 713 N 1.21 2.36 0.38 0.00 0.52 -1.26 0.10 118.95 122.26 1ynj s ARG 713 Ca 0.02 -1.43 -0.11 0.00 -0.52 0.00 0.00 55.73 53.69 1ynj s ARG 713 Cb -0.14 -2.19 -0.07 0.00 0.52 0.00 0.00 34.95 33.07 1ynj s ARG 713 CO -0.08 0.30 0.75 -0.51 0.02 0.00 0.00 175.30 175.78 1ynj s ASP 714 N -3.73 6.57 -0.07 0.23 1.01 -0.85 -0.99 116.67 118.84 1ynj s ASP 714 Ca 0.33 1.13 -0.13 0.00 0.71 0.00 0.00 52.55 54.59 1ynj s ASP 714 Cb -0.05 -2.32 0.03 0.00 1.01 0.00 0.00 42.92 41.58 1ynj s ASP 714 CO 0.21 -0.35 0.33 -0.89 0.21 0.00 0.00 175.17 174.68 1ynj s THR 715 N -2.27 0.03 -0.30 -1.27 2.01 -1.17 -4.92 115.64 107.75 1ynj s THR 715 Ca 0.51 -0.24 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1ynj s THR 715 Cb -0.10 -0.55 0.00 0.00 0.01 0.00 0.00 72.50 71.86 1ynj s THR 715 CO 0.28 -0.13 0.47 2.29 -0.69 0.00 0.00 174.62 176.85 1ynj n LYS 716 N 2.08 0.00 0.00 4.92 0.00 -1.26 0.16 118.16 124.06 1ynj n LYS 716 Ca -0.17 0.08 0.00 0.00 -0.00 0.00 0.00 58.31 58.22 1ynj n LYS 716 Cb 0.57 -1.77 0.00 0.00 -0.00 0.00 0.00 35.03 33.83 1ynj n LYS 716 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1ynj n LEU 717 N -0.97 0.68 0.00 -5.58 4.77 -1.26 -5.11 117.00 109.53 1ynj n LEU 717 Ca 0.00 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.17 1ynj n LEU 717 Cb 0.27 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1ynj n LEU 717 CO 0.00 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 1ynj n GLY 718 N 0.42 2.59 3.73 -0.72 0.00 0.42 -4.65 105.19 106.99 1ynj n GLY 718 Ca 0.00 -2.11 -0.41 0.00 0.00 0.00 0.00 46.02 43.50 1ynj n GLY 718 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ynj s PRO 719 N -2.17 4.59 -0.07 1.61 0.04 -1.26 -3.02 135.00 134.71 1ynj s PRO 719 Ca 0.00 1.67 -0.30 0.00 0.04 0.00 0.00 61.00 62.41 1ynj s PRO 719 Cb 0.00 -3.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 1ynj s PRO 719 CO 0.00 0.05 1.53 -1.21 0.04 0.00 0.00 177.00 177.41 1ynj s GLU 720 N -0.06 4.21 0.01 4.56 2.02 -0.16 -4.64 118.70 124.64 1ynj s GLU 720 Ca 0.50 2.05 0.08 0.00 0.02 0.00 0.00 54.97 57.62 1ynj s GLU 720 Cb -0.28 -3.87 -0.02 0.00 0.10 0.00 0.00 34.13 30.06 1ynj s GLU 720 CO 0.33 -0.78 -0.23 1.03 0.02 0.00 0.00 175.26 175.63 1ynj s ARG 721 N 3.67 1.75 -1.12 1.61 0.52 -0.46 -4.29 118.95 120.62 1ynj s ARG 721 Ca 0.68 -0.93 -0.05 0.00 -0.52 0.00 0.00 55.73 54.92 1ynj s ARG 721 Cb -0.31 -1.79 0.28 0.00 0.52 0.00 0.00 34.95 33.66 1ynj s ARG 721 CO 0.26 0.48 1.61 -0.89 0.02 0.00 0.00 175.30 176.77 1ynj n ILE 722 N 2.17 5.21 -2.54 1.52 2.08 -1.26 -1.13 119.36 125.41 1ynj n ILE 722 Ca -0.16 -5.62 -0.22 0.00 0.56 0.00 0.00 62.75 57.30 1ynj n ILE 722 Cb 0.52 -2.09 0.04 0.00 -0.75 0.00 0.00 39.64 37.36 1ynj n ILE 722 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1ynj s THR 723 N -2.27 2.68 -0.58 1.39 -1.32 -1.23 -4.46 115.64 109.85 1ynj s THR 723 Ca 0.34 -0.54 0.15 0.00 -1.21 0.00 0.00 61.69 60.43 1ynj s THR 723 Cb 0.07 -3.04 -0.18 0.00 -1.51 0.00 0.00 72.50 67.84 1ynj s THR 723 CO 0.07 -0.03 0.58 -1.14 -2.21 0.00 0.00 174.62 171.89 1ynj n ARG 724 N -2.48 1.72 -1.52 7.08 0.63 -1.25 -4.00 116.66 116.84 1ynj n ARG 724 Ca 0.07 -0.03 -0.40 0.00 -0.92 0.00 0.00 57.85 56.58 1ynj n ARG 724 Cb 0.60 -1.24 -0.05 0.00 0.45 0.00 0.00 32.46 32.22 1ynj n ARG 724 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1ynj n ASP 725 N -1.49 3.00 -4.65 6.15 2.03 -1.26 -4.93 116.55 115.41 1ynj n ASP 725 Ca 0.02 -2.72 -0.37 0.00 0.52 0.00 0.00 54.79 52.23 1ynj n ASP 725 Cb 0.27 -1.37 -0.09 0.00 -0.72 0.00 0.00 41.12 39.21 1ynj n ASP 725 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ynj s ILE 726 N 5.87 5.31 0.52 5.18 1.01 -1.26 -4.94 121.20 132.90 1ynj s ILE 726 Ca 0.58 0.30 -0.20 0.00 0.00 0.00 0.00 60.65 61.33 1ynj s ILE 726 Cb 0.11 -3.56 -0.08 0.00 0.01 0.00 0.00 42.46 38.93 1ynj s ILE 726 CO 0.09 0.31 0.78 -0.81 0.00 0.00 0.00 174.94 175.31 1ynj n PRO 727 N 4.47 0.85 0.00 2.79 -0.04 -1.26 -2.70 135.00 139.10 1ynj n PRO 727 Ca -0.13 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 1ynj n PRO 727 Cb 0.52 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 1ynj n PRO 727 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1ynj n HIS 728 N -1.29 0.00 -2.65 0.54 8.25 -1.26 -4.91 115.22 113.89 1ynj n HIS 728 Ca 0.12 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.16 1ynj n HIS 728 Cb 0.44 -0.82 -0.03 0.00 1.12 0.00 0.00 29.99 30.70 1ynj n HIS 728 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1ynj s LEU 729 N 0.00 4.41 0.24 2.41 1.02 -1.10 -4.98 118.68 120.68 1ynj s LEU 729 Ca 0.00 1.79 -0.30 0.00 0.02 0.00 0.00 54.13 55.64 1ynj s LEU 729 Cb 0.00 -3.58 -0.10 0.00 0.02 0.00 0.00 46.19 42.53 1ynj s LEU 729 CO 0.00 -0.24 1.39 -0.94 0.02 0.00 0.00 176.35 176.58 1ynj s SER 730 N 0.66 6.74 0.00 2.29 1.04 -1.26 -4.84 113.70 118.32 1ynj s SER 730 Ca 0.52 2.58 0.01 0.00 0.48 0.00 0.00 55.95 59.53 1ynj s SER 730 Cb -0.24 -2.62 0.03 0.00 0.10 0.00 0.00 66.02 63.29 1ynj s SER 730 CO 0.29 -0.63 0.26 -0.62 0.98 0.00 0.00 173.24 173.52 1ynj n GLU 731 N 2.32 0.04 -0.08 4.02 -0.58 -1.26 0.10 120.64 125.21 1ynj n GLU 731 Ca 0.06 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.73 1ynj n GLU 731 Cb 0.41 -1.20 -0.16 0.00 -0.57 0.00 0.00 31.44 29.92 1ynj n GLU 731 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ynj n ALA 732 N -0.70 1.69 0.02 0.62 0.00 -1.26 -3.48 120.51 117.39 1ynj n ALA 732 Ca 0.00 -1.15 -0.12 0.00 0.00 0.00 0.00 53.44 52.17 1ynj n ALA 732 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1ynj n ALA 732 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ynj h ALA 733 N 1.15 0.52 0.00 0.00 0.00 0.34 -2.91 119.26 118.35 1ynj h ALA 733 Ca -0.44 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 53.88 1ynj h ALA 733 Cb 2.04 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1ynj h ALA 733 CO 0.03 0.73 0.00 1.28 0.00 0.00 0.00 179.25 181.29 1ynj n LEU 734 N -3.89 0.38 -0.48 0.00 7.99 -1.02 -4.41 117.00 115.57 1ynj n LEU 734 Ca -0.05 0.56 0.40 0.00 -0.01 0.00 0.00 56.01 56.91 1ynj n LEU 734 Cb 0.70 -0.48 0.67 0.00 -0.11 0.00 0.00 43.42 44.20 1ynj n LEU 734 CO 0.49 -0.26 1.20 -1.14 -1.51 0.00 0.00 177.39 176.17 1ynj n ARG 735 N -1.89 -0.03 -0.21 3.23 0.63 -1.10 -0.36 116.66 116.93 1ynj n ARG 735 Ca 0.04 1.20 0.12 0.00 -0.92 0.00 0.00 57.85 58.29 1ynj n ARG 735 Cb 0.29 -2.40 0.23 0.00 0.45 0.00 0.00 32.46 31.02 1ynj n ARG 735 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1ynj n ASP 736 N -4.59 3.51 -4.68 6.15 8.00 -1.26 -4.92 116.55 118.76 1ynj n ASP 736 Ca 0.39 -1.99 -0.38 0.00 0.71 0.00 0.00 54.79 53.53 1ynj n ASP 736 Cb 1.56 -0.28 -0.08 0.00 -0.02 0.00 0.00 41.12 42.30 1ynj n ASP 736 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ynj s LEU 737 N -1.39 4.17 1.07 0.64 1.43 0.52 -1.01 118.68 124.10 1ynj s LEU 737 Ca 0.39 0.47 -0.13 0.00 -1.03 0.00 0.00 54.13 53.84 1ynj s LEU 737 Cb 0.23 -2.45 0.23 0.00 0.03 0.00 0.00 46.19 44.23 1ynj s LEU 737 CO 0.31 -0.03 1.07 1.51 0.23 0.00 0.00 176.35 179.45 1ynj s ASP 738 N 0.93 1.97 -0.93 2.29 -4.77 -1.11 -4.80 116.67 110.26 1ynj s ASP 738 Ca 0.17 1.27 -0.20 0.00 -3.30 0.00 0.00 52.55 50.49 1ynj s ASP 738 Cb -0.14 -1.98 -0.11 0.00 -1.09 0.00 0.00 42.92 39.59 1ynj s ASP 738 CO 0.07 -3.55 1.98 1.21 0.70 0.00 0.00 175.17 175.58 1ynj n GLU 739 N -4.46 1.79 0.00 2.11 4.07 -1.26 -1.94 120.64 120.95 1ynj n GLU 739 Ca 0.04 -2.03 0.00 0.00 -0.06 0.00 0.00 57.16 55.11 1ynj n GLU 739 Cb 0.56 -3.03 0.00 0.00 -0.06 0.00 0.00 31.44 28.91 1ynj n GLU 739 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1ynj n GLU 740 N 6.90 0.00 0.00 5.31 4.07 -1.26 -4.99 120.64 130.66 1ynj n GLU 740 Ca 0.50 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.60 1ynj n GLU 740 Cb 0.40 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.78 1ynj n GLU 740 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ynj n GLY 741 N -0.39 0.89 3.43 8.31 0.00 -0.82 -3.87 105.19 112.74 1ynj n GLY 741 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1ynj n GLY 741 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ynj s ILE 742 N -2.00 3.82 0.39 -0.61 1.01 -1.26 0.39 121.20 122.93 1ynj s ILE 742 Ca 0.00 -0.36 -0.24 0.00 0.00 0.00 0.00 60.65 60.05 1ynj s ILE 742 Cb 0.00 -2.72 -0.13 0.00 0.01 0.00 0.00 42.46 39.62 1ynj s ILE 742 CO 0.00 0.44 0.65 1.33 0.00 0.00 0.00 174.94 177.35 1ynj n VAL 743 N 4.22 1.88 -1.11 2.92 0.24 -0.69 -2.74 118.33 123.05 1ynj n VAL 743 Ca -0.17 -0.50 -0.32 0.00 -2.04 0.00 0.00 64.34 61.31 1ynj n VAL 743 Cb 0.52 -0.62 0.12 0.00 -1.47 0.00 0.00 33.84 32.39 1ynj n VAL 743 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1ynj s ARG 744 N -1.58 1.73 0.44 7.34 0.52 -0.18 -4.80 118.95 122.43 1ynj s ARG 744 Ca 0.63 1.53 -0.21 0.00 -0.52 0.00 0.00 55.73 57.16 1ynj s ARG 744 Cb -0.63 -1.81 -0.11 0.00 0.52 0.00 0.00 34.95 32.92 1ynj s ARG 744 CO 0.58 -2.10 0.96 0.42 0.02 0.00 0.00 175.30 175.19 1ynj s ILE 745 N -2.47 4.30 0.00 1.52 1.01 -1.26 -3.31 121.20 120.99 1ynj s ILE 745 Ca 0.68 1.43 0.00 0.00 0.00 0.00 0.00 60.65 62.76 1ynj s ILE 745 Cb -0.24 -3.58 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1ynj s ILE 745 CO 0.52 -0.31 0.00 0.61 0.00 0.00 0.00 174.94 175.76 1ynj n GLY 746 N -0.58 2.13 3.69 6.18 0.00 0.29 -4.98 105.19 111.93 1ynj n GLY 746 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 1ynj n GLY 746 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynj n ALA 747 N 0.37 1.73 -2.56 4.61 0.00 -1.21 -4.66 120.51 118.78 1ynj n ALA 747 Ca 0.00 0.41 -0.41 0.00 0.00 0.00 0.00 53.44 53.44 1ynj n ALA 747 Cb 0.00 -2.37 -0.08 0.00 0.00 0.00 0.00 19.45 17.00 1ynj n ALA 747 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ynj s GLU 748 N 0.03 3.67 -0.20 0.00 2.12 -1.26 -0.91 118.70 122.15 1ynj s GLU 748 Ca 0.70 -0.15 -0.03 0.00 0.36 0.00 0.00 54.97 55.84 1ynj s GLU 748 Cb -0.60 -3.78 -0.01 0.00 0.26 0.00 0.00 34.13 29.99 1ynj s GLU 748 CO 0.45 -0.57 -0.05 0.08 -0.54 0.00 0.00 175.26 174.62 1ynj s VAL 749 N 2.30 3.38 0.33 3.70 1.01 0.75 -4.98 120.40 126.89 1ynj s VAL 749 Ca 0.17 -0.50 0.07 0.00 0.00 0.00 0.00 61.98 61.72 1ynj s VAL 749 Cb -0.16 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 1ynj s VAL 749 CO 0.12 0.44 0.36 -1.59 0.00 0.00 0.00 175.10 174.43 1ynj s LYS 750 N 1.26 2.89 0.58 2.72 0.00 -1.26 -0.40 119.74 125.52 1ynj s LYS 750 Ca 0.03 -1.17 -0.19 0.00 0.00 0.00 0.00 55.97 54.63 1ynj s LYS 750 Cb -0.14 -2.61 -0.05 0.00 0.00 0.00 0.00 37.83 35.02 1ynj s LYS 750 CO -0.02 0.10 1.03 -0.35 0.00 0.00 0.00 175.35 176.11 1ynj n PRO 751 N -1.47 1.06 -1.14 1.78 -0.04 -1.22 -2.95 135.00 131.02 1ynj n PRO 751 Ca -0.02 0.40 -0.04 0.00 -0.04 0.00 0.00 63.50 63.80 1ynj n PRO 751 Cb 0.59 -2.22 -0.02 0.00 -0.04 0.00 0.00 33.50 31.81 1ynj n PRO 751 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ynj n GLY 752 N 1.20 0.70 3.55 0.55 0.00 0.14 -4.90 105.19 106.42 1ynj n GLY 752 Ca 0.13 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 1ynj n GLY 752 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ynj s ASP 753 N -2.95 5.05 0.07 1.61 -0.00 -1.15 -4.81 116.67 114.49 1ynj s ASP 753 Ca 0.00 -0.05 -0.32 0.00 -0.00 0.00 0.00 52.55 52.18 1ynj s ASP 753 Cb 0.00 -1.80 -0.11 0.00 -0.00 0.00 0.00 42.92 41.01 1ynj s ASP 753 CO 0.00 0.19 1.84 -0.38 -0.00 0.00 0.00 175.17 176.82 1ynj n ILE 754 N 3.41 0.43 -0.11 0.77 2.08 -1.26 -1.86 119.36 122.83 1ynj n ILE 754 Ca -0.17 -0.08 -0.18 0.00 0.56 0.00 0.00 62.75 62.88 1ynj n ILE 754 Cb 0.52 -2.05 -0.13 0.00 -0.75 0.00 0.00 39.64 37.24 1ynj n ILE 754 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1ynj n LEU 755 N 5.90 2.66 -3.50 1.39 4.77 -1.26 -4.74 117.00 122.21 1ynj n LEU 755 Ca 0.19 -0.08 -0.13 0.00 -0.03 0.00 0.00 56.01 55.96 1ynj n LEU 755 Cb 0.35 -0.80 -0.11 0.00 -2.33 0.00 0.00 43.42 40.53 1ynj n LEU 755 CO 0.67 0.88 -0.12 -0.69 -1.33 0.00 0.00 177.39 176.81 1ynj s VAL 756 N -2.52 -0.47 0.36 4.08 1.01 -1.25 -1.70 120.40 119.90 1ynj s VAL 756 Ca -0.31 0.02 -0.26 0.00 0.00 0.00 0.00 61.98 61.43 1ynj s VAL 756 Cb 0.08 -0.66 -0.09 0.00 0.00 0.00 0.00 36.38 35.71 1ynj s VAL 756 CO 0.64 -0.08 1.11 -0.83 0.00 0.00 0.00 175.10 175.95 1ynj s GLY 757 N 2.45 2.89 -0.30 4.51 0.00 0.16 0.33 107.32 117.36 1ynj s GLY 757 Ca 0.07 0.87 -0.10 0.00 0.00 0.00 0.00 44.72 45.56 1ynj s GLY 757 CO -0.12 1.39 0.68 -1.60 0.00 0.00 0.00 173.10 173.44 1ynj s ARG 758 N -2.07 0.55 -0.18 2.90 3.52 -1.26 -3.58 118.95 118.83 1ynj s ARG 758 Ca 0.53 1.37 -0.12 0.00 -0.13 0.00 0.00 55.73 57.38 1ynj s ARG 758 Cb -0.29 0.82 -0.05 0.00 -1.56 0.00 0.00 34.95 33.88 1ynj s ARG 758 CO 0.36 -0.21 0.22 0.95 -0.81 0.00 0.00 175.30 175.81 1ynj s THR 759 N 2.86 5.35 0.30 4.11 -4.23 -0.29 -2.59 115.64 121.15 1ynj s THR 759 Ca -0.04 0.39 0.09 0.00 -1.18 0.00 0.00 61.69 60.95 1ynj s THR 759 Cb -0.12 -3.56 -0.05 0.00 1.34 0.00 0.00 72.50 70.11 1ynj s THR 759 CO -0.19 0.40 -0.00 -0.44 -0.54 0.00 0.00 174.62 173.85 1ynj s SER 760 N 0.49 4.36 -0.05 3.99 0.01 -1.10 -1.36 113.70 120.04 1ynj s SER 760 Ca 0.13 -0.80 -0.02 0.00 1.31 0.00 0.00 55.95 56.57 1ynj s SER 760 Cb -0.12 -0.68 -0.01 0.00 0.21 0.00 0.00 66.02 65.42 1ynj s SER 760 CO 0.02 -0.10 -0.04 -0.26 0.41 0.00 0.00 173.24 173.27 1ynj h PHE 761 N 1.86 0.00 -3.96 2.43 -1.00 -1.83 0.34 116.94 114.79 1ynj h PHE 761 Ca -0.43 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.35 1ynj h PHE 761 Cb 1.25 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.81 1ynj h PHE 761 CO 0.70 0.00 -0.81 1.63 -1.61 0.00 0.00 178.31 178.22 1ynj n LYS 762 N -3.28 -4.32 -1.98 1.51 5.02 -1.26 -4.13 118.16 109.72 1ynj n LYS 762 Ca -0.01 3.14 -0.27 0.00 -2.02 0.00 0.00 58.31 59.14 1ynj n LYS 762 Cb 0.05 -3.57 0.03 0.00 -0.02 0.00 0.00 35.03 31.52 1ynj n LYS 762 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ynj n GLY 763 N 0.21 6.20 0.00 0.72 0.00 -1.26 -4.89 105.19 106.17 1ynj n GLY 763 Ca 0.00 -2.62 0.00 0.00 0.00 0.00 0.00 46.02 43.40 1ynj n GLY 763 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ynj n GLU 764 N -0.70 0.00 0.00 1.61 4.71 -1.26 -4.76 120.64 120.24 1ynj n GLU 764 Ca 0.47 0.42 0.00 0.00 -0.01 0.00 0.00 57.16 58.04 1ynj n GLU 764 Cb 0.82 -1.52 0.00 0.00 -1.01 0.00 0.00 31.44 29.73 1ynj n GLU 764 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1ynj n GLN 765 N -1.41 0.00 -4.15 3.49 0.00 -1.26 -5.13 117.38 108.92 1ynj n GLN 765 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.00 56.81 1ynj n GLN 765 Cb 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 30.24 30.10 1ynj n GLN 765 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1ynj s GLU 766 N 1.02 0.74 -0.28 3.69 0.41 -1.26 -5.12 118.70 117.90 1ynj s GLU 766 Ca 0.00 -0.09 -0.29 0.00 -0.41 0.00 0.00 54.97 54.18 1ynj s GLU 766 Cb 0.00 -0.76 -0.00 0.00 -1.78 0.00 0.00 34.13 31.58 1ynj s GLU 766 CO 0.00 -0.07 1.36 -1.25 -0.49 0.00 0.00 175.26 174.81 1ynj s PRO 767 N 0.84 3.91 0.41 0.39 0.04 -1.26 -5.00 135.00 134.33 1ynj s PRO 767 Ca -0.11 1.34 -0.23 0.00 0.04 0.00 0.00 61.00 62.04 1ynj s PRO 767 Cb -0.14 -3.90 -0.09 0.00 0.04 0.00 0.00 34.50 30.41 1ynj s PRO 767 CO 0.00 -1.13 1.01 -1.54 0.04 0.00 0.00 177.00 175.38 1ynj s SER 768 N 3.01 6.82 0.00 6.66 1.04 -1.26 -4.76 113.70 125.21 1ynj s SER 768 Ca 0.59 1.91 0.00 0.00 0.48 0.00 0.00 55.95 58.93 1ynj s SER 768 Cb -0.18 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.37 1ynj s SER 768 CO 0.24 -0.45 0.00 -0.81 0.98 0.00 0.00 173.24 173.20 1ynj n PRO 769 N -0.25 2.66 0.00 4.02 -0.04 -1.26 -3.18 135.00 136.96 1ynj n PRO 769 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1ynj n PRO 769 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 1ynj n PRO 769 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ynj n GLU 770 N 0.00 0.00 -0.14 0.54 1.02 -1.26 -3.31 120.64 117.49 1ynj n GLU 770 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 1ynj n GLU 770 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.45 1ynj n GLU 770 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1ynj h GLU 771 N 0.00 0.42 -0.41 3.49 5.08 -1.94 1.90 114.58 123.12 1ynj h GLU 771 Ca 0.00 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 1ynj h GLU 771 Cb 0.00 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1ynj h GLU 771 CO 0.00 0.28 -0.11 -0.09 -1.00 0.00 0.00 179.01 178.09 1ynj h ARG 772 N 0.43 0.73 -0.42 2.33 1.12 -1.61 0.12 114.38 117.07 1ynj h ARG 772 Ca 0.19 -0.23 -0.03 0.00 -1.11 0.00 0.00 59.98 58.79 1ynj h ARG 772 Cb 0.11 -0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 29.98 1ynj h ARG 772 CO -0.14 0.81 0.13 -0.07 -3.11 0.00 0.00 179.97 177.60 1ynj h LEU 773 N 0.66 0.62 -1.07 3.80 -0.00 -1.61 -3.05 115.31 114.66 1ynj h LEU 773 Ca 0.11 -0.21 -0.06 0.00 -0.00 0.00 0.00 57.88 57.73 1ynj h LEU 773 Cb 0.57 -0.16 -0.02 0.00 -0.00 0.00 0.00 40.66 41.05 1ynj h LEU 773 CO 0.04 0.66 -0.01 -0.07 -0.00 0.00 0.00 178.44 179.05 1ynj h LEU 774 N 0.55 0.61 -0.18 1.67 3.38 0.33 -3.25 115.31 118.41 1ynj h LEU 774 Ca 0.14 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1ynj h LEU 774 Cb 0.26 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1ynj h LEU 774 CO -0.00 0.69 0.03 0.03 0.09 0.00 0.00 178.44 179.28 1ynj h ARG 775 N 0.61 0.10 0.13 1.13 2.47 -0.65 -2.77 114.38 115.40 1ynj h ARG 775 Ca 0.12 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.83 1ynj h ARG 775 Cb 0.40 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 1ynj h ARG 775 CO 0.02 0.07 -0.06 0.66 0.56 0.00 0.00 179.97 181.21 1ynj h SER 776 N 0.11 -0.15 -1.01 7.04 4.64 -1.64 -2.50 113.55 120.04 1ynj h SER 776 Ca 0.08 -0.35 0.28 0.00 -0.47 0.00 0.00 61.79 61.33 1ynj h SER 776 Cb 0.07 0.04 -0.05 0.00 -0.31 0.00 0.00 62.40 62.15 1ynj h SER 776 CO -0.11 0.31 0.71 0.40 -0.87 0.00 0.00 176.83 177.27 1ynj h ILE 777 N -0.64 0.51 -0.06 0.95 2.04 -1.57 0.27 117.51 119.01 1ynj h ILE 777 Ca -0.02 -0.03 -0.02 0.00 1.00 0.00 0.00 64.86 65.79 1ynj h ILE 777 Cb 0.49 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1ynj h ILE 777 CO 0.03 0.02 -0.24 0.49 0.00 0.00 0.00 178.15 178.45 1ynj n PHE 778 N -4.32 0.19 0.00 1.37 3.01 -1.05 -5.05 117.46 111.61 1ynj n PHE 778 Ca 0.22 -1.29 0.00 0.00 1.01 0.00 0.00 57.45 57.39 1ynj n PHE 778 Cb 1.02 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 40.24 1ynj n PHE 778 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ynj n GLY 779 N -1.20 2.41 3.63 1.37 0.00 0.96 -5.00 105.19 107.37 1ynj n GLY 779 Ca 0.20 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1ynj n GLY 779 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ynj s GLU 780 N 0.00 3.73 -0.33 1.61 4.04 -1.25 -4.87 118.70 121.64 1ynj s GLU 780 Ca 0.00 2.16 -0.28 0.00 0.04 0.00 0.00 54.97 56.88 1ynj s GLU 780 Cb 0.00 -4.19 -0.02 0.00 0.02 0.00 0.00 34.13 29.95 1ynj s GLU 780 CO 0.00 -1.40 1.74 0.15 -1.84 0.00 0.00 175.26 173.91 1ynj s LYS 781 N 5.09 3.41 -0.09 -4.83 -0.14 -1.26 -4.79 119.74 117.13 1ynj s LYS 781 Ca 0.87 1.40 -0.40 0.00 -1.36 0.00 0.00 55.97 56.47 1ynj s LYS 781 Cb -0.34 -4.16 -0.18 0.00 -1.68 0.00 0.00 37.83 31.46 1ynj s LYS 781 CO 0.36 -1.77 1.33 0.00 -0.76 0.00 0.00 175.35 174.52 1ynj n ALA 782 N 9.92 -1.95 -2.63 5.17 0.00 -1.26 -4.94 120.51 124.83 1ynj n ALA 782 Ca 0.22 0.53 -0.29 0.00 0.00 0.00 0.00 53.44 53.90 1ynj n ALA 782 Cb 0.47 -1.95 -0.09 0.00 0.00 0.00 0.00 19.45 17.88 1ynj n ALA 782 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ynj s ARG 783 N 1.12 2.30 -0.01 0.00 1.81 -1.26 -5.02 118.95 117.89 1ynj s ARG 783 Ca 0.92 -1.02 0.18 0.00 -1.72 0.00 0.00 55.73 54.09 1ynj s ARG 783 Cb -1.18 -2.36 0.54 0.00 -0.45 0.00 0.00 34.95 31.50 1ynj s ARG 783 CO 0.59 0.49 1.45 -3.47 -0.68 0.00 0.00 175.30 173.68 1ynj n ASP 784 N 0.37 3.29 -3.74 0.23 -0.08 -1.26 -4.92 116.55 110.44 1ynj n ASP 784 Ca -0.11 -2.03 -0.13 0.00 -1.51 0.00 0.00 54.79 51.01 1ynj n ASP 784 Cb 0.53 -0.41 -0.13 0.00 2.34 0.00 0.00 41.12 43.44 1ynj n ASP 784 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1ynj s VAL 785 N -1.25 -0.04 0.63 5.18 0.11 -1.26 -4.66 120.40 119.11 1ynj s VAL 785 Ca 0.40 0.15 -0.07 0.00 -2.93 0.00 0.00 61.98 59.54 1ynj s VAL 785 Cb 0.21 -0.32 0.02 0.00 -1.53 0.00 0.00 36.38 34.77 1ynj s VAL 785 CO 0.27 0.06 0.94 -0.75 -3.33 0.00 0.00 175.10 172.29 1ynj s LYS 786 N 1.12 2.74 -0.09 1.54 2.20 0.12 -4.80 119.74 122.57 1ynj s LYS 786 Ca -0.08 -0.03 -0.11 0.00 -0.36 0.00 0.00 55.97 55.39 1ynj s LYS 786 Cb -0.10 -2.23 -0.08 0.00 -1.51 0.00 0.00 37.83 33.91 1ynj s LYS 786 CO -0.07 -0.86 0.37 0.22 -0.36 0.00 0.00 175.35 174.66 1ynj h ASP 787 N -0.32 -0.10 -4.86 1.43 1.82 -1.84 -2.92 116.42 109.63 1ynj h ASP 787 Ca -0.45 -0.23 -0.16 0.00 -0.39 0.00 0.00 57.03 55.80 1ynj h ASP 787 Cb 1.27 0.03 -0.10 0.00 0.68 0.00 0.00 39.33 41.21 1ynj h ASP 787 CO 0.61 0.49 -0.23 1.07 -1.61 0.00 0.00 179.24 179.56 1ynj n THR 788 N -4.83 0.00 -1.04 2.25 5.66 -1.25 -3.80 114.28 111.28 1ynj n THR 788 Ca -0.04 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.74 1ynj n THR 788 Cb 0.16 -0.13 0.18 0.00 -1.55 0.00 0.00 70.33 68.99 1ynj n THR 788 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1ynj n SER 789 N -1.38 -1.49 0.00 1.09 7.64 -1.07 -4.46 113.62 113.95 1ynj n SER 789 Ca 0.03 -1.05 0.00 0.00 1.01 0.00 0.00 58.87 58.86 1ynj n SER 789 Cb 0.38 -0.74 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 1ynj n SER 789 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1ynj n LEU 790 N 0.00 2.03 0.00 -3.43 7.94 0.15 -4.82 117.00 118.87 1ynj n LEU 790 Ca 0.11 0.17 0.00 0.00 -1.11 0.00 0.00 56.01 55.18 1ynj n LEU 790 Cb 0.43 -0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.35 1ynj n LEU 790 CO 0.30 -0.03 0.00 0.54 -1.11 0.00 0.00 177.39 177.09 1ynj n ARG 791 N -0.60 0.00 -2.75 1.96 1.74 -1.25 -4.85 116.66 110.90 1ynj n ARG 791 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 1ynj n ARG 791 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.41 1ynj n ARG 791 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ynj s VAL 792 N -2.48 4.84 0.58 1.55 1.01 -0.77 -4.80 120.40 120.31 1ynj s VAL 792 Ca 0.00 1.94 -0.16 0.00 0.00 0.00 0.00 61.98 63.76 1ynj s VAL 792 Cb 0.00 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 1ynj s VAL 792 CO 0.00 0.06 1.05 -2.16 0.00 0.00 0.00 175.10 174.05 1ynj s PRO 793 N 1.74 3.41 0.24 2.72 0.04 -1.26 0.26 135.00 142.15 1ynj s PRO 793 Ca 0.47 1.21 -0.31 0.00 0.04 0.00 0.00 61.00 62.41 1ynj s PRO 793 Cb -0.18 -2.04 -0.12 0.00 0.04 0.00 0.00 34.50 32.19 1ynj s PRO 793 CO 0.19 -0.74 1.66 -2.14 0.04 0.00 0.00 177.00 176.01 1ynj s PRO 794 N -3.97 4.13 0.00 0.56 0.02 -1.26 -1.88 135.00 132.59 1ynj s PRO 794 Ca 0.64 2.58 0.00 0.00 0.02 0.00 0.00 61.00 64.24 1ynj s PRO 794 Cb -0.16 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1ynj s PRO 794 CO 0.35 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.73 1ynj n GLY 795 N 3.16 3.11 3.94 0.52 0.00 -1.26 -5.00 105.19 109.65 1ynj n GLY 795 Ca 0.12 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.85 1ynj n GLY 795 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ynj s GLU 796 N 0.00 0.74 0.00 1.61 2.02 -0.79 -5.00 118.70 117.29 1ynj s GLU 796 Ca 0.00 -0.50 0.00 0.00 0.02 0.00 0.00 54.97 54.49 1ynj s GLU 796 Cb 0.00 -1.90 0.00 0.00 0.10 0.00 0.00 34.13 32.33 1ynj s GLU 796 CO 0.00 -2.32 0.00 0.41 0.02 0.00 0.00 175.26 173.37 1ynj n GLY 797 N -3.67 4.08 0.00 -1.39 0.00 -1.26 -3.45 105.19 99.51 1ynj n GLY 797 Ca 0.15 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.61 1ynj n GLY 797 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ynj n GLY 798 N -1.62 -0.55 3.79 -0.02 0.00 0.47 -4.90 105.19 102.35 1ynj n GLY 798 Ca 0.00 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 1ynj n GLY 798 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ynj s ILE 799 N -3.84 5.39 -0.18 -0.61 1.01 0.07 -0.17 121.20 122.87 1ynj s ILE 799 Ca 0.00 0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.68 1ynj s ILE 799 Cb 0.00 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.96 1ynj s ILE 799 CO 0.00 0.50 1.22 -0.69 0.00 0.00 0.00 174.94 175.97 1ynj s VAL 800 N -0.22 4.36 -0.02 2.92 1.01 -0.08 0.52 120.40 128.88 1ynj s VAL 800 Ca 0.14 1.64 0.04 0.00 0.00 0.00 0.00 61.98 63.80 1ynj s VAL 800 Cb -0.12 -4.06 -0.06 0.00 0.00 0.00 0.00 36.38 32.13 1ynj s VAL 800 CO 0.03 -0.14 0.07 0.55 0.00 0.00 0.00 175.10 175.60 1ynj n VAL 801 N 5.35 0.12 -3.57 2.92 3.14 0.07 0.11 118.33 126.47 1ynj n VAL 801 Ca 0.13 -0.14 -0.11 0.00 -2.96 0.00 0.00 64.34 61.26 1ynj n VAL 801 Cb 0.45 -0.14 -0.05 0.00 -1.06 0.00 0.00 33.84 33.04 1ynj n VAL 801 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1ynj s GLY 802 N -2.94 -0.32 0.27 7.55 0.00 -1.20 -4.91 107.32 105.77 1ynj s GLY 802 Ca -0.02 1.90 0.09 0.00 0.00 0.00 0.00 44.72 46.69 1ynj s GLY 802 CO 0.18 1.00 0.07 1.09 0.00 0.00 0.00 173.10 175.45 1ynj s ARG 803 N -1.17 2.50 -0.06 2.90 1.04 -1.26 0.38 118.95 123.28 1ynj s ARG 803 Ca -0.03 -1.31 -0.03 0.00 -1.04 0.00 0.00 55.73 53.32 1ynj s ARG 803 Cb -0.00 -2.29 0.04 0.00 -2.04 0.00 0.00 34.95 30.65 1ynj s ARG 803 CO 0.03 0.36 0.13 -1.17 -0.04 0.00 0.00 175.30 174.60 1ynj s LEU 804 N -3.74 0.84 -0.06 -1.89 2.96 0.46 -4.93 118.68 112.31 1ynj s LEU 804 Ca 0.32 0.27 0.05 0.00 -0.22 0.00 0.00 54.13 54.55 1ynj s LEU 804 Cb -0.07 0.32 -0.00 0.00 0.50 0.00 0.00 46.19 46.94 1ynj s LEU 804 CO 0.22 -0.14 -0.20 -0.60 -1.32 0.00 0.00 176.35 174.31 1ynj s ARG 805 N 1.06 2.22 -0.10 1.98 6.06 -1.26 0.16 118.95 129.06 1ynj s ARG 805 Ca -0.08 -0.73 -0.02 0.00 -2.50 0.00 0.00 55.73 52.41 1ynj s ARG 805 Cb -0.11 -1.85 0.03 0.00 0.06 0.00 0.00 34.95 33.09 1ynj s ARG 805 CO -0.05 0.25 0.00 -0.51 -2.50 0.00 0.00 175.30 172.50 1ynj s LEU 806 N 0.09 0.74 -0.15 -0.88 1.43 -0.46 -4.99 118.68 114.46 1ynj s LEU 806 Ca -0.07 -0.25 -0.04 0.00 -1.03 0.00 0.00 54.13 52.74 1ynj s LEU 806 Cb -0.14 -0.49 -0.03 0.00 0.03 0.00 0.00 46.19 45.56 1ynj s LEU 806 CO 0.04 -0.21 -0.02 -0.13 0.23 0.00 0.00 176.35 176.26 1ynj s ARG 807 N 1.94 3.59 -0.25 1.70 0.52 -1.26 0.21 118.95 125.40 1ynj s ARG 807 Ca 0.04 -0.48 -0.39 0.00 -0.52 0.00 0.00 55.73 54.38 1ynj s ARG 807 Cb -0.13 -2.93 -0.14 0.00 0.52 0.00 0.00 34.95 32.26 1ynj s ARG 807 CO -0.06 0.32 1.81 -2.13 0.02 0.00 0.00 175.30 175.27 1ynj n ARG 808 N 3.30 1.38 0.00 3.54 0.63 -1.26 -2.41 116.66 121.83 1ynj n ARG 808 Ca -0.17 0.50 0.00 0.00 -0.92 0.00 0.00 57.85 57.25 1ynj n ARG 808 Cb 0.53 -2.25 0.00 0.00 0.45 0.00 0.00 32.46 31.19 1ynj n ARG 808 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ynj n GLY 809 N 4.44 1.84 0.00 5.14 0.00 -1.26 -4.83 105.19 110.52 1ynj n GLY 809 Ca 0.27 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1ynj n GLY 809 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ynj n ASP 810 N 0.00 0.00 0.00 1.61 -0.08 -1.01 -4.59 116.55 112.48 1ynj n ASP 810 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1ynj n ASP 810 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1ynj n ASP 810 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1ynj n PRO 811 N 0.00 0.00 0.00 -0.67 -0.01 -1.26 -2.17 135.00 130.88 1ynj n PRO 811 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 63.50 63.64 1ynj n PRO 811 Cb 0.00 -0.05 0.82 0.00 -0.01 0.00 0.00 33.50 34.26 1ynj n PRO 811 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1ynj n GLY 812 N 0.00 -1.04 3.70 -1.23 0.00 -1.26 -4.88 105.19 100.47 1ynj n GLY 812 Ca 0.00 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1ynj n GLY 812 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ynj s VAL 813 N -2.21 4.86 -0.38 1.61 1.01 -0.92 -4.84 120.40 119.52 1ynj s VAL 813 Ca 0.38 1.98 0.02 0.00 0.00 0.00 0.00 61.98 64.36 1ynj s VAL 813 Cb 0.20 -4.29 0.15 0.00 0.00 0.00 0.00 36.38 32.45 1ynj s VAL 813 CO 0.38 0.12 0.27 -0.70 0.00 0.00 0.00 175.10 175.17 1ynj s GLU 814 N 1.31 0.73 0.55 2.72 2.12 -1.26 -4.44 118.70 120.43 1ynj s GLU 814 Ca 0.49 -1.68 -0.07 0.00 0.36 0.00 0.00 54.97 54.07 1ynj s GLU 814 Cb -0.20 -1.40 -0.02 0.00 0.26 0.00 0.00 34.13 32.77 1ynj s GLU 814 CO 0.24 -1.28 0.88 -0.51 -0.54 0.00 0.00 175.26 174.04 1ynj s LEU 815 N 0.62 3.41 0.58 2.70 1.43 -1.26 -5.04 118.68 121.11 1ynj s LEU 815 Ca 0.24 0.95 -0.19 0.00 -1.03 0.00 0.00 54.13 54.11 1ynj s LEU 815 Cb -0.12 -3.88 -0.04 0.00 0.03 0.00 0.00 46.19 42.18 1ynj s LEU 815 CO -0.07 -0.81 1.15 -0.54 0.23 0.00 0.00 176.35 176.30 1ynj s LYS 816 N -4.92 3.15 0.09 1.70 -0.14 -1.26 -4.86 119.74 113.50 1ynj s LYS 816 Ca 0.51 1.64 -0.26 0.00 -1.36 0.00 0.00 55.97 56.49 1ynj s LYS 816 Cb -0.11 -1.97 -0.15 0.00 -1.68 0.00 0.00 37.83 33.93 1ynj s LYS 816 CO 0.47 -1.02 0.60 -2.30 -0.76 0.00 0.00 175.35 172.34 1ynj n PRO 817 N -1.57 0.00 0.00 -1.68 -0.01 -1.26 -1.00 135.00 129.48 1ynj n PRO 817 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.61 1ynj n PRO 817 Cb 0.51 -0.97 0.00 0.00 -0.01 0.00 0.00 33.50 33.03 1ynj n PRO 817 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1ynj n GLY 818 N 1.42 2.28 3.69 -1.23 0.00 -1.26 -4.98 105.19 105.12 1ynj n GLY 818 Ca 0.15 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1ynj n GLY 818 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ynj s VAL 819 N 0.00 3.14 -0.11 1.61 1.01 -0.17 -2.00 120.40 123.88 1ynj s VAL 819 Ca 0.00 0.54 -0.02 0.00 0.00 0.00 0.00 61.98 62.50 1ynj s VAL 819 Cb 0.00 -3.35 0.04 0.00 0.00 0.00 0.00 36.38 33.07 1ynj s VAL 819 CO 0.00 -0.01 0.02 -0.60 0.00 0.00 0.00 175.10 174.51 1ynj s ARG 820 N 2.81 0.60 0.42 2.72 3.52 0.28 -4.63 118.95 124.67 1ynj s ARG 820 Ca 0.73 -0.07 0.00 0.00 -0.13 0.00 0.00 55.73 56.27 1ynj s ARG 820 Cb -0.39 -1.37 0.00 0.00 -1.56 0.00 0.00 34.95 31.63 1ynj s ARG 820 CO 0.32 -0.42 0.00 -0.85 -0.81 0.00 0.00 175.30 173.53 1ynj n GLU 821 N 5.12 -4.34 -4.44 5.12 0.28 -1.25 -3.64 120.64 117.48 1ynj n GLU 821 Ca -0.08 3.19 -0.22 0.00 -0.16 0.00 0.00 57.16 59.90 1ynj n GLU 821 Cb 0.49 -3.64 -0.16 0.00 1.43 0.00 0.00 31.44 29.56 1ynj n GLU 821 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1ynj s VAL 822 N -2.77 0.89 -0.04 3.84 1.01 0.13 -1.48 120.40 121.98 1ynj s VAL 822 Ca 0.00 -0.38 0.04 0.00 0.00 0.00 0.00 61.98 61.64 1ynj s VAL 822 Cb 0.00 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1ynj s VAL 822 CO 0.00 0.28 -0.16 -0.69 0.00 0.00 0.00 175.10 174.54 1ynj s VAL 823 N 0.42 2.96 -0.10 2.92 1.01 0.13 -1.35 120.40 126.39 1ynj s VAL 823 Ca -0.08 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.13 1ynj s VAL 823 Cb -0.12 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.13 1ynj s VAL 823 CO 0.01 0.58 -0.09 -0.13 0.00 0.00 0.00 175.10 175.47 1ynj s ARG 824 N -0.76 1.60 -0.14 2.72 0.52 0.41 -1.30 118.95 122.00 1ynj s ARG 824 Ca 0.12 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 55.02 1ynj s ARG 824 Cb -0.11 -1.53 -0.01 0.00 0.52 0.00 0.00 34.95 33.82 1ynj s ARG 824 CO 0.01 -0.17 -0.16 0.08 0.02 0.00 0.00 175.30 175.08 1ynj s VAL 825 N 1.34 2.73 -0.16 3.52 1.01 -0.14 0.17 120.40 128.88 1ynj s VAL 825 Ca -0.02 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.15 1ynj s VAL 825 Cb -0.14 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 1ynj s VAL 825 CO -0.04 0.52 -0.01 -0.36 0.00 0.00 0.00 175.10 175.21 1ynj s PHE 826 N 0.58 3.10 -0.24 5.22 0.40 0.16 -0.83 117.98 126.36 1ynj s PHE 826 Ca -0.09 -0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.08 1ynj s PHE 826 Cb -0.16 -1.98 0.06 0.00 0.51 0.00 0.00 43.02 41.46 1ynj s PHE 826 CO 0.03 0.05 -0.03 0.08 0.70 0.00 0.00 175.22 176.06 1ynj s VAL 827 N 0.27 1.39 0.77 -0.44 1.01 -1.10 -0.75 120.40 121.55 1ynj s VAL 827 Ca -0.01 -1.18 -0.12 0.00 0.00 0.00 0.00 61.98 60.68 1ynj s VAL 827 Cb -0.13 -1.72 0.06 0.00 0.00 0.00 0.00 36.38 34.59 1ynj s VAL 827 CO 0.02 -0.16 1.15 0.00 0.00 0.00 0.00 175.10 176.11 1ynj s ALA 828 N 1.45 2.75 -0.30 5.51 0.00 0.19 -1.45 121.76 129.91 1ynj s ALA 828 Ca -0.04 -0.58 -0.09 0.00 0.00 0.00 0.00 51.96 51.26 1ynj s ALA 828 Cb -0.19 -2.96 0.19 0.00 0.00 0.00 0.00 23.12 20.16 1ynj s ALA 828 CO -0.07 -1.50 0.98 -1.14 0.00 0.00 0.00 175.76 174.03 1ynj s GLN 829 N -5.50 0.20 0.31 0.00 0.74 -0.63 -0.76 119.66 114.04 1ynj s GLN 829 Ca 0.61 0.19 -0.29 0.00 0.05 0.00 0.00 55.36 55.92 1ynj s GLN 829 Cb -0.11 0.09 -0.12 0.00 1.10 0.00 0.00 33.01 33.96 1ynj s GLN 829 CO 0.50 -0.38 1.35 1.63 -0.55 0.00 0.00 175.29 177.84 1ynj n LYS 830 N 5.13 2.17 -0.04 1.67 5.02 -1.26 -1.10 118.16 129.74 1ynj n LYS 830 Ca 0.09 0.76 -0.06 0.00 -2.02 0.00 0.00 58.31 57.09 1ynj n LYS 830 Cb 0.57 -2.38 -0.02 0.00 -0.02 0.00 0.00 35.03 33.18 1ynj n LYS 830 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1ynj n ARG 831 N 1.06 0.33 0.00 1.97 1.74 0.41 -4.89 116.66 117.28 1ynj n ARG 831 Ca 0.07 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1ynj n ARG 831 Cb 0.35 -1.06 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 1ynj n ARG 831 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1ynj n LYS 832 N -4.02 0.00 -1.68 5.56 5.02 -1.26 -4.90 118.16 116.88 1ynj n LYS 832 Ca -0.09 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.84 1ynj n LYS 832 Cb 0.32 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.41 1ynj n LYS 832 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1ynj n LEU 833 N -0.51 5.95 -3.72 -0.35 7.94 -1.26 -4.94 117.00 120.11 1ynj n LEU 833 Ca 0.00 0.81 -0.14 0.00 -1.11 0.00 0.00 56.01 55.58 1ynj n LEU 833 Cb 0.00 -1.55 -0.09 0.00 0.53 0.00 0.00 43.42 42.30 1ynj n LEU 833 CO 0.00 -1.04 0.11 -1.58 -1.11 0.00 0.00 177.39 173.76 1ynj s GLN 834 N -3.43 0.60 -0.09 1.96 0.74 -1.26 -5.02 119.66 113.16 1ynj s GLN 834 Ca 0.82 0.32 -0.29 0.00 0.05 0.00 0.00 55.36 56.26 1ynj s GLN 834 Cb -0.37 0.28 -0.06 0.00 1.10 0.00 0.00 33.01 33.96 1ynj s GLN 834 CO 0.41 -0.12 1.89 0.08 -0.55 0.00 0.00 175.29 176.99 1ynj s VAL 835 N -0.38 3.27 0.00 1.34 1.01 -1.26 -1.45 120.40 122.92 1ynj s VAL 835 Ca -0.05 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1ynj s VAL 835 Cb -0.03 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1ynj s VAL 835 CO 0.03 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.66 1ynj n GLY 836 N 4.74 1.46 3.71 4.51 0.00 -0.44 -4.86 105.19 114.31 1ynj n GLY 836 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1ynj n GLY 836 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ynj s ASP 837 N -1.08 3.59 -0.09 1.61 1.01 -0.53 -4.20 116.67 116.98 1ynj s ASP 837 Ca 0.00 1.72 0.01 0.00 0.71 0.00 0.00 52.55 54.99 1ynj s ASP 837 Cb 0.00 -2.36 0.02 0.00 1.01 0.00 0.00 42.92 41.58 1ynj s ASP 837 CO 0.00 -2.60 -0.11 -1.59 0.21 0.00 0.00 175.17 171.08 1ynj s LYS 838 N -4.85 1.76 -0.02 8.23 -2.85 -1.26 -1.07 119.74 119.68 1ynj s LYS 838 Ca 0.63 -0.39 -0.01 0.00 -1.00 0.00 0.00 55.97 55.20 1ynj s LYS 838 Cb -0.19 -1.58 -0.04 0.00 -2.06 0.00 0.00 37.83 33.96 1ynj s LYS 838 CO 0.57 -0.10 0.10 -0.51 0.10 0.00 0.00 175.35 175.51 1ynj s LEU 839 N 1.12 4.02 0.14 2.77 1.43 -0.10 -1.48 118.68 126.58 1ynj s LEU 839 Ca -0.06 0.21 0.05 0.00 -1.03 0.00 0.00 54.13 53.30 1ynj s LEU 839 Cb -0.14 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 1ynj s LEU 839 CO -0.02 0.28 -0.11 0.00 0.23 0.00 0.00 176.35 176.74 1ynj s ALA 840 N -1.20 1.42 0.39 4.21 0.00 -0.28 -1.58 121.76 124.72 1ynj s ALA 840 Ca 0.23 -1.42 0.08 0.00 0.00 0.00 0.00 51.96 50.85 1ynj s ALA 840 Cb -0.12 0.02 -0.06 0.00 0.00 0.00 0.00 23.12 22.96 1ynj s ALA 840 CO 0.14 -0.06 0.09 0.54 0.00 0.00 0.00 175.76 176.47 1ynj s ASN 841 N -2.96 4.22 0.37 0.00 6.03 -1.25 0.17 114.94 121.51 1ynj s ASN 841 Ca 0.14 -1.13 0.20 0.00 -1.03 0.00 0.00 52.86 51.04 1ynj s ASN 841 Cb 0.01 -0.47 1.10 0.00 -3.03 0.00 0.00 41.25 38.85 1ynj s ASN 841 CO 0.01 -0.44 1.57 0.03 -2.03 0.00 0.00 177.10 176.25 1ynj h ARG 842 N 1.62 0.00 -0.39 3.55 3.08 -1.87 -0.04 114.38 120.33 1ynj h ARG 842 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.62 1ynj h ARG 842 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1ynj h ARG 842 CO 0.72 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 180.34 1ynj n HIS 843 N -2.27 1.41 -2.09 3.04 8.25 -1.26 -4.41 115.22 117.88 1ynj n HIS 843 Ca -0.01 -0.81 -0.08 0.00 -0.26 0.00 0.00 57.72 56.56 1ynj n HIS 843 Cb 0.18 -0.39 -0.01 0.00 1.12 0.00 0.00 29.99 30.90 1ynj n HIS 843 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ynj n GLY 844 N -0.02 0.10 2.68 -1.41 0.00 -0.03 -4.52 105.19 101.99 1ynj n GLY 844 Ca 0.24 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 1ynj n GLY 844 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ynj n ASN 845 N 0.53 6.47 -4.64 1.61 4.05 -1.24 -4.78 115.26 117.26 1ynj n ASN 845 Ca -0.09 -3.11 -0.30 0.00 0.45 0.00 0.00 54.58 51.52 1ynj n ASN 845 Cb 0.55 -1.43 0.18 0.00 1.23 0.00 0.00 39.78 40.31 1ynj n ASN 845 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 1ynj s LYS 846 N -0.27 0.59 0.00 1.20 -2.85 -1.26 -3.95 119.74 113.20 1ynj s LYS 846 Ca 0.46 1.19 0.00 0.00 -1.00 0.00 0.00 55.97 56.62 1ynj s LYS 846 Cb 0.14 -1.70 0.00 0.00 -2.06 0.00 0.00 37.83 34.20 1ynj s LYS 846 CO -0.04 -2.80 0.00 0.41 0.10 0.00 0.00 175.35 173.02 1ynj n GLY 847 N 0.03 2.40 3.81 0.59 0.00 -0.61 -4.91 105.19 106.49 1ynj n GLY 847 Ca 0.08 -0.67 -0.37 0.00 0.00 0.00 0.00 46.02 45.06 1ynj n GLY 847 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ynj s VAL 848 N -2.00 5.18 0.09 1.61 -7.23 -1.25 -0.92 120.40 115.88 1ynj s VAL 848 Ca 0.00 0.69 -0.31 0.00 -1.81 0.00 0.00 61.98 60.55 1ynj s VAL 848 Cb 0.00 -3.66 -0.10 0.00 0.56 0.00 0.00 36.38 33.19 1ynj s VAL 848 CO 0.00 0.52 1.87 -0.69 -0.31 0.00 0.00 175.10 176.49 1ynj s VAL 849 N -0.53 2.72 -0.10 1.32 1.01 -0.23 0.24 120.40 124.83 1ynj s VAL 849 Ca 0.21 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.27 1ynj s VAL 849 Cb -0.15 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1ynj s VAL 849 CO 0.09 -0.00 0.10 0.00 0.00 0.00 0.00 175.10 175.29 1ynj n ALA 850 N 6.34 2.29 -3.61 5.51 0.00 0.23 -1.32 120.51 129.95 1ynj n ALA 850 Ca 0.18 -0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.52 1ynj n ALA 850 Cb 0.39 -0.09 -0.06 0.00 0.00 0.00 0.00 19.45 19.69 1ynj n ALA 850 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1ynj s LYS 851 N -1.42 0.55 -0.03 0.00 2.47 -1.23 -4.99 119.74 115.09 1ynj s LYS 851 Ca 0.01 1.10 -0.19 0.00 -1.56 0.00 0.00 55.97 55.33 1ynj s LYS 851 Cb 0.02 0.36 -0.05 0.00 -1.46 0.00 0.00 37.83 36.70 1ynj s LYS 851 CO 0.11 -0.14 0.54 0.96 0.16 0.00 0.00 175.35 176.97 1ynj s ILE 852 N 2.02 4.98 -0.00 5.43 -5.25 -1.26 0.15 121.20 127.27 1ynj s ILE 852 Ca -0.08 1.11 0.04 0.00 -0.99 0.00 0.00 60.65 60.73 1ynj s ILE 852 Cb -0.07 -3.87 -0.03 0.00 2.95 0.00 0.00 42.46 41.44 1ynj s ILE 852 CO -0.18 0.43 -0.08 -0.76 -1.79 0.00 0.00 174.94 172.55 1ynj s LEU 853 N -0.19 3.08 0.40 0.37 1.02 0.16 -4.84 118.68 118.68 1ynj s LEU 853 Ca 0.29 -0.17 -0.25 0.00 0.02 0.00 0.00 54.13 54.02 1ynj s LEU 853 Cb -0.17 -1.76 -0.08 0.00 0.02 0.00 0.00 46.19 44.20 1ynj s LEU 853 CO 0.15 0.29 1.13 -2.16 0.02 0.00 0.00 176.35 175.78 1ynj s PRO 854 N -1.34 4.07 0.65 1.29 0.04 -1.26 -0.15 135.00 138.30 1ynj s PRO 854 Ca 0.16 1.74 0.18 0.00 0.04 0.00 0.00 61.00 63.12 1ynj s PRO 854 Cb -0.11 -2.62 0.87 0.00 0.04 0.00 0.00 34.50 32.68 1ynj s PRO 854 CO 0.06 -0.28 1.47 -0.39 0.04 0.00 0.00 177.00 177.90 1ynj h VAL 855 N 2.25 0.05 -0.90 -0.36 -1.51 -1.96 0.29 116.25 114.11 1ynj h VAL 855 Ca -0.49 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.02 1ynj h VAL 855 Cb 1.23 0.30 -0.05 0.00 -2.13 0.00 0.00 31.29 30.64 1ynj h VAL 855 CO 0.62 0.00 0.59 -0.33 -1.23 0.00 0.00 177.57 177.22 1ynj h GLU 856 N 0.00 1.09 0.00 5.19 3.07 -1.93 -3.39 114.58 118.61 1ynj h GLU 856 Ca 0.10 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1ynj h GLU 856 Cb 1.58 -0.24 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 1ynj h GLU 856 CO -0.00 0.72 0.00 -0.25 -1.40 0.00 0.00 179.01 178.08 1ynj n ASP 857 N -4.45 0.00 -1.23 1.42 8.00 0.09 -3.55 116.55 116.84 1ynj n ASP 857 Ca 0.12 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.62 1ynj n ASP 857 Cb 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 1ynj n ASP 857 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1ynj n MET 858 N 0.00 -2.68 -1.63 -1.24 2.81 -1.26 -4.52 117.12 108.59 1ynj n MET 858 Ca 0.00 2.14 -0.43 0.00 -1.81 0.00 0.00 57.70 57.60 1ynj n MET 858 Cb 0.00 -2.05 -0.01 0.00 -0.71 0.00 0.00 33.22 30.46 1ynj n MET 858 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1ynj n PRO 859 N 0.85 1.62 -4.12 0.03 -0.04 -1.26 -3.20 135.00 128.88 1ynj n PRO 859 Ca 0.00 0.57 -0.15 0.00 -0.04 0.00 0.00 63.50 63.88 1ynj n PRO 859 Cb 0.00 -2.06 -0.14 0.00 -0.04 0.00 0.00 33.50 31.25 1ynj n PRO 859 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1ynj s HIS 860 N -1.13 0.41 0.98 0.54 -3.43 -0.80 -1.38 115.29 110.47 1ynj s HIS 860 Ca 0.59 -0.08 -0.13 0.00 -0.80 0.00 0.00 55.06 54.64 1ynj s HIS 860 Cb -0.62 -0.26 0.09 0.00 -1.43 0.00 0.00 32.58 30.35 1ynj s HIS 860 CO 0.60 -0.01 0.55 1.28 -2.00 0.00 0.00 174.74 175.16 1ynj n LEU 861 N 2.97 0.19 -0.34 5.38 4.32 0.23 -2.41 117.00 127.35 1ynj n LEU 861 Ca -0.13 0.26 -0.00 0.00 -0.02 0.00 0.00 56.01 56.12 1ynj n LEU 861 Cb 0.58 -1.24 0.13 0.00 -1.62 0.00 0.00 43.42 41.28 1ynj n LEU 861 CO 0.25 -3.22 1.24 -0.65 -1.22 0.00 0.00 177.39 173.79 1ynj h PRO 862 N -1.78 1.12 0.00 3.23 0.11 -1.87 -2.30 132.00 130.51 1ynj h PRO 862 Ca -0.46 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1ynj h PRO 862 Cb 1.29 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1ynj h PRO 862 CO 0.37 0.74 0.12 -0.40 -0.21 0.00 0.00 178.00 178.62 1ynj n ASP 863 N -4.51 0.28 0.00 -2.05 3.85 -1.26 -4.80 116.55 108.05 1ynj n ASP 863 Ca 0.12 0.56 0.00 0.00 -0.71 0.00 0.00 54.79 54.77 1ynj n ASP 863 Cb 0.10 -0.57 0.00 0.00 -1.35 0.00 0.00 41.12 39.30 1ynj n ASP 863 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ynj n GLY 864 N -1.34 2.09 3.67 6.12 0.00 -0.86 -5.07 105.19 109.80 1ynj n GLY 864 Ca -0.01 -0.35 -0.46 0.00 0.00 0.00 0.00 46.02 45.20 1ynj n GLY 864 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ynj n THR 865 N 0.00 0.12 -2.12 2.61 -2.24 -1.26 -4.68 114.28 106.72 1ynj n THR 865 Ca 0.00 -0.02 -0.32 0.00 -2.27 0.00 0.00 64.05 61.44 1ynj n THR 865 Cb 0.00 -1.60 -0.01 0.00 -2.10 0.00 0.00 70.33 66.62 1ynj n THR 865 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1ynj s PRO 866 N 1.58 3.62 0.18 -0.78 0.04 -1.26 -0.60 135.00 137.78 1ynj s PRO 866 Ca 0.82 0.97 -0.03 0.00 0.04 0.00 0.00 61.00 62.79 1ynj s PRO 866 Cb -0.68 -2.08 0.04 0.00 0.04 0.00 0.00 34.50 31.82 1ynj s PRO 866 CO 0.41 -0.55 0.20 1.33 0.04 0.00 0.00 177.00 178.43 1ynj n VAL 867 N -2.10 0.00 0.00 -0.36 0.24 -0.48 -4.87 118.33 110.76 1ynj n VAL 867 Ca 0.07 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 1ynj n VAL 867 Cb 0.54 -1.43 0.00 0.00 -1.47 0.00 0.00 33.84 31.48 1ynj n VAL 867 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1ynj n ASP 868 N -3.23 0.86 -4.01 -1.34 8.00 0.37 -4.84 116.55 112.36 1ynj n ASP 868 Ca 0.03 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.33 1ynj n ASP 868 Cb 0.10 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 41.05 1ynj n ASP 868 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ynj s VAL 869 N -1.91 0.72 -0.39 2.53 0.11 -0.95 0.69 120.40 121.21 1ynj s VAL 869 Ca 0.00 -0.36 -0.06 0.00 -2.93 0.00 0.00 61.98 58.62 1ynj s VAL 869 Cb 0.00 -0.63 0.07 0.00 -1.53 0.00 0.00 36.38 34.30 1ynj s VAL 869 CO 0.00 0.22 0.19 -0.63 -3.33 0.00 0.00 175.10 171.55 1ynj s ILE 870 N -0.01 3.80 -0.17 7.04 1.01 -0.58 -2.35 121.20 129.94 1ynj s ILE 870 Ca 0.00 -1.49 -0.09 0.00 0.00 0.00 0.00 60.65 59.07 1ynj s ILE 870 Cb -0.06 -3.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.03 1ynj s ILE 870 CO -0.00 -0.44 0.14 -0.22 0.00 0.00 0.00 174.94 174.42 1ynj s LEU 871 N 1.34 4.27 -0.02 2.97 2.96 0.10 -3.46 118.68 126.84 1ynj s LEU 871 Ca 0.02 0.33 -0.28 0.00 -0.22 0.00 0.00 54.13 53.98 1ynj s LEU 871 Cb -0.22 -2.10 -0.03 0.00 0.50 0.00 0.00 46.19 44.34 1ynj s LEU 871 CO 0.00 0.25 0.90 0.21 -1.32 0.00 0.00 176.35 176.39 1ynj s ASN 872 N -0.10 7.25 0.22 3.68 3.84 -1.25 -0.61 114.94 127.97 1ynj s ASN 872 Ca 0.11 1.51 -0.09 0.00 0.21 0.00 0.00 52.86 54.60 1ynj s ASN 872 Cb -0.11 -2.52 0.18 0.00 -0.55 0.00 0.00 41.25 38.24 1ynj s ASN 872 CO 0.00 -0.22 1.87 1.55 -2.79 0.00 0.00 177.10 177.51 1ynj h PRO 873 N 6.80 1.09 -0.14 0.43 0.13 -1.84 -2.16 132.00 136.31 1ynj h PRO 873 Ca -0.41 -0.09 0.04 0.00 -0.87 0.00 0.00 66.00 64.67 1ynj h PRO 873 Cb 1.21 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 1ynj h PRO 873 CO 0.75 0.76 0.50 -0.07 -0.23 0.00 0.00 178.00 179.71 1ynj h LEU 874 N 1.11 0.00 -0.84 1.56 3.38 -1.94 0.82 115.31 119.39 1ynj h LEU 874 Ca 0.29 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.22 1ynj h LEU 874 Cb -0.07 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ynj h LEU 874 CO -0.06 0.00 0.34 1.23 0.09 0.00 0.00 178.44 180.04 1ynj h GLY 875 N 0.00 1.27 0.00 0.83 0.00 -1.69 -3.39 103.07 100.10 1ynj h GLY 875 Ca 0.07 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1ynj h GLY 875 CO -0.00 0.64 0.00 -0.62 0.00 0.00 0.00 176.54 176.56 1ynj n VAL 876 N -4.28 0.00 -0.31 4.60 0.31 0.29 -4.14 118.33 114.79 1ynj n VAL 876 Ca 0.07 1.48 0.05 0.00 -0.01 0.00 0.00 64.34 65.93 1ynj n VAL 876 Cb 0.17 -2.44 0.24 0.00 -0.91 0.00 0.00 33.84 30.91 1ynj n VAL 876 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1ynj h PRO 877 N 0.00 0.99 0.17 5.55 0.13 -1.76 -2.84 132.00 134.24 1ynj h PRO 877 Ca 0.00 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 1ynj h PRO 877 Cb 0.00 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 30.91 1ynj h PRO 877 CO 0.00 0.65 -0.08 1.03 -0.23 0.00 0.00 178.00 179.37 1ynj h SER 878 N 1.02 -0.19 -4.12 1.44 0.87 -1.82 -3.39 113.55 107.35 1ynj h SER 878 Ca 0.40 -0.32 -0.48 0.00 -1.23 0.00 0.00 61.79 60.17 1ynj h SER 878 Cb 0.25 0.05 0.03 0.00 -0.44 0.00 0.00 62.40 62.29 1ynj h SER 878 CO -0.16 0.26 0.38 0.00 -0.53 0.00 0.00 176.83 176.78 1ynj s ARG 879 N -4.16 3.69 -0.45 2.24 3.03 -1.07 -4.97 118.95 117.26 1ynj s ARG 879 Ca -0.14 1.27 0.05 0.00 2.03 0.00 0.00 55.73 58.93 1ynj s ARG 879 Cb 0.01 -2.08 0.42 0.00 -1.03 0.00 0.00 34.95 32.27 1ynj s ARG 879 CO 0.56 -0.51 1.17 -1.33 -1.13 0.00 0.00 175.30 174.06 1ynj n MET 880 N -1.32 3.40 -2.40 3.89 2.81 -1.26 -4.73 117.12 117.51 1ynj n MET 880 Ca 0.09 -4.42 -0.42 0.00 -1.81 0.00 0.00 57.70 51.14 1ynj n MET 880 Cb 0.53 -2.25 0.01 0.00 -0.71 0.00 0.00 33.22 30.79 1ynj n MET 880 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1ynj n ASN 881 N -0.50 6.74 0.30 7.83 2.04 -1.26 -0.73 115.26 129.68 1ynj n ASN 881 Ca 0.40 -3.29 0.19 0.00 -0.44 0.00 0.00 54.58 51.45 1ynj n ASN 881 Cb 0.66 -1.34 0.93 0.00 -2.53 0.00 0.00 39.78 37.49 1ynj n ASN 881 CO 0.00 0.00 0.00 0.25 -0.44 0.00 0.00 177.26 177.07 1ynj h LEU 882 N 5.98 0.00 -0.89 -4.53 5.85 -1.81 -3.05 115.31 116.87 1ynj h LEU 882 Ca 0.48 0.00 0.13 0.00 0.84 0.00 0.00 57.88 59.34 1ynj h LEU 882 Cb 0.46 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.40 1ynj h LEU 882 CO 1.44 0.01 0.50 1.23 -0.34 0.00 0.00 178.44 181.29 1ynj h GLY 883 N 1.02 1.44 0.50 3.75 0.00 -1.78 -1.56 103.07 106.45 1ynj h GLY 883 Ca -0.00 -0.31 0.12 0.00 0.00 0.00 0.00 47.33 47.14 1ynj h GLY 883 CO 0.00 0.04 0.62 0.06 0.00 0.00 0.00 176.54 177.26 1ynj h GLN 884 N 0.75 0.92 0.38 4.80 3.07 -1.89 0.44 115.11 123.58 1ynj h GLN 884 Ca 0.46 -0.06 -0.02 0.00 0.09 0.00 0.00 58.65 59.13 1ynj h GLN 884 Cb 0.57 -0.21 0.00 0.00 0.08 0.00 0.00 27.48 27.93 1ynj h GLN 884 CO -0.32 0.61 -0.18 0.82 0.09 0.00 0.00 178.83 179.85 1ynj h ILE 885 N 0.95 0.62 -0.80 1.86 1.08 -1.49 -1.21 117.51 118.52 1ynj h ILE 885 Ca 0.48 -0.35 0.13 0.00 -0.39 0.00 0.00 64.86 64.73 1ynj h ILE 885 Cb 0.51 0.80 -0.09 0.00 -3.07 0.00 0.00 36.82 34.97 1ynj h ILE 885 CO -0.25 0.07 0.40 -0.07 -0.69 0.00 0.00 178.15 177.61 1ynj h LEU 886 N -0.71 0.48 -1.31 1.44 3.38 -1.21 -1.65 115.31 115.74 1ynj h LEU 886 Ca -0.05 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1ynj h LEU 886 Cb 0.50 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1ynj h LEU 886 CO 0.09 0.22 0.28 -0.08 0.09 0.00 0.00 178.44 179.04 1ynj h GLU 887 N 0.60 0.75 -0.18 1.13 4.81 0.11 -0.99 114.58 120.81 1ynj h GLU 887 Ca 0.42 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.49 1ynj h GLU 887 Cb 0.56 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1ynj h GLU 887 CO -0.34 0.57 -0.24 1.15 -0.73 0.00 0.00 179.01 179.42 1ynj h THR 888 N 0.75 1.24 0.10 0.32 2.02 -0.26 -1.60 112.91 115.48 1ynj h THR 888 Ca 0.19 -1.14 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1ynj h THR 888 Cb 0.05 1.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1ynj h THR 888 CO -0.03 0.35 -0.05 0.45 0.37 0.00 0.00 175.52 176.62 1ynj h HIS 889 N 0.29 -0.12 -0.97 3.16 3.86 -0.87 -0.27 115.15 120.22 1ynj h HIS 889 Ca 0.05 -0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.32 1ynj h HIS 889 Cb 0.59 0.04 -0.07 0.00 1.06 0.00 0.00 27.41 29.03 1ynj h HIS 889 CO 0.01 0.39 0.63 1.25 0.86 0.00 0.00 177.93 181.07 1ynj h LEU 890 N -0.76 0.98 -0.73 2.43 5.85 -1.37 -1.62 115.31 120.09 1ynj h LEU 890 Ca -0.01 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1ynj h LEU 890 Cb 0.57 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1ynj h LEU 890 CO 0.02 0.62 0.42 1.23 -0.34 0.00 0.00 178.44 180.38 1ynj h GLY 891 N 1.10 1.07 1.36 3.75 0.00 -1.19 -1.62 103.07 107.54 1ynj h GLY 891 Ca 0.42 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 1ynj h GLY 891 CO -0.17 0.45 0.19 -2.00 0.00 0.00 0.00 176.54 175.01 1ynj h LEU 892 N 1.00 0.75 0.00 3.11 5.85 -0.11 -1.39 115.31 124.52 1ynj h LEU 892 Ca 0.26 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1ynj h LEU 892 Cb 0.01 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.84 1ynj h LEU 892 CO -0.04 0.70 0.00 0.00 -0.34 0.00 0.00 178.44 178.76 1ynj n ALA 893 N -2.46 -0.31 -0.25 1.25 0.00 -0.79 -3.36 120.51 114.58 1ynj n ALA 893 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.43 1ynj n ALA 893 Cb 0.19 0.16 -0.03 0.00 0.00 0.00 0.00 19.45 19.77 1ynj n ALA 893 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ynj n GLY 894 N -0.98 -1.51 0.41 0.00 0.00 -0.68 -0.44 105.19 101.99 1ynj n GLY 894 Ca 0.00 0.73 -0.08 0.00 0.00 0.00 0.00 46.02 46.66 1ynj n GLY 894 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ynj h TYR 895 N 0.00 -1.59 -0.00 1.61 3.20 -1.29 1.44 116.97 120.34 1ynj h TYR 895 Ca 0.14 0.11 -0.11 0.00 3.14 0.00 0.00 58.73 62.01 1ynj h TYR 895 Cb 0.29 0.82 0.01 0.00 1.54 0.00 0.00 36.73 39.39 1ynj h TYR 895 CO -0.61 -0.40 -0.43 0.74 -1.64 0.00 0.00 178.16 175.83 1ynj h PHE 896 N -0.06 0.44 0.00 -3.82 -1.00 -0.76 -3.27 116.94 108.47 1ynj h PHE 896 Ca 0.21 -0.24 0.00 0.00 2.81 0.00 0.00 57.97 60.75 1ynj h PHE 896 Cb 0.49 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 40.00 1ynj h PHE 896 CO -0.93 1.05 0.00 -0.11 -1.61 0.00 0.00 178.31 176.71 1ynj n LEU 897 N -4.36 0.16 -3.20 1.54 7.94 0.27 -4.92 117.00 114.43 1ynj n LEU 897 Ca -0.10 0.53 -0.15 0.00 -1.11 0.00 0.00 56.01 55.19 1ynj n LEU 897 Cb 0.59 -0.51 0.07 0.00 0.53 0.00 0.00 43.42 44.10 1ynj n LEU 897 CO 0.43 -0.27 0.04 0.61 -1.11 0.00 0.00 177.39 177.09 1ynj n GLY 898 N 0.26 -0.99 3.38 -3.96 0.00 0.49 -4.97 105.19 99.39 1ynj n GLY 898 Ca 0.04 0.49 -0.14 0.00 0.00 0.00 0.00 46.02 46.41 1ynj n GLY 898 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ynj s GLN 899 N -4.47 0.99 0.62 1.61 -2.07 -1.14 -4.35 119.66 110.85 1ynj s GLN 899 Ca 0.38 -0.21 0.07 0.00 -1.82 0.00 0.00 55.36 53.78 1ynj s GLN 899 Cb -0.05 0.45 0.10 0.00 -1.09 0.00 0.00 33.01 32.42 1ynj s GLN 899 CO 0.71 -0.34 0.85 1.03 -1.32 0.00 0.00 175.29 176.22 1ynj s ARG 900 N -2.25 2.11 0.00 9.60 0.52 -1.21 -4.44 118.95 123.29 1ynj s ARG 900 Ca -0.06 -1.48 -0.01 0.00 -0.52 0.00 0.00 55.73 53.65 1ynj s ARG 900 Cb -0.01 -2.55 -0.01 0.00 0.52 0.00 0.00 34.95 32.90 1ynj s ARG 900 CO -0.00 -1.04 0.01 0.71 0.02 0.00 0.00 175.30 175.00 1ynj s TYR 901 N -2.81 0.10 -0.35 -0.53 1.51 0.89 -3.02 117.35 113.15 1ynj s TYR 901 Ca 0.63 -0.21 -0.02 0.00 -1.01 0.00 0.00 57.07 56.46 1ynj s TYR 901 Cb -0.06 -0.08 0.08 0.00 -0.11 0.00 0.00 41.96 41.79 1ynj s TYR 901 CO 0.41 -0.12 0.09 0.42 -1.11 0.00 0.00 175.55 175.24 1ynj s ILE 902 N -0.76 3.09 -0.36 2.71 1.01 -0.86 0.17 121.20 126.21 1ynj s ILE 902 Ca -0.08 -1.73 -0.01 0.00 0.00 0.00 0.00 60.65 58.83 1ynj s ILE 902 Cb -0.05 -2.96 0.09 0.00 0.01 0.00 0.00 42.46 39.55 1ynj s ILE 902 CO -0.00 -0.39 0.11 -0.55 0.00 0.00 0.00 174.94 174.11 1ynj s SER 903 N 1.47 5.05 0.97 3.58 0.15 0.29 -1.64 113.70 123.57 1ynj s SER 903 Ca 0.02 -1.82 -0.13 0.00 0.70 0.00 0.00 55.95 54.71 1ynj s SER 903 Cb -0.21 -1.76 0.03 0.00 -1.71 0.00 0.00 66.02 62.37 1ynj s SER 903 CO -0.03 -0.43 0.29 -0.81 1.20 0.00 0.00 173.24 173.47 1ynj n PRO 904 N 4.54 -0.37 -2.45 5.44 -0.04 -1.26 -4.16 135.00 136.70 1ynj n PRO 904 Ca -0.04 -0.07 -0.40 0.00 -0.04 0.00 0.00 63.50 62.94 1ynj n PRO 904 Cb 0.42 -1.79 -0.04 0.00 -0.04 0.00 0.00 33.50 32.05 1ynj n PRO 904 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ynj s VAL 905 N -2.36 3.45 -1.48 0.52 1.01 -1.26 -0.11 120.40 120.17 1ynj s VAL 905 Ca 0.56 1.44 -0.19 0.00 0.00 0.00 0.00 61.98 63.79 1ynj s VAL 905 Cb -0.20 -3.91 0.19 0.00 0.00 0.00 0.00 36.38 32.45 1ynj s VAL 905 CO 0.68 0.33 0.47 0.49 0.00 0.00 0.00 175.10 177.08 1ynj n PHE 906 N 1.28 -1.33 -0.92 5.22 3.01 -1.26 -4.42 117.46 119.04 1ynj n PHE 906 Ca -0.01 0.54 0.00 0.00 1.01 0.00 0.00 57.45 58.99 1ynj n PHE 906 Cb 0.45 -1.67 0.00 0.00 -0.01 0.00 0.00 39.48 38.25 1ynj n PHE 906 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1ynj n ASP 907 N -2.24 0.00 -2.95 4.37 2.03 -1.21 -4.95 116.55 111.60 1ynj n ASP 907 Ca 0.09 -0.27 0.00 0.00 0.52 0.00 0.00 54.79 55.13 1ynj n ASP 907 Cb 0.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 1ynj n ASP 907 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ynj n GLY 908 N 0.00 0.29 3.65 0.27 0.00 0.84 -3.32 105.19 106.92 1ynj n GLY 908 Ca 0.00 -1.55 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 1ynj n GLY 908 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynj n ALA 909 N -3.00 0.65 -2.61 4.61 0.00 -1.26 -4.64 120.51 114.26 1ynj n ALA 909 Ca 0.00 0.17 -0.23 0.00 0.00 0.00 0.00 53.44 53.38 1ynj n ALA 909 Cb 0.00 -2.17 -0.07 0.00 0.00 0.00 0.00 19.45 17.21 1ynj n ALA 909 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ynj s THR 910 N -1.32 3.34 0.14 0.00 -4.23 -1.26 -4.99 115.64 107.32 1ynj s THR 910 Ca 0.67 -1.80 -0.21 0.00 -1.18 0.00 0.00 61.69 59.17 1ynj s THR 910 Cb -0.49 -2.93 0.01 0.00 1.34 0.00 0.00 72.50 70.43 1ynj s THR 910 CO 0.54 -0.30 1.67 -0.33 -0.54 0.00 0.00 174.62 175.66 1ynj h GLU 911 N 1.73 -0.11 -0.90 3.99 5.08 -1.97 0.30 114.58 122.70 1ynj h GLU 911 Ca -0.44 0.01 0.22 0.00 -1.00 0.00 0.00 59.36 58.14 1ynj h GLU 911 Cb 1.25 0.03 -0.17 0.00 0.50 0.00 0.00 28.75 30.36 1ynj h GLU 911 CO 0.62 -0.07 -0.09 -0.35 -1.00 0.00 0.00 179.01 178.11 1ynj n PRO 912 N -5.29 -0.08 -0.03 2.33 -0.04 -1.26 0.12 135.00 130.76 1ynj n PRO 912 Ca -0.01 1.37 -0.15 0.00 -0.04 0.00 0.00 63.50 64.67 1ynj n PRO 912 Cb 0.21 -2.12 -0.10 0.00 -0.04 0.00 0.00 33.50 31.45 1ynj n PRO 912 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1ynj h GLU 913 N 0.00 0.30 -0.26 0.54 5.08 -1.48 -2.65 114.58 116.11 1ynj h GLU 913 Ca 0.49 -0.24 0.03 0.00 -1.00 0.00 0.00 59.36 58.64 1ynj h GLU 913 Cb 0.92 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 1ynj h GLU 913 CO -0.88 0.88 0.09 0.82 -1.00 0.00 0.00 179.01 178.92 1ynj h ILE 914 N -0.22 0.94 0.00 3.13 2.04 0.31 -1.83 117.51 121.88 1ynj h ILE 914 Ca -0.02 -0.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.68 1ynj h ILE 914 Cb 0.93 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1ynj h ILE 914 CO 0.06 0.04 -0.41 0.11 0.00 0.00 0.00 178.15 177.95 1ynj h LYS 915 N 0.22 0.00 -0.69 2.37 1.79 0.86 -0.43 116.57 120.69 1ynj h LYS 915 Ca 0.11 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.56 1ynj h LYS 915 Cb 0.08 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.69 1ynj h LYS 915 CO -0.11 0.41 0.35 1.49 -1.08 0.00 0.00 179.45 180.50 1ynj h GLU 916 N 0.00 0.96 0.00 3.15 4.22 -1.05 -1.21 114.58 120.65 1ynj h GLU 916 Ca -0.00 -0.12 -0.20 0.00 0.08 0.00 0.00 59.36 59.12 1ynj h GLU 916 Cb 0.82 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 1ynj h GLU 916 CO 0.05 0.73 -0.93 -0.07 -2.18 0.00 0.00 179.01 176.61 1ynj h LEU 917 N 0.97 0.00 -0.78 1.64 3.38 -0.43 -2.32 115.31 117.77 1ynj h LEU 917 Ca 0.24 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.08 1ynj h LEU 917 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1ynj h LEU 917 CO -0.03 0.93 -0.57 -0.07 0.09 0.00 0.00 178.44 178.79 1ynj h LEU 918 N 0.00 0.14 0.85 1.67 3.38 -0.99 -2.06 115.31 118.29 1ynj h LEU 918 Ca -0.01 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1ynj h LEU 918 Cb 1.72 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 42.44 1ynj h LEU 918 CO 0.12 0.68 -0.41 0.00 0.09 0.00 0.00 178.44 178.92 1ynj h ALA 919 N 1.32 -1.19 -1.12 1.53 0.00 -1.02 -0.79 119.26 118.00 1ynj h ALA 919 Ca -0.00 -0.25 0.32 0.00 0.00 0.00 0.00 54.91 54.98 1ynj h ALA 919 Cb 1.04 0.44 -0.11 0.00 0.00 0.00 0.00 17.79 19.16 1ynj h ALA 919 CO 0.08 -1.10 0.72 1.49 0.00 0.00 0.00 179.25 180.44 1ynj h GLU 920 N -1.25 0.28 0.35 0.00 4.81 -1.43 -2.07 114.58 115.27 1ynj h GLU 920 Ca -0.12 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1ynj h GLU 920 Cb 0.87 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1ynj h GLU 920 CO 0.19 0.19 -0.17 0.00 -0.73 0.00 0.00 179.01 178.49 1ynj h ALA 921 N 1.64 -0.47 -1.15 2.92 0.00 -1.11 -3.04 119.26 118.05 1ynj h ALA 921 Ca 0.68 -0.12 0.33 0.00 0.00 0.00 0.00 54.91 55.80 1ynj h ALA 921 Cb 1.85 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 19.74 1ynj h ALA 921 CO -0.37 -0.44 0.77 0.35 0.00 0.00 0.00 179.25 179.56 1ynj h PHE 922 N -1.11 0.47 0.00 0.00 3.57 -0.81 0.31 116.94 119.37 1ynj h PHE 922 Ca -0.05 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.42 1ynj h PHE 922 Cb 0.39 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1ynj h PHE 922 CO 0.01 -0.01 -0.23 -0.97 -2.23 0.00 0.00 178.31 174.87 1ynj h ASN 923 N 0.23 0.00 0.10 0.41 -1.24 -1.32 0.15 115.58 113.91 1ynj h ASN 923 Ca 0.64 0.00 -0.34 0.00 0.71 0.00 0.00 56.30 57.31 1ynj h ASN 923 Cb 1.96 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.99 1ynj h ASN 923 CO -0.25 0.23 -1.86 -0.11 -1.29 0.00 0.00 177.43 174.15 1ynj n LEU 924 N -3.78 2.48 -0.30 0.34 0.00 0.91 -2.66 117.00 113.99 1ynj n LEU 924 Ca -0.02 0.25 -0.05 0.00 0.00 0.00 0.00 56.01 56.20 1ynj n LEU 924 Cb 0.33 -1.09 0.07 0.00 0.00 0.00 0.00 43.42 42.74 1ynj n LEU 924 CO 0.34 0.74 1.13 0.22 0.00 0.00 0.00 177.39 179.81 1ynj h TYR 925 N -0.15 1.14 0.00 1.96 3.20 -0.90 -0.78 116.97 121.44 1ynj h TYR 925 Ca -0.41 -0.04 -0.18 0.00 3.14 0.00 0.00 58.73 61.24 1ynj h TYR 925 Cb 1.89 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 39.77 1ynj h TYR 925 CO 0.08 0.81 -1.30 0.35 -1.64 0.00 0.00 178.16 176.46 1ynj h PHE 926 N 1.14 0.00 -0.91 -3.82 3.57 -0.89 -3.13 116.94 112.90 1ynj h PHE 926 Ca 0.28 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 1ynj h PHE 926 Cb 0.07 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.76 1ynj h PHE 926 CO 0.01 0.65 0.53 0.78 -2.23 0.00 0.00 178.31 178.05 1ynj h GLY 927 N 3.61 1.33 0.98 2.40 0.00 -1.29 -1.73 103.07 108.37 1ynj h GLY 927 Ca -0.15 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 46.60 1ynj h GLY 927 CO 0.06 0.55 -0.15 1.70 0.00 0.00 0.00 176.54 178.69 1ynj h LYS 928 N 1.26 -0.41 -0.69 4.80 3.64 -1.22 0.57 116.57 124.51 1ynj h LYS 928 Ca 0.32 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.81 1ynj h LYS 928 Cb -0.03 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 1ynj h LYS 928 CO -0.06 -0.26 0.46 -0.09 -2.27 0.00 0.00 179.45 177.23 1ynj h ARG 929 N -0.45 0.63 0.21 1.90 2.43 -1.42 0.24 114.38 117.92 1ynj h ARG 929 Ca -0.04 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1ynj h ARG 929 Cb 0.35 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1ynj h ARG 929 CO 0.07 0.42 -0.10 0.37 -1.51 0.00 0.00 179.97 179.22 1ynj h GLN 930 N 0.65 -0.27 0.00 0.20 5.75 -1.30 0.16 115.11 120.30 1ynj h GLN 930 Ca 0.31 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.83 1ynj h GLN 930 Cb 0.35 0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.97 1ynj h GLN 930 CO -0.10 -0.06 0.21 0.78 -2.65 0.00 0.00 178.83 177.01 1ynj h GLY 931 N -1.04 0.00 0.43 2.39 0.00 -0.38 0.35 103.07 104.83 1ynj h GLY 931 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 1ynj h GLY 931 CO 0.05 0.00 -1.61 -2.21 0.00 0.00 0.00 176.54 172.76 1ynj n GLU 932 N -2.21 0.64 0.00 4.80 4.07 0.82 -5.01 120.64 123.75 1ynj n GLU 932 Ca -0.01 -0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.04 1ynj n GLU 932 Cb 0.24 -1.65 0.00 0.00 -0.06 0.00 0.00 31.44 29.97 1ynj n GLU 932 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ynj n GLY 933 N 1.26 1.83 0.00 8.31 0.00 0.12 -5.08 105.19 111.64 1ynj n GLY 933 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ynj n GLY 933 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ynj n PHE 934 N 0.00 0.00 0.00 1.61 3.01 0.54 -5.01 117.46 117.61 1ynj n PHE 934 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1ynj n PHE 934 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1ynj n PHE 934 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ynj n GLY 935 N 0.36 2.70 3.26 1.37 0.00 -1.26 -4.19 105.19 107.43 1ynj n GLY 935 Ca 0.00 0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 1ynj n GLY 935 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ynj n VAL 936 N 0.00 -7.39 -1.68 1.61 0.31 -1.26 -4.95 118.33 104.97 1ynj n VAL 936 Ca 0.00 0.26 -0.30 0.00 -0.01 0.00 0.00 64.34 64.29 1ynj n VAL 936 Cb 0.00 -5.33 0.06 0.00 -0.91 0.00 0.00 33.84 27.66 1ynj n VAL 936 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 1ynj s ASP 937 N -2.42 5.20 0.31 4.52 1.47 -1.26 -4.69 116.67 119.80 1ynj s ASP 937 Ca 0.19 1.36 0.11 0.00 1.18 0.00 0.00 52.55 55.39 1ynj s ASP 937 Cb -0.03 -2.19 0.98 0.00 -0.34 0.00 0.00 42.92 41.34 1ynj s ASP 937 CO 0.82 -1.53 1.45 0.29 0.68 0.00 0.00 175.17 176.89 1ynj n LYS 938 N -3.16 -0.06 -0.32 2.11 5.02 -1.26 0.13 118.16 120.61 1ynj n LYS 938 Ca 0.07 1.33 0.02 0.00 -2.02 0.00 0.00 58.31 57.71 1ynj n LYS 938 Cb 0.55 -2.25 0.16 0.00 -0.02 0.00 0.00 35.03 33.48 1ynj n LYS 938 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ynj h ARG 939 N 0.00 0.97 -0.02 1.97 3.08 -1.98 -0.52 114.38 117.87 1ynj h ARG 939 Ca 0.67 -0.06 -0.18 0.00 0.07 0.00 0.00 59.98 60.49 1ynj h ARG 939 Cb 1.62 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 31.44 1ynj h ARG 939 CO -0.79 0.64 -0.78 0.93 -1.07 0.00 0.00 179.97 178.90 1ynj h GLU 940 N 1.00 0.22 -0.41 0.04 5.08 -0.64 -3.06 114.58 116.81 1ynj h GLU 940 Ca 0.40 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 1ynj h GLU 940 Cb 0.21 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1ynj h GLU 940 CO -0.19 0.90 -0.12 0.87 -1.00 0.00 0.00 179.01 179.47 1ynj h LYS 941 N 0.14 0.73 -0.04 2.33 1.57 -0.79 0.25 116.57 120.75 1ynj h LYS 941 Ca -0.03 -0.24 -0.11 0.00 -1.87 0.00 0.00 60.65 58.40 1ynj h LYS 941 Cb 1.37 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 1ynj h LYS 941 CO 0.12 0.82 -0.49 1.49 -0.57 0.00 0.00 179.45 180.82 1ynj h GLU 942 N 0.66 0.11 0.14 3.15 4.81 -1.14 -1.57 114.58 120.74 1ynj h GLU 942 Ca 0.11 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1ynj h GLU 942 Cb 0.58 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1ynj h GLU 942 CO 0.04 0.58 -0.07 0.28 -0.73 0.00 0.00 179.01 179.11 1ynj h VAL 943 N 0.09 0.00 -1.22 0.32 2.07 -1.40 -3.26 116.25 112.85 1ynj h VAL 943 Ca 0.00 -0.75 0.37 0.00 0.82 0.00 0.00 66.70 67.14 1ynj h VAL 943 Cb 0.90 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.56 1ynj h VAL 943 CO 0.07 0.00 0.80 -0.07 0.02 0.00 0.00 177.57 178.39 1ynj h LEU 944 N -0.94 0.30 0.00 2.57 3.38 -0.51 0.41 115.31 120.52 1ynj h LEU 944 Ca -0.02 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1ynj h LEU 944 Cb 0.14 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1ynj h LEU 944 CO 0.03 -0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.49 1ynj n ALA 945 N -2.53 0.00 0.29 1.53 0.00 -0.59 -2.56 120.51 116.65 1ynj n ALA 945 Ca 0.32 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.91 1ynj n ALA 945 Cb 1.23 0.06 0.79 0.00 0.00 0.00 0.00 19.45 21.54 1ynj n ALA 945 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1ynj h ARG 946 N 0.00 0.00 -0.30 0.00 0.11 -1.10 0.35 114.38 113.44 1ynj h ARG 946 Ca 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 1ynj h ARG 946 Cb 0.00 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.06 1ynj h ARG 946 CO 0.00 0.00 0.06 0.00 0.10 0.00 0.00 179.97 180.13 1ynj h ALA 947 N 1.51 1.55 0.14 0.08 0.00 -0.08 -1.80 119.26 120.66 1ynj h ALA 947 Ca 0.00 -0.13 -0.31 0.00 0.00 0.00 0.00 54.91 54.47 1ynj h ALA 947 Cb 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1ynj h ALA 947 CO 0.00 0.34 -1.51 1.05 0.00 0.00 0.00 179.25 179.13 1ynj h GLU 948 N 0.43 0.29 -0.08 0.00 4.11 -0.01 -1.69 114.58 117.64 1ynj h GLU 948 Ca 0.10 -0.50 0.02 0.00 0.07 0.00 0.00 59.36 59.06 1ynj h GLU 948 Cb 0.19 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1ynj h GLU 948 CO -0.00 1.18 0.48 0.87 0.07 0.00 0.00 179.01 181.61 1ynj h LYS 949 N 0.08 0.00 -0.64 1.06 1.57 -1.49 0.88 116.57 118.03 1ynj h LYS 949 Ca -0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 1ynj h LYS 949 Cb 2.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.34 1ynj h LYS 949 CO 0.18 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.34 1ynj n LEU 950 N -2.94 3.85 -4.36 2.94 4.77 -0.70 -4.94 117.00 115.62 1ynj n LEU 950 Ca 0.00 -1.93 -0.38 0.00 -0.03 0.00 0.00 56.01 53.67 1ynj n LEU 950 Cb 0.55 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 1ynj n LEU 950 CO 0.13 0.78 -0.15 0.61 -1.33 0.00 0.00 177.39 177.43 1ynj n GLY 951 N 1.26 -0.37 0.00 -0.72 0.00 0.31 -4.84 105.19 100.83 1ynj n GLY 951 Ca 0.22 0.11 0.03 0.00 0.00 0.00 0.00 46.02 46.38 1ynj n GLY 951 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ynj n LEU 952 N -4.27 0.22 -4.12 0.99 7.94 -0.65 -4.97 117.00 112.14 1ynj n LEU 952 Ca 0.02 -0.39 -0.17 0.00 -1.11 0.00 0.00 56.01 54.36 1ynj n LEU 952 Cb 0.51 0.00 -0.12 0.00 0.53 0.00 0.00 43.42 44.34 1ynj n LEU 952 CO 0.90 0.05 -0.44 -0.69 -1.11 0.00 0.00 177.39 176.10 1ynj s VAL 953 N -1.76 0.92 -0.11 1.96 1.01 -1.22 -4.74 120.40 116.47 1ynj s VAL 953 Ca 0.01 -1.07 -0.29 0.00 0.00 0.00 0.00 61.98 60.62 1ynj s VAL 953 Cb 0.04 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 1ynj s VAL 953 CO 0.25 -0.17 1.46 -0.44 0.00 0.00 0.00 175.10 176.20 1ynj s SER 954 N -1.39 6.80 0.55 3.32 0.01 -1.26 -4.56 113.70 117.17 1ynj s SER 954 Ca -0.03 1.96 -0.20 0.00 1.31 0.00 0.00 55.95 59.00 1ynj s SER 954 Cb -0.09 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.55 1ynj s SER 954 CO 0.01 -0.85 1.14 -2.16 0.41 0.00 0.00 173.24 171.80 1ynj s PRO 955 N 3.78 3.32 -0.06 12.44 0.04 -1.26 -3.26 135.00 150.00 1ynj s PRO 955 Ca 0.64 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.34 1ynj s PRO 955 Cb -0.27 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1ynj s PRO 955 CO 0.22 -0.89 0.00 0.41 0.04 0.00 0.00 177.00 176.78 1ynj n GLY 956 N 0.23 0.40 3.44 0.56 0.00 -1.26 -5.06 105.19 103.50 1ynj n GLY 956 Ca 0.12 -1.01 -0.27 0.00 0.00 0.00 0.00 46.02 44.86 1ynj n GLY 956 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ynj s LYS 957 N -2.67 1.59 0.43 1.61 1.02 -1.20 -5.13 119.74 115.39 1ynj s LYS 957 Ca 0.00 -1.49 -0.25 0.00 0.02 0.00 0.00 55.97 54.25 1ynj s LYS 957 Cb 0.00 -1.89 -0.08 0.00 -0.52 0.00 0.00 37.83 35.34 1ynj s LYS 957 CO 0.00 0.41 1.28 0.45 -0.92 0.00 0.00 175.35 176.57 1ynj s SER 958 N -2.68 6.21 0.31 2.83 0.15 -1.26 -4.71 113.70 114.55 1ynj s SER 958 Ca 0.21 2.60 0.07 0.00 0.70 0.00 0.00 55.95 59.53 1ynj s SER 958 Cb -0.08 -2.63 0.85 0.00 -1.71 0.00 0.00 66.02 62.45 1ynj s SER 958 CO 0.10 -0.91 1.65 1.55 1.20 0.00 0.00 173.24 176.83 1ynj h PRO 959 N 2.48 0.25 -0.37 5.44 0.13 -1.99 2.29 132.00 140.23 1ynj h PRO 959 Ca -0.50 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1ynj h PRO 959 Cb 1.25 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1ynj h PRO 959 CO 0.62 0.17 0.19 1.49 -0.23 0.00 0.00 178.00 180.23 1ynj h GLU 960 N 0.26 0.52 0.00 0.86 4.81 -1.97 0.38 114.58 119.43 1ynj h GLU 960 Ca 0.62 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.77 1ynj h GLU 960 Cb 1.32 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 1ynj h GLU 960 CO -0.64 0.44 -0.04 0.93 -0.73 0.00 0.00 179.01 178.98 1ynj h GLU 961 N 0.46 0.00 0.02 1.92 5.08 0.33 -2.38 114.58 120.01 1ynj h GLU 961 Ca 0.13 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.19 1ynj h GLU 961 Cb 0.09 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1ynj h GLU 961 CO -0.02 0.04 -1.73 1.96 -1.00 0.00 0.00 179.01 178.26 1ynj h GLN 962 N 0.00 0.04 0.41 2.33 4.20 0.37 -3.00 115.11 119.47 1ynj h GLN 962 Ca -0.00 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1ynj h GLN 962 Cb 0.51 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.32 1ynj h GLN 962 CO 0.01 0.62 -0.24 -0.07 -0.67 0.00 0.00 178.83 178.48 1ynj h LEU 963 N 0.01 -0.59 -0.42 1.46 3.38 0.08 -2.84 115.31 116.39 1ynj h LEU 963 Ca -0.30 0.03 0.08 0.00 0.09 0.00 0.00 57.88 57.78 1ynj h LEU 963 Cb 2.01 0.17 -0.07 0.00 0.09 0.00 0.00 40.66 42.86 1ynj h LEU 963 CO 0.08 -0.39 -0.01 0.50 0.09 0.00 0.00 178.44 178.72 1ynj h LYS 964 N -0.61 0.10 -0.80 1.13 3.64 -1.55 0.16 116.57 118.63 1ynj h LYS 964 Ca -0.05 -0.01 0.17 0.00 -1.27 0.00 0.00 60.65 59.49 1ynj h LYS 964 Cb 0.50 -0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 32.14 1ynj h LYS 964 CO 0.06 0.07 -0.17 -1.91 -2.27 0.00 0.00 179.45 175.22 1ynj n GLU 965 N -5.21 -0.07 -0.00 1.90 4.07 -1.13 -0.48 120.64 119.72 1ynj n GLU 965 Ca 0.03 1.24 -0.17 0.00 -0.06 0.00 0.00 57.16 58.21 1ynj n GLU 965 Cb 0.22 -1.87 -0.13 0.00 -0.06 0.00 0.00 31.44 29.61 1ynj n GLU 965 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1ynj h LEU 966 N 0.00 0.33 -1.66 4.31 4.07 -0.52 -2.86 115.31 118.98 1ynj h LEU 966 Ca 0.40 -0.86 0.08 0.00 0.08 0.00 0.00 57.88 57.58 1ynj h LEU 966 Cb 0.64 -0.10 -0.03 0.00 1.08 0.00 0.00 40.66 42.25 1ynj h LEU 966 CO -0.81 1.16 0.36 0.15 -1.08 0.00 0.00 178.44 178.22 1ynj h PHE 967 N -0.45 0.42 -0.22 1.13 3.57 0.67 0.45 116.94 122.49 1ynj h PHE 967 Ca -0.07 0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.29 1ynj h PHE 967 Cb 1.27 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.87 1ynj h PHE 967 CO 0.19 0.21 -0.44 0.22 -2.23 0.00 0.00 178.31 176.26 1ynj h ASP 968 N 0.40 0.78 0.15 0.41 3.58 -0.78 -2.09 116.42 118.87 1ynj h ASP 968 Ca 0.24 -0.55 0.00 0.00 0.42 0.00 0.00 57.03 57.15 1ynj h ASP 968 Cb 0.43 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.26 1ynj h ASP 968 CO -0.06 1.18 0.00 0.18 -2.88 0.00 0.00 179.24 177.66 1ynj n LEU 969 N -4.18 0.00 0.00 2.28 4.32 -0.26 -4.79 117.00 114.38 1ynj n LEU 969 Ca -0.05 0.19 0.00 0.00 -0.02 0.00 0.00 56.01 56.12 1ynj n LEU 969 Cb 0.56 -0.19 0.00 0.00 -1.62 0.00 0.00 43.42 42.18 1ynj n LEU 969 CO 0.47 -0.11 0.00 0.61 -1.22 0.00 0.00 177.39 177.14 1ynj n GLY 970 N -0.22 0.73 3.91 -0.72 0.00 -0.02 -5.05 105.19 103.83 1ynj n GLY 970 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 1ynj n GLY 970 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ynj s LYS 971 N -0.60 2.93 0.16 1.61 -0.14 -0.72 -3.53 119.74 119.46 1ynj s LYS 971 Ca 0.00 -1.14 -0.08 0.00 -1.36 0.00 0.00 55.97 53.40 1ynj s LYS 971 Cb 0.00 -2.64 -0.01 0.00 -1.68 0.00 0.00 37.83 33.50 1ynj s LYS 971 CO 0.00 0.12 0.25 0.54 -0.76 0.00 0.00 175.35 175.51 1ynj s VAL 972 N -2.22 0.07 -0.63 3.17 0.11 0.11 -2.93 120.40 118.08 1ynj s VAL 972 Ca 0.42 -1.47 -0.22 0.00 -2.93 0.00 0.00 61.98 57.77 1ynj s VAL 972 Cb -0.08 -1.88 0.07 0.00 -1.53 0.00 0.00 36.38 32.96 1ynj s VAL 972 CO 0.28 -0.31 0.93 -0.69 -3.33 0.00 0.00 175.10 171.98 1ynj s VAL 973 N -3.98 4.39 0.65 2.04 1.01 -1.26 -0.08 120.40 123.16 1ynj s VAL 973 Ca 0.18 -0.33 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 1ynj s VAL 973 Cb 0.04 -4.64 -0.01 0.00 0.00 0.00 0.00 36.38 31.78 1ynj s VAL 973 CO 0.01 -1.37 1.03 -0.76 0.00 0.00 0.00 175.10 174.01 1ynj s LEU 974 N 3.90 3.09 -0.08 3.92 1.43 -1.26 -4.52 118.68 125.16 1ynj s LEU 974 Ca 0.22 1.14 0.02 0.00 -1.03 0.00 0.00 54.13 54.48 1ynj s LEU 974 Cb -0.17 -4.03 0.02 0.00 0.03 0.00 0.00 46.19 42.04 1ynj s LEU 974 CO 0.11 -1.11 -0.12 -0.31 0.23 0.00 0.00 176.35 175.15 1ynj s TYR 975 N -3.21 1.61 -0.16 0.29 4.12 -1.01 -2.16 117.35 116.83 1ynj s TYR 975 Ca 0.56 -0.68 -0.29 0.00 0.02 0.00 0.00 57.07 56.68 1ynj s TYR 975 Cb -0.11 -1.20 -0.03 0.00 -1.52 0.00 0.00 41.96 39.11 1ynj s TYR 975 CO 0.51 -0.37 1.46 0.34 0.02 0.00 0.00 175.55 177.51 1ynj s ASP 976 N 0.92 6.71 0.19 2.29 -1.08 -0.96 -1.91 116.67 122.82 1ynj s ASP 976 Ca -0.09 1.79 -0.14 0.00 -0.52 0.00 0.00 52.55 53.59 1ynj s ASP 976 Cb -0.15 -2.54 0.19 0.00 -1.46 0.00 0.00 42.92 38.96 1ynj s ASP 976 CO 0.00 -0.95 1.69 1.23 0.52 0.00 0.00 175.17 177.66 1ynj h GLY 977 N 10.42 0.52 0.49 2.66 0.00 -1.76 -2.41 103.07 113.00 1ynj h GLY 977 Ca -0.32 0.05 0.11 0.00 0.00 0.00 0.00 47.33 47.17 1ynj h GLY 977 CO 0.98 -0.13 0.53 3.21 0.00 0.00 0.00 176.54 181.13 1ynj h ARG 978 N 0.13 0.84 -2.54 4.80 3.08 -1.84 -3.40 114.38 115.44 1ynj h ARG 978 Ca 0.25 -0.05 -0.34 0.00 0.07 0.00 0.00 59.98 59.91 1ynj h ARG 978 Cb 0.37 -0.19 -0.36 0.00 0.08 0.00 0.00 29.97 29.87 1ynj h ARG 978 CO -0.40 0.56 -0.64 -0.08 -1.07 0.00 0.00 179.97 178.34 1ynj s THR 979 N -6.00 -0.30 -0.12 2.04 -1.32 -0.91 -5.02 115.64 104.00 1ynj s THR 979 Ca -0.12 -0.17 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 1ynj s THR 979 Cb 0.21 -0.70 0.00 0.00 -1.51 0.00 0.00 72.50 70.49 1ynj s THR 979 CO 0.79 -0.25 0.25 0.61 -2.21 0.00 0.00 174.62 173.81 1ynj n GLY 980 N 5.31 -0.02 3.75 6.08 0.00 -1.18 -4.11 105.19 115.04 1ynj n GLY 980 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1ynj n GLY 980 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ynj s GLU 981 N -1.50 4.49 0.40 1.61 2.56 -1.26 -4.56 118.70 120.44 1ynj s GLU 981 Ca 0.00 1.98 -0.23 0.00 0.00 0.00 0.00 54.97 56.72 1ynj s GLU 981 Cb 0.00 -3.16 -0.10 0.00 2.00 0.00 0.00 34.13 32.87 1ynj s GLU 981 CO 0.00 -0.04 1.00 -1.25 -0.56 0.00 0.00 175.26 174.42 1ynj s PRO 982 N -1.12 4.23 -0.06 4.30 0.04 -1.26 -2.27 135.00 138.85 1ynj s PRO 982 Ca 0.49 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.61 1ynj s PRO 982 Cb -0.35 -2.47 -0.06 0.00 0.04 0.00 0.00 34.50 31.66 1ynj s PRO 982 CO 0.43 -0.06 1.68 -0.06 0.04 0.00 0.00 177.00 179.04 1ynj s PHE 983 N -1.80 1.92 -0.30 0.56 0.40 -0.92 -4.84 117.98 113.00 1ynj s PHE 983 Ca 0.58 0.16 -0.28 0.00 -0.60 0.00 0.00 56.93 56.79 1ynj s PHE 983 Cb -0.18 -3.95 -0.02 0.00 0.51 0.00 0.00 43.02 39.38 1ynj s PHE 983 CO 0.23 -3.95 1.84 -1.83 0.70 0.00 0.00 175.22 172.21 1ynj s GLU 984 N 4.13 3.37 0.00 0.44 -1.05 -1.26 -4.54 118.70 119.78 1ynj s GLU 984 Ca 0.75 1.56 0.00 0.00 -0.15 0.00 0.00 54.97 57.12 1ynj s GLU 984 Cb -0.34 -4.20 0.00 0.00 -0.44 0.00 0.00 34.13 29.15 1ynj s GLU 984 CO 0.30 -1.81 0.00 0.41 0.95 0.00 0.00 175.26 175.11 1ynj n GLY 985 N 5.38 -0.83 3.63 -3.83 0.00 -1.26 -5.06 105.19 103.21 1ynj n GLY 985 Ca 0.23 -1.12 -0.36 0.00 0.00 0.00 0.00 46.02 44.78 1ynj n GLY 985 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ynj n PRO 986 N 1.40 0.57 -5.20 1.61 -0.04 -1.26 -4.89 135.00 127.19 1ynj n PRO 986 Ca 0.00 0.25 -0.32 0.00 -0.04 0.00 0.00 63.50 63.39 1ynj n PRO 986 Cb 0.00 -2.25 -0.17 0.00 -0.04 0.00 0.00 33.50 31.04 1ynj n PRO 986 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ynj s ILE 987 N -1.77 2.02 -0.00 0.52 -1.09 0.88 -4.84 121.20 116.91 1ynj s ILE 987 Ca 0.74 -1.00 -0.30 0.00 -2.23 0.00 0.00 60.65 57.86 1ynj s ILE 987 Cb -0.35 -1.74 -0.05 0.00 -1.58 0.00 0.00 42.46 38.74 1ynj s ILE 987 CO 0.49 0.55 1.31 0.54 -1.23 0.00 0.00 174.94 176.60 1ynj s VAL 988 N 0.27 3.91 0.04 2.92 0.11 -1.26 0.09 120.40 126.48 1ynj s VAL 988 Ca -0.16 1.29 0.04 0.00 -2.93 0.00 0.00 61.98 60.22 1ynj s VAL 988 Cb -0.17 -3.83 -0.02 0.00 -1.53 0.00 0.00 36.38 30.83 1ynj s VAL 988 CO 0.08 0.02 -0.11 -0.69 -3.33 0.00 0.00 175.10 171.06 1ynj s VAL 989 N 2.10 0.89 -2.04 2.04 1.01 -1.23 -1.93 120.40 121.24 1ynj s VAL 989 Ca 0.61 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1ynj s VAL 989 Cb -0.29 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.25 1ynj s VAL 989 CO 0.25 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.87 1ynj n GLY 990 N 1.86 -1.71 3.65 4.51 0.00 -0.07 -4.68 105.19 108.75 1ynj n GLY 990 Ca -0.19 -1.10 -0.39 0.00 0.00 0.00 0.00 46.02 44.34 1ynj n GLY 990 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ynj s GLN 991 N -1.70 4.15 -0.08 1.61 -0.21 -1.25 0.73 119.66 122.90 1ynj s GLN 991 Ca 0.00 0.34 0.02 0.00 0.02 0.00 0.00 55.36 55.74 1ynj s GLN 991 Cb 0.00 -3.59 0.01 0.00 1.00 0.00 0.00 33.01 30.44 1ynj s GLN 991 CO 0.00 -0.19 -0.14 1.41 -2.12 0.00 0.00 175.29 174.25 1ynj s MET 992 N 1.78 1.93 0.07 2.91 1.75 -0.71 -4.46 119.30 122.58 1ynj s MET 992 Ca 0.22 -0.48 -0.31 0.00 -1.25 0.00 0.00 55.69 53.88 1ynj s MET 992 Cb -0.15 -1.62 -0.07 0.00 2.84 0.00 0.00 34.83 35.82 1ynj s MET 992 CO 0.09 -0.01 1.39 0.12 -0.65 0.00 0.00 175.02 175.96 1ynj s PHE 993 N 0.82 3.09 -0.00 4.11 2.19 -1.26 -3.17 117.98 123.75 1ynj s PHE 993 Ca -0.11 0.91 0.00 0.00 0.33 0.00 0.00 56.93 58.06 1ynj s PHE 993 Cb -0.15 -3.66 0.00 0.00 -1.31 0.00 0.00 43.02 37.90 1ynj s PHE 993 CO 0.02 -2.36 -0.01 0.42 1.83 0.00 0.00 175.22 175.12 1ynj s ILE 994 N 1.62 0.08 0.14 3.12 1.01 0.26 -4.42 121.20 123.00 1ynj s ILE 994 Ca 0.64 -0.02 0.05 0.00 0.00 0.00 0.00 60.65 61.33 1ynj s ILE 994 Cb -0.34 -0.09 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 1ynj s ILE 994 CO 0.29 0.04 0.07 -0.04 0.00 0.00 0.00 174.94 175.30 1ynj s MET 995 N 0.13 2.73 -0.23 2.79 -1.94 0.44 -1.06 119.30 122.16 1ynj s MET 995 Ca -0.01 -0.88 -0.09 0.00 -1.71 0.00 0.00 55.69 53.00 1ynj s MET 995 Cb -0.02 -2.58 -0.04 0.00 2.01 0.00 0.00 34.83 34.19 1ynj s MET 995 CO -0.00 0.50 0.13 0.21 -0.01 0.00 0.00 175.02 175.85 1ynj s LYS 996 N -2.78 3.98 0.61 2.03 2.20 -1.26 -1.13 119.74 123.38 1ynj s LYS 996 Ca 0.29 -0.32 -0.02 0.00 -0.36 0.00 0.00 55.97 55.56 1ynj s LYS 996 Cb -0.11 -3.44 0.04 0.00 -1.51 0.00 0.00 37.83 32.82 1ynj s LYS 996 CO 0.21 0.05 0.86 -0.51 -0.36 0.00 0.00 175.35 175.61 1ynj s LEU 997 N 1.03 3.11 0.47 5.43 1.43 -0.55 -1.12 118.68 128.49 1ynj s LEU 997 Ca 0.06 0.15 0.21 0.00 -1.03 0.00 0.00 54.13 53.53 1ynj s LEU 997 Cb -0.14 -2.95 1.22 0.00 0.03 0.00 0.00 46.19 44.35 1ynj s LEU 997 CO 0.04 -1.31 1.90 0.22 0.23 0.00 0.00 176.35 177.44 1ynj h TYR 998 N -0.17 0.32 -3.91 0.29 3.20 -1.31 -3.42 116.97 111.96 1ynj h TYR 998 Ca -0.43 0.01 -0.46 0.00 3.14 0.00 0.00 58.73 60.99 1ynj h TYR 998 Cb 1.30 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 1ynj h TYR 998 CO 0.36 0.10 0.30 -1.01 -1.64 0.00 0.00 178.16 176.26 1ynj s HIS 999 N -5.25 3.49 -0.15 -3.82 0.09 -1.26 -5.05 115.29 103.34 1ynj s HIS 999 Ca -0.07 1.61 -0.20 0.00 -0.00 0.00 0.00 55.06 56.40 1ynj s HIS 999 Cb 0.21 -2.82 0.05 0.00 -0.00 0.00 0.00 32.58 30.02 1ynj s HIS 999 CO 0.77 0.07 0.53 -1.64 -0.00 0.00 0.00 174.74 174.47 1ynj s MET 1000N -2.62 0.71 0.40 1.40 -1.94 -1.26 -4.28 119.30 111.72 1ynj s MET 1000Ca 0.55 0.53 0.14 0.00 -1.71 0.00 0.00 55.69 55.20 1ynj s MET 1000Cb -0.13 0.34 0.99 0.00 2.01 0.00 0.00 34.83 38.04 1ynj s MET 1000CO 0.18 -0.14 1.89 -0.39 -0.01 0.00 0.00 175.02 176.55 1ynj h VAL 1001N 3.99 0.77 -0.70 -6.03 -1.51 -1.89 -2.70 116.25 108.18 1ynj h VAL 1001Ca -0.28 -0.17 0.07 0.00 -1.23 0.00 0.00 66.70 65.09 1ynj h VAL 1001Cb 1.17 0.24 -0.10 0.00 -2.13 0.00 0.00 31.29 30.46 1ynj h VAL 1001CO 0.24 0.09 -0.57 -0.08 -1.23 0.00 0.00 177.57 176.02 1ynj h GLU 1002N 0.49 -0.19 0.00 5.19 4.57 -1.95 -1.87 114.58 120.81 1ynj h GLU 1002Ca 0.42 0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.54 1ynj h GLU 1002Cb 0.90 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.52 1ynj h GLU 1002CO -0.16 -0.13 -0.32 -0.44 -1.18 0.00 0.00 179.01 176.78 1ynj h ASP 1003N -0.20 0.00 -3.94 1.04 3.32 -1.89 -3.44 116.42 111.31 1ynj h ASP 1003Ca 0.12 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.02 1ynj h ASP 1003Cb 0.51 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.09 1ynj h ASP 1003CO -0.77 0.32 0.04 0.29 -1.72 0.00 0.00 179.24 177.41 1ynj n LYS 1004N -3.93 0.33 -1.55 3.56 4.76 -0.70 -4.99 118.16 115.65 1ynj n LYS 1004Ca -0.02 -0.90 -0.01 0.00 -2.87 0.00 0.00 58.31 54.52 1ynj n LYS 1004Cb 0.39 -0.23 -0.01 0.00 -1.84 0.00 0.00 35.03 33.34 1ynj n LYS 1004CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 1ynj n MET 1005N -1.63 -1.38 -3.72 1.97 0.00 -1.26 -4.90 117.12 106.19 1ynj n MET 1005Ca 0.06 1.38 -0.14 0.00 -0.00 0.00 0.00 57.70 59.00 1ynj n MET 1005Cb 0.20 -1.87 -0.09 0.00 0.00 0.00 0.00 33.22 31.46 1ynj n MET 1005CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 1ynj s HIS 1006N -0.17 -0.35 -0.20 1.12 3.76 -1.26 -5.05 115.29 113.13 1ynj s HIS 1006Ca -0.03 0.73 -0.09 0.00 -0.15 0.00 0.00 55.06 55.51 1ynj s HIS 1006Cb 0.00 0.16 0.08 0.00 1.11 0.00 0.00 32.58 33.93 1ynj s HIS 1006CO 0.09 -0.34 0.47 0.00 -0.85 0.00 0.00 174.74 174.11 1ynj s ALA 1007N -0.65 -1.27 0.12 -1.40 0.00 -1.26 -5.06 121.76 112.24 1ynj s ALA 1007Ca -0.07 1.70 0.09 0.00 0.00 0.00 0.00 51.96 53.68 1ynj s ALA 1007Cb -0.04 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 1ynj s ALA 1007CO 0.03 -0.51 -0.19 0.50 0.00 0.00 0.00 175.76 175.59 1ynj s ARG 1008N 2.00 1.74 -0.19 0.00 3.52 -1.26 -4.78 118.95 119.98 1ynj s ARG 1008Ca -0.06 -1.21 -0.08 0.00 -0.13 0.00 0.00 55.73 54.25 1ynj s ARG 1008Cb -0.10 -2.09 -0.09 0.00 -1.56 0.00 0.00 34.95 31.12 1ynj s ARG 1008CO -0.14 0.47 -0.23 -1.13 -0.81 0.00 0.00 175.30 173.46 1ynj n SER 1009N 0.77 1.49 -2.64 -2.12 3.41 -1.26 -5.03 113.62 108.25 1ynj n SER 1009Ca -0.16 0.19 -0.08 0.00 -0.26 0.00 0.00 58.87 58.56 1ynj n SER 1009Cb 0.53 -0.51 0.03 0.00 -0.26 0.00 0.00 64.21 63.99 1ynj n SER 1009CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1ynj n THR 1010N -3.73 0.00 0.00 6.66 -2.24 -1.26 -5.15 114.28 108.56 1ynj n THR 1010Ca -0.36 -0.92 0.00 0.00 -2.27 0.00 0.00 64.05 60.50 1ynj n THR 1010Cb 0.77 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 1ynj n THR 1010CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ynj n GLY 1011N -0.49 0.45 3.59 3.38 0.00 -1.26 -4.87 105.19 105.99 1ynj n GLY 1011Ca -0.08 -1.04 -0.41 0.00 0.00 0.00 0.00 46.02 44.49 1ynj n GLY 1011CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ynj s PRO 1012N 0.00 2.93 -0.23 1.61 0.02 -1.26 -4.94 135.00 133.12 1ynj s PRO 1012Ca 0.00 1.78 -0.11 0.00 0.02 0.00 0.00 61.00 62.69 1ynj s PRO 1012Cb 0.00 -4.40 -0.05 0.00 0.02 0.00 0.00 34.50 30.08 1ynj s PRO 1012CO 0.00 -2.34 0.19 0.71 -0.33 0.00 0.00 177.00 175.23 1ynj s TYR 1013N 8.96 3.33 0.49 6.54 4.12 -1.26 -2.36 117.35 137.17 1ynj s TYR 1013Ca 0.96 0.28 -0.22 0.00 0.02 0.00 0.00 57.07 58.11 1ynj s TYR 1013Cb -0.28 -2.30 -0.08 0.00 -1.52 0.00 0.00 41.96 37.78 1ynj s TYR 1013CO 0.33 0.06 1.06 0.45 0.02 0.00 0.00 175.55 177.47 1ynj n SER 1014N 4.29 1.41 0.11 2.29 2.88 -1.20 -4.90 113.62 118.50 1ynj n SER 1014Ca -0.14 0.96 0.12 0.00 -1.33 0.00 0.00 58.87 58.48 1ynj n SER 1014Cb 0.52 -1.41 0.06 0.00 -0.75 0.00 0.00 64.21 62.64 1ynj n SER 1014CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1ynj h LEU 1015N 1.27 0.00 0.08 2.46 4.07 -1.96 -2.36 115.31 118.87 1ynj h LEU 1015Ca -0.47 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 57.43 1ynj h LEU 1015Cb 1.34 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.08 1ynj h LEU 1015CO 0.55 0.03 -0.04 0.40 -1.08 0.00 0.00 178.44 178.30 1ynj h ILE 1016N 0.00 0.00 0.00 1.22 2.04 -1.98 -3.41 117.51 115.38 1ynj h ILE 1016Ca 0.00 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.98 1ynj h ILE 1016Cb 0.93 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1ynj h ILE 1016CO 0.00 0.00 -1.42 0.35 0.00 0.00 0.00 178.15 177.08 1ynj n THR 1017N -4.74 0.05 -1.00 -0.27 -2.24 -1.26 -4.98 114.28 99.83 1ynj n THR 1017Ca -0.01 -0.27 -0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1ynj n THR 1017Cb 0.04 0.40 -0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1ynj n THR 1017CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1ynj n GLN 1018N -1.93 -1.07 -4.21 -0.78 -0.06 -0.89 -4.82 117.38 103.62 1ynj n GLN 1018Ca 0.00 0.27 -0.30 0.00 -2.00 0.00 0.00 57.00 54.98 1ynj n GLN 1018Cb 0.46 -4.07 -0.10 0.00 -4.06 0.00 0.00 30.24 22.47 1ynj n GLN 1018CO 0.00 0.00 0.00 1.14 -0.20 0.00 0.00 177.06 178.00 1ynj s GLN 1019N -1.08 2.17 0.18 3.69 -2.07 -1.26 -3.68 119.66 117.61 1ynj s GLN 1019Ca 0.00 -1.01 -0.32 0.00 -1.82 0.00 0.00 55.36 52.21 1ynj s GLN 1019Cb 0.00 -2.33 -0.11 0.00 -1.09 0.00 0.00 33.01 29.48 1ynj s GLN 1019CO 0.00 0.51 1.73 -1.25 -1.32 0.00 0.00 175.29 174.96 1ynj s PRO 1020N -2.26 4.14 -0.30 9.60 0.04 -1.26 -3.23 135.00 141.73 1ynj s PRO 1020Ca 0.22 2.57 -0.08 0.00 0.04 0.00 0.00 61.00 63.75 1ynj s PRO 1020Cb -0.11 -3.20 0.18 0.00 0.04 0.00 0.00 34.50 31.41 1ynj s PRO 1020CO 0.14 -0.76 0.84 -0.51 0.04 0.00 0.00 177.00 176.76 1ynj s LEU 1021N 1.53 -0.88 0.00 -3.56 1.43 -0.99 -4.82 118.68 111.39 1ynj s LEU 1021Ca 0.76 0.63 0.00 0.00 -1.03 0.00 0.00 54.13 54.49 1ynj s LEU 1021Cb -0.48 1.77 0.00 0.00 0.03 0.00 0.00 46.19 47.51 1ynj s LEU 1021CO 0.33 -0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.35 1ynj n GLY 1022N 5.41 -0.21 3.15 -3.19 0.00 -1.26 -4.52 105.19 104.56 1ynj n GLY 1022Ca -0.05 -1.70 0.05 0.00 0.00 0.00 0.00 46.02 44.32 1ynj n GLY 1022CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ynj s GLY 1023N -2.15 -1.00 -0.02 -0.02 0.00 -1.26 -4.47 107.32 98.40 1ynj s GLY 1023Ca 0.00 1.73 -0.23 0.00 0.00 0.00 0.00 44.72 46.23 1ynj s GLY 1023CO 0.00 3.81 1.10 0.50 0.00 0.00 0.00 173.10 178.51 1ynj h LYS 1024N 7.75 0.25 0.00 2.90 6.56 -1.98 -3.39 116.57 128.66 1ynj h LYS 1024Ca -0.08 -0.23 0.00 0.00 -1.06 0.00 0.00 60.65 59.28 1ynj h LYS 1024Cb 1.18 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.90 1ynj h LYS 1024CO 0.05 0.92 0.00 0.00 -2.06 0.00 0.00 179.45 178.36 1ynj n ALA 1025N -2.52 0.00 -2.19 3.86 0.00 -1.26 -4.61 120.51 113.79 1ynj n ALA 1025Ca -0.09 -0.03 -0.32 0.00 0.00 0.00 0.00 53.44 53.00 1ynj n ALA 1025Cb 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 1ynj n ALA 1025CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ynj s GLN 1026N -0.18 3.93 0.00 0.00 -0.21 -1.26 -4.61 119.66 117.32 1ynj s GLN 1026Ca 0.00 0.57 0.00 0.00 0.02 0.00 0.00 55.36 55.95 1ynj s GLN 1026Cb 0.00 -2.45 0.00 0.00 1.00 0.00 0.00 33.01 31.56 1ynj s GLN 1026CO 0.00 0.14 0.00 1.97 -2.12 0.00 0.00 175.29 175.28 1ynj n PHE 1027N -0.54 -1.24 -0.93 0.91 -0.00 -1.26 -4.16 117.46 110.24 1ynj n PHE 1027Ca 0.03 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.60 1ynj n PHE 1027Cb 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 39.98 1ynj n PHE 1027CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ynj n GLY 1028N 5.00 -1.24 0.00 4.97 0.00 -1.26 -4.61 105.19 108.05 1ynj n GLY 1028Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1ynj n GLY 1028CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ynj n GLY 1029N -2.92 2.69 3.89 -0.02 0.00 -1.26 -4.72 105.19 102.84 1ynj n GLY 1029Ca 0.00 0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 1ynj n GLY 1029CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ynj s GLN 1030N -0.19 3.59 0.06 1.61 2.00 -1.26 -5.00 119.66 120.46 1ynj s GLN 1030Ca 0.00 -0.12 -0.30 0.00 -2.00 0.00 0.00 55.36 52.94 1ynj s GLN 1030Cb 0.00 -2.99 -0.05 0.00 0.80 0.00 0.00 33.01 30.77 1ynj s GLN 1030CO 0.00 0.57 1.11 -0.98 -0.50 0.00 0.00 175.29 175.49 1ynj s ARG 1031N -2.19 4.51 -0.82 1.67 1.04 -1.26 -5.01 118.95 116.89 1ynj s ARG 1031Ca 0.34 1.64 -0.15 0.00 -1.04 0.00 0.00 55.73 56.51 1ynj s ARG 1031Cb -0.13 -3.37 0.19 0.00 -2.04 0.00 0.00 34.95 29.60 1ynj s ARG 1031CO 0.21 -0.13 0.82 0.12 -0.04 0.00 0.00 175.30 176.28 1ynj s PHE 1032N 0.83 3.59 0.96 5.89 5.36 -1.26 -5.06 117.98 128.29 1ynj s PHE 1032Ca 0.55 -1.81 -0.11 0.00 -0.96 0.00 0.00 56.93 54.60 1ynj s PHE 1032Cb -0.26 -3.91 0.17 0.00 -0.34 0.00 0.00 43.02 38.68 1ynj s PHE 1032CO 0.30 -1.10 1.10 0.20 -1.46 0.00 0.00 175.22 174.26 1ynj s GLY 1033N 2.56 1.63 0.59 13.12 0.00 -1.26 -4.77 107.32 119.20 1ynj s GLY 1033Ca 0.20 0.21 0.32 0.00 0.00 0.00 0.00 44.72 45.45 1ynj s GLY 1033CO -0.08 0.72 2.25 1.05 0.00 0.00 0.00 173.10 177.04 1ynj h GLU 1034N -1.93 0.00 -0.30 2.90 4.11 -1.99 -0.32 114.58 117.05 1ynj h GLU 1034Ca -0.50 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 58.81 1ynj h GLU 1034Cb 1.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1ynj h GLU 1034CO 0.48 0.02 -0.34 0.52 0.07 0.00 0.00 179.01 179.76 1ynj h MET 1035N 0.00 0.66 0.05 1.06 2.86 -2.00 -1.74 114.93 115.81 1ynj h MET 1035Ca -0.00 -0.31 -0.23 0.00 -2.06 0.00 0.00 59.70 57.10 1ynj h MET 1035Cb 0.06 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1ynj h MET 1035CO 0.00 0.90 -1.09 0.93 1.06 0.00 0.00 176.91 178.71 1ynj h GLU 1036N 0.55 0.10 -0.56 1.72 3.07 -1.49 -2.74 114.58 115.25 1ynj h GLU 1036Ca 0.06 -0.18 0.01 0.00 -0.50 0.00 0.00 59.36 58.75 1ynj h GLU 1036Cb 0.84 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.79 1ynj h GLU 1036CO 0.07 1.08 0.36 0.28 -1.40 0.00 0.00 179.01 179.41 1ynj h VAL 1037N 0.03 1.12 0.11 3.13 2.07 -0.81 -1.92 116.25 119.98 1ynj h VAL 1037Ca -0.06 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.22 1ynj h VAL 1037Cb 1.85 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 1ynj h VAL 1037CO 0.16 0.13 -0.49 -0.50 0.02 0.00 0.00 177.57 176.89 1ynj h TRP 1038N 0.73 -1.43 -0.94 1.57 6.55 -1.29 -1.28 115.95 119.86 1ynj h TRP 1038Ca 0.21 0.04 0.28 0.00 0.95 0.00 0.00 58.89 60.37 1ynj h TRP 1038Cb -0.06 0.61 -0.16 0.00 -0.86 0.00 0.00 29.16 28.69 1ynj h TRP 1038CO -0.04 -0.56 0.25 0.00 -1.05 0.00 0.00 178.44 177.04 1ynj h ALA 1039N -0.61 1.43 -0.04 1.49 0.00 -1.13 1.09 119.26 121.49 1ynj h ALA 1039Ca -0.01 0.26 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 1ynj h ALA 1039Cb 0.71 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1ynj h ALA 1039CO -0.27 -0.58 -0.65 -0.07 0.00 0.00 0.00 179.25 177.68 1ynj h LEU 1040N 0.13 0.19 -0.75 0.00 3.38 -0.97 0.11 115.31 117.40 1ynj h LEU 1040Ca 0.62 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 58.34 1ynj h LEU 1040Cb 1.36 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1ynj h LEU 1040CO -0.74 0.79 -0.50 -0.33 0.09 0.00 0.00 178.44 177.75 1ynj h GLU 1041N 0.12 0.32 0.23 1.13 5.08 0.17 -2.65 114.58 118.98 1ynj h GLU 1041Ca -0.01 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1ynj h GLU 1041Cb 1.17 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1ynj h GLU 1041CO 0.10 0.75 -0.11 0.00 -1.00 0.00 0.00 179.01 178.74 1ynj h ALA 1042N 1.22 -0.31 -2.07 3.43 0.00 0.17 -3.40 119.26 118.30 1ynj h ALA 1042Ca 0.01 -0.20 -0.48 0.00 0.00 0.00 0.00 54.91 54.24 1ynj h ALA 1042Cb 0.96 0.12 0.22 0.00 0.00 0.00 0.00 17.79 19.09 1ynj h ALA 1042CO 0.08 -0.41 -0.30 0.66 0.00 0.00 0.00 179.25 179.28 1ynj n TYR 1043N -5.01 -0.82 -0.11 0.00 0.53 0.30 -4.90 117.16 107.15 1ynj n TYR 1043Ca -0.08 0.12 0.01 0.00 -1.02 0.00 0.00 57.90 56.93 1ynj n TYR 1043Cb 0.26 -1.76 0.21 0.00 -1.03 0.00 0.00 39.34 37.02 1ynj n TYR 1043CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1ynj n GLY 1044N 1.15 2.50 2.90 2.72 0.00 -1.26 -4.74 105.19 108.47 1ynj n GLY 1044Ca 0.05 -0.54 -0.33 0.00 0.00 0.00 0.00 46.02 45.21 1ynj n GLY 1044CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynj n ALA 1045N 0.24 3.71 0.02 4.61 0.00 -1.00 -4.78 120.51 123.31 1ynj n ALA 1045Ca 0.18 -2.61 -0.07 0.00 0.00 0.00 0.00 53.44 50.95 1ynj n ALA 1045Cb 0.85 -3.33 -0.04 0.00 0.00 0.00 0.00 19.45 16.93 1ynj n ALA 1045CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ynj h ALA 1046N 7.31 -0.68 -0.61 0.00 0.00 -1.89 -0.89 119.26 122.51 1ynj h ALA 1046Ca 0.43 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.26 1ynj h ALA 1046Cb 0.43 0.71 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1ynj h ALA 1046CO 1.71 -0.75 0.19 0.45 0.00 0.00 0.00 179.25 180.85 1ynj h HIS 1047N -0.28 0.94 -0.76 0.00 3.86 -1.98 -1.11 115.15 115.82 1ynj h HIS 1047Ca 0.01 -0.08 -0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1ynj h HIS 1047Cb 0.30 -0.28 -0.04 0.00 1.06 0.00 0.00 27.41 28.45 1ynj h HIS 1047CO -0.44 0.76 0.46 1.15 0.86 0.00 0.00 177.93 180.72 1ynj h THR 1048N 0.89 1.22 0.10 2.45 2.02 -1.90 0.93 112.91 118.61 1ynj h THR 1048Ca 0.20 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 1ynj h THR 1048Cb 0.26 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1ynj h THR 1048CO -0.01 0.22 -0.05 0.25 0.37 0.00 0.00 175.52 176.31 1ynj h LEU 1049N 1.04 -0.11 -1.62 2.58 5.85 -0.72 -2.63 115.31 119.71 1ynj h LEU 1049Ca 0.27 -0.23 0.09 0.00 0.84 0.00 0.00 57.88 58.85 1ynj h LEU 1049Cb -0.04 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1ynj h LEU 1049CO -0.05 0.18 0.39 -0.61 -0.34 0.00 0.00 178.44 178.01 1ynj h GLN 1050N -0.40 0.43 0.06 1.25 4.15 -0.57 -1.54 115.11 118.48 1ynj h GLN 1050Ca -0.01 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.40 1ynj h GLN 1050Cb 0.34 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.90 1ynj h GLN 1050CO 0.02 0.28 -0.21 0.93 -1.93 0.00 0.00 178.83 177.92 1ynj h GLU 1051N 0.44 -0.36 0.00 1.69 5.08 0.11 -0.87 114.58 120.67 1ynj h GLU 1051Ca 0.26 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1ynj h GLU 1051Cb 0.46 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1ynj h GLU 1051CO -0.07 -0.24 0.00 1.98 -1.00 0.00 0.00 179.01 179.68 1ynj h MET 1052N -0.37 0.00 0.00 2.33 4.05 -0.94 -2.55 114.93 117.45 1ynj h MET 1052Ca 0.04 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 1ynj h MET 1052Cb 0.42 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.22 1ynj h MET 1052CO -0.15 0.00 -1.67 1.28 0.23 0.00 0.00 176.91 176.60 1ynj n LEU 1053N -2.57 0.22 0.00 3.39 4.32 -0.84 -4.77 117.00 116.75 1ynj n LEU 1053Ca -0.02 -0.12 0.00 0.00 -0.02 0.00 0.00 56.01 55.86 1ynj n LEU 1053Cb 0.08 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.88 1ynj n LEU 1053CO 0.15 0.05 0.00 0.35 -1.22 0.00 0.00 177.39 176.72 1ynj n THR 1054N -2.01 0.00 0.23 -5.08 -2.24 -0.39 -4.76 114.28 100.03 1ynj n THR 1054Ca -0.02 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.78 1ynj n THR 1054Cb 0.46 -0.09 0.12 0.00 -2.10 0.00 0.00 70.33 68.72 1ynj n THR 1054CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1ynj n ILE 1055N -0.20 0.99 -1.25 2.28 -5.35 -1.15 -1.25 119.36 113.42 1ynj n ILE 1055Ca 0.00 0.25 0.07 0.00 -0.27 0.00 0.00 62.75 62.80 1ynj n ILE 1055Cb 0.00 -1.17 0.18 0.00 -1.74 0.00 0.00 39.64 36.92 1ynj n ILE 1055CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1ynj n LYS 1056N -1.29 1.67 0.00 6.28 5.02 -1.18 -3.74 118.16 124.92 1ynj n LYS 1056Ca 0.02 -2.89 0.00 0.00 -2.02 0.00 0.00 58.31 53.43 1ynj n LYS 1056Cb 0.04 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 33.43 1ynj n LYS 1056CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ynj n SER 1057N -1.18 0.00 0.04 4.39 2.88 -0.38 -4.73 113.62 114.63 1ynj n SER 1057Ca 0.20 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.64 1ynj n SER 1057Cb 0.74 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.23 1ynj n SER 1057CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1ynj h ASP 1058N 0.00 0.53 -0.19 -3.46 3.45 -1.63 -3.39 116.42 111.73 1ynj h ASP 1058Ca 0.00 -0.33 -0.06 0.00 0.43 0.00 0.00 57.03 57.06 1ynj h ASP 1058Cb 0.00 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 1ynj h ASP 1058CO 0.00 1.06 0.20 -0.62 -1.57 0.00 0.00 179.24 178.31 1ynj s ASP 1059N -6.97 3.70 0.09 6.45 -1.08 -1.00 -4.72 116.67 113.14 1ynj s ASP 1059Ca -0.06 -0.97 -0.26 0.00 -0.52 0.00 0.00 52.55 50.74 1ynj s ASP 1059Cb 0.11 -2.59 -0.09 0.00 -1.46 0.00 0.00 42.92 38.88 1ynj s ASP 1059CO 0.84 -4.44 1.42 0.40 0.52 0.00 0.00 175.17 173.91 1ynj h ILE 1060N 6.74 0.00 -0.94 4.11 5.03 -1.89 0.93 117.51 131.49 1ynj h ILE 1060Ca 0.04 0.00 0.26 0.00 -0.12 0.00 0.00 64.86 65.04 1ynj h ILE 1060Cb 0.99 0.00 -0.17 0.00 -3.03 0.00 0.00 36.82 34.61 1ynj h ILE 1060CO 1.04 0.00 0.09 -0.33 -0.68 0.00 0.00 178.15 178.27 1ynj h GLU 1061N -0.39 0.05 0.18 2.37 5.08 -1.99 -1.97 114.58 117.91 1ynj h GLU 1061Ca 0.04 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1ynj h GLU 1061Cb 0.50 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ynj h GLU 1061CO -0.39 0.03 -0.09 0.78 -1.00 0.00 0.00 179.01 178.35 1ynj h GLY 1062N 0.05 -0.26 0.17 -3.84 0.00 -1.29 -1.98 103.07 95.94 1ynj h GLY 1062Ca 0.58 0.09 0.08 0.00 0.00 0.00 0.00 47.33 48.09 1ynj h GLY 1062CO -0.84 -0.09 -0.13 0.07 0.00 0.00 0.00 176.54 175.55 1ynj h ARG 1063N -0.95 -0.04 -0.29 4.80 0.11 -0.80 0.19 114.38 117.40 1ynj h ARG 1063Ca -0.02 0.00 0.06 0.00 0.10 0.00 0.00 59.98 60.12 1ynj h ARG 1063Cb 0.46 0.01 -0.06 0.00 1.11 0.00 0.00 29.97 31.49 1ynj h ARG 1063CO 0.04 -0.03 -0.09 -0.91 0.10 0.00 0.00 179.97 179.08 1ynj h ASN 1064N -0.04 -0.32 -0.58 0.08 -0.26 -1.41 0.41 115.58 113.45 1ynj h ASN 1064Ca 0.19 0.09 0.06 0.00 -0.56 0.00 0.00 56.30 56.08 1ynj h ASN 1064Cb 0.33 0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 37.75 1ynj h ASN 1064CO -0.42 -0.12 0.38 0.00 -1.06 0.00 0.00 177.43 176.22 1ynj h ALA 1065N 1.24 1.81 0.11 -0.83 0.00 -0.45 -0.24 119.26 120.90 1ynj h ALA 1065Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1ynj h ALA 1065Cb 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ynj h ALA 1065CO -0.31 0.10 -0.05 0.00 0.00 0.00 0.00 179.25 178.99 1ynj h ALA 1066N 1.68 -0.15 0.00 0.00 0.00 0.19 -2.62 119.26 118.36 1ynj h ALA 1066Ca 0.25 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ynj h ALA 1066Cb 0.25 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ynj h ALA 1066CO -0.07 -0.26 -0.18 -0.92 0.00 0.00 0.00 179.25 177.82 1ynj h TYR 1067N -0.79 0.00 0.00 0.00 3.20 -0.19 -0.45 116.97 118.74 1ynj h TYR 1067Ca -0.02 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1ynj h TYR 1067Cb 0.56 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.83 1ynj h TYR 1067CO 0.10 0.18 0.00 0.37 -1.64 0.00 0.00 178.16 177.17 1ynj h GLN 1068N 0.00 0.00 0.06 1.82 5.75 -1.04 -2.97 115.11 118.73 1ynj h GLN 1068Ca -0.00 0.00 -0.31 0.00 -0.15 0.00 0.00 58.65 58.19 1ynj h GLN 1068Cb 0.36 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 1ynj h GLN 1068CO 0.02 0.00 -1.74 0.00 -2.65 0.00 0.00 178.83 174.46 1ynj h ALA 1069N 2.23 0.57 -0.05 3.38 0.00 -0.74 -3.33 119.26 121.33 1ynj h ALA 1069Ca 0.00 -1.37 -0.19 0.00 0.00 0.00 0.00 54.91 53.36 1ynj h ALA 1069Cb 0.67 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1ynj h ALA 1069CO 0.00 1.42 -0.76 0.82 0.00 0.00 0.00 179.25 180.73 1ynj h ILE 1070N 0.03 1.40 0.00 0.00 2.04 -1.21 0.14 117.51 119.92 1ynj h ILE 1070Ca -0.31 -2.24 -0.01 0.00 1.00 0.00 0.00 64.86 63.30 1ynj h ILE 1070Cb 2.01 2.20 -0.00 0.00 -0.74 0.00 0.00 36.82 40.29 1ynj h ILE 1070CO 0.10 0.67 -0.04 0.40 0.00 0.00 0.00 178.15 179.27 1ynj h ILE 1071N 0.22 0.61 -0.15 -0.67 2.04 -1.68 -3.06 117.51 114.82 1ynj h ILE 1071Ca -0.03 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1ynj h ILE 1071Cb 1.34 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1ynj h ILE 1071CO 0.13 0.04 0.00 1.17 0.00 0.00 0.00 178.15 179.49 1ynj n LYS 1072N -3.87 2.89 -3.35 2.37 4.81 -0.93 -4.99 118.16 115.09 1ynj n LYS 1072Ca -0.03 -1.80 -0.20 0.00 -0.87 0.00 0.00 58.31 55.42 1ynj n LYS 1072Cb 0.13 -1.15 0.06 0.00 0.02 0.00 0.00 35.03 34.09 1ynj n LYS 1072CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ynj n GLY 1073N -0.13 -0.29 3.89 3.14 0.00 -0.76 -5.03 105.19 106.02 1ynj n GLY 1073Ca 0.06 0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 1ynj n GLY 1073CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ynj s GLU 1074N -6.02 2.68 0.47 1.61 2.02 0.43 -5.04 118.70 114.85 1ynj s GLU 1074Ca 0.46 -1.37 0.25 0.00 0.02 0.00 0.00 54.97 54.33 1ynj s GLU 1074Cb -0.20 -2.49 1.11 0.00 0.10 0.00 0.00 34.13 32.65 1ynj s GLU 1074CO 0.57 -0.08 1.91 0.38 0.02 0.00 0.00 175.26 178.06 1ynj h ASP 1075N 1.05 0.00 0.00 -0.19 2.03 -1.96 -3.41 116.42 113.94 1ynj h ASP 1075Ca -0.43 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.87 1ynj h ASP 1075Cb 1.26 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 1ynj h ASP 1075CO 0.56 0.19 0.00 0.52 -1.03 0.00 0.00 179.24 179.48 1ynj n VAL 1076N -3.48 0.00 0.00 4.15 0.31 -1.26 -5.03 118.33 113.02 1ynj n VAL 1076Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1ynj n VAL 1076Cb 0.36 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.29 1ynj n VAL 1076CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1ynj n PRO 1077N 0.00 0.00 -3.62 5.55 -0.04 -1.26 -4.50 135.00 131.13 1ynj n PRO 1077Ca 0.00 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.18 1ynj n PRO 1077Cb 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 33.50 1ynj n PRO 1077CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ynj n GLU 1078N 0.00 -1.31 -2.12 0.54 1.02 -1.26 -4.93 120.64 112.59 1ynj n GLU 1078Ca 0.00 0.56 -0.42 0.00 -0.02 0.00 0.00 57.16 57.27 1ynj n GLU 1078Cb 0.00 -4.25 -0.03 0.00 -0.02 0.00 0.00 31.44 27.15 1ynj n GLU 1078CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1ynj s PRO 1079N -5.65 4.21 0.03 3.49 0.04 -1.26 -4.92 135.00 130.95 1ynj s PRO 1079Ca 0.43 2.06 -0.13 0.00 0.04 0.00 0.00 61.00 63.40 1ynj s PRO 1079Cb -0.15 -3.83 -0.07 0.00 0.04 0.00 0.00 34.50 30.50 1ynj s PRO 1079CO 0.85 -0.76 1.21 0.66 0.04 0.00 0.00 177.00 179.00 1ynj h SER 1080N 8.84 -0.50 -3.28 6.66 4.64 -1.98 -3.43 113.55 124.50 1ynj h SER 1080Ca -0.37 0.04 -0.21 0.00 -0.47 0.00 0.00 61.79 60.78 1ynj h SER 1080Cb 1.17 0.16 -0.31 0.00 -0.31 0.00 0.00 62.40 63.11 1ynj h SER 1080CO 0.94 -0.26 -0.51 -0.69 -0.87 0.00 0.00 176.83 175.44 1ynj s VAL 1081N -4.06 -0.10 -0.30 0.95 1.01 -1.26 -5.10 120.40 111.53 1ynj s VAL 1081Ca -0.07 0.18 -0.40 0.00 0.00 0.00 0.00 61.98 61.69 1ynj s VAL 1081Cb 0.01 -0.37 -0.15 0.00 0.00 0.00 0.00 36.38 35.87 1ynj s VAL 1081CO 0.22 0.07 1.80 -2.65 0.00 0.00 0.00 175.10 174.55 1ynj n PRO 1082N 4.44 1.07 -0.26 2.72 -0.01 -1.26 -4.80 135.00 136.89 1ynj n PRO 1082Ca -0.22 0.38 0.07 0.00 -0.01 0.00 0.00 63.50 63.72 1ynj n PRO 1082Cb 0.52 -2.10 0.20 0.00 -0.01 0.00 0.00 33.50 32.11 1ynj n PRO 1082CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 175.50 176.42 1ynj h GLU 1083N 7.74 0.35 -0.91 -0.52 4.39 -1.95 -0.40 114.58 123.27 1ynj h GLU 1083Ca -0.43 -0.02 0.21 0.00 0.34 0.00 0.00 59.36 59.46 1ynj h GLU 1083Cb 1.32 -0.08 -0.17 0.00 -0.10 0.00 0.00 28.75 29.72 1ynj h GLU 1083CO 0.97 0.23 -0.12 0.43 -1.16 0.00 0.00 179.01 179.37 1ynj n SER 1084N -5.08 -0.23 0.37 1.42 7.64 -1.26 -0.81 113.62 115.68 1ynj n SER 1084Ca 0.15 1.56 -0.15 0.00 1.01 0.00 0.00 58.87 61.44 1ynj n SER 1084Cb 0.47 -0.51 -0.07 0.00 -1.01 0.00 0.00 64.21 63.09 1ynj n SER 1084CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1ynj h PHE 1085N 0.00 -0.90 -0.39 1.43 3.57 -1.42 -1.70 116.94 117.53 1ynj h PHE 1085Ca 0.49 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 62.01 1ynj h PHE 1085Cb 0.88 0.30 -0.07 0.00 2.79 0.00 0.00 35.95 39.85 1ynj h PHE 1085CO -0.60 -0.56 -0.41 0.00 -2.23 0.00 0.00 178.31 174.52 1ynj h ARG 1086N -0.96 -0.22 -0.70 1.11 3.08 -1.23 -0.89 114.38 114.57 1ynj h ARG 1086Ca -0.10 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.03 1ynj h ARG 1086Cb 0.74 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.75 1ynj h ARG 1086CO 0.15 -0.15 -0.41 0.28 -1.07 0.00 0.00 179.97 178.77 1ynj n VAL 1087N -4.64 -0.48 0.03 2.04 0.31 0.01 -1.31 118.33 114.29 1ynj n VAL 1087Ca -0.02 2.01 -0.11 0.00 -0.01 0.00 0.00 64.34 66.21 1ynj n VAL 1087Cb 0.24 -2.51 -0.04 0.00 -0.91 0.00 0.00 33.84 30.61 1ynj n VAL 1087CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1ynj h LEU 1088N 0.00 -0.80 -0.51 7.52 5.85 -0.31 0.49 115.31 127.55 1ynj h LEU 1088Ca 0.11 0.12 0.09 0.00 0.84 0.00 0.00 57.88 59.04 1ynj h LEU 1088Cb 0.29 0.34 -0.10 0.00 0.37 0.00 0.00 40.66 41.55 1ynj h LEU 1088CO -0.66 -0.32 -0.36 0.58 -0.34 0.00 0.00 178.44 177.34 1ynj h VAL 1089N -0.37 0.17 -0.63 1.05 2.07 -0.48 0.55 116.25 118.60 1ynj h VAL 1089Ca 0.08 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.54 1ynj h VAL 1089Cb 0.49 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 1ynj h VAL 1089CO -0.27 0.00 0.15 0.11 0.02 0.00 0.00 177.57 177.58 1ynj h LYS 1090N -0.22 1.01 0.00 1.57 1.79 -0.56 -0.22 116.57 119.94 1ynj h LYS 1090Ca 0.20 -0.24 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1ynj h LYS 1090Cb 0.55 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1ynj h LYS 1090CO -0.63 0.92 0.00 0.39 -1.08 0.00 0.00 179.45 179.05 1ynj n GLU 1091N -4.32 0.14 -0.09 3.15 1.02 0.17 -2.01 120.64 118.69 1ynj n GLU 1091Ca 0.04 0.48 -0.19 0.00 -0.02 0.00 0.00 57.16 57.47 1ynj n GLU 1091Cb 0.25 -1.83 -0.11 0.00 -0.02 0.00 0.00 31.44 29.73 1ynj n GLU 1091CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1ynj h LEU 1092N 0.00 0.00 -0.99 -4.62 3.38 0.17 -3.37 115.31 109.88 1ynj h LEU 1092Ca 0.00 -0.54 0.35 0.00 0.09 0.00 0.00 57.88 57.77 1ynj h LEU 1092Cb 0.20 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.79 1ynj h LEU 1092CO 0.00 1.33 0.46 1.56 0.09 0.00 0.00 178.44 181.88 1ynj h GLN 1093N -1.00 0.13 0.00 1.13 4.20 -0.63 0.48 115.11 119.42 1ynj h GLN 1093Ca -0.26 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1ynj h GLN 1093Cb 1.16 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.91 1ynj h GLN 1093CO -0.15 0.09 0.00 0.00 -0.67 0.00 0.00 178.83 178.09 1ynj n ALA 1094N -2.42 1.08 -1.71 3.87 0.00 -0.85 -1.57 120.51 118.91 1ynj n ALA 1094Ca 0.32 0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.83 1ynj n ALA 1094Cb 1.06 -1.08 0.18 0.00 0.00 0.00 0.00 19.45 19.61 1ynj n ALA 1094CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ynj n LEU 1095N -1.63 2.74 0.00 0.00 7.94 0.17 -5.08 117.00 121.14 1ynj n LEU 1095Ca 0.00 -3.82 0.00 0.00 -1.11 0.00 0.00 56.01 51.08 1ynj n LEU 1095Cb 0.02 -0.47 0.00 0.00 0.53 0.00 0.00 43.42 43.51 1ynj n LEU 1095CO 0.03 1.39 0.00 0.00 -1.11 0.00 0.00 177.39 177.70 1ynj n ALA 1096N -0.97 0.00 -1.07 1.96 0.00 -0.61 -5.07 120.51 114.76 1ynj n ALA 1096Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1ynj n ALA 1096Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.20 1ynj n ALA 1096CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ynj n LEU 1097N 0.00 -2.56 -0.10 0.00 4.77 -1.26 -3.75 117.00 114.10 1ynj n LEU 1097Ca 0.00 0.37 -0.11 0.00 -0.03 0.00 0.00 56.01 56.23 1ynj n LEU 1097Cb 0.00 -1.28 -0.04 0.00 -2.33 0.00 0.00 43.42 39.78 1ynj n LEU 1097CO 0.00 -0.33 0.73 -0.78 -1.33 0.00 0.00 177.39 175.68 1ynj h ASP 1098N 0.53 0.55 -6.09 -1.43 3.58 -1.94 -3.32 116.42 108.30 1ynj h ASP 1098Ca 0.00 -0.35 -0.25 0.00 0.42 0.00 0.00 57.03 56.85 1ynj h ASP 1098Cb 0.00 -0.15 0.01 0.00 1.72 0.00 0.00 39.33 40.91 1ynj h ASP 1098CO 0.00 0.77 -0.92 0.52 -2.88 0.00 0.00 179.24 176.73 1ynj n VAL 1099N -4.52 -6.59 -2.81 2.25 0.31 -1.26 -4.87 118.33 100.84 1ynj n VAL 1099Ca -0.03 0.34 -0.41 0.00 -0.01 0.00 0.00 64.34 64.23 1ynj n VAL 1099Cb 0.30 -4.93 -0.03 0.00 -0.91 0.00 0.00 33.84 28.26 1ynj n VAL 1099CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1ynj s GLN 1100N -2.68 4.53 -0.19 5.55 0.74 -1.26 -5.05 119.66 121.29 1ynj s GLN 1100Ca 0.30 1.26 -0.07 0.00 0.05 0.00 0.00 55.36 56.90 1ynj s GLN 1100Cb -0.05 -3.45 -0.04 0.00 1.10 0.00 0.00 33.01 30.57 1ynj s GLN 1100CO 0.84 -0.01 0.06 0.95 -0.55 0.00 0.00 175.29 176.58 1ynj s THR 1101N 0.93 4.70 -0.01 -0.34 -4.23 -1.26 -5.10 115.64 110.33 1ynj s THR 1101Ca 0.48 -0.06 0.01 0.00 -1.18 0.00 0.00 61.69 60.94 1ynj s THR 1101Cb -0.20 -3.13 0.00 0.00 1.34 0.00 0.00 72.50 70.51 1ynj s THR 1101CO 0.25 0.44 -0.03 -0.76 -0.54 0.00 0.00 174.62 173.98 1ynj s LEU 1102N 0.58 1.81 1.04 4.79 1.43 -1.26 -2.27 118.68 124.79 1ynj s LEU 1102Ca 0.03 -0.06 -0.17 0.00 -1.03 0.00 0.00 54.13 52.90 1ynj s LEU 1102Cb -0.13 -0.21 0.23 0.00 0.03 0.00 0.00 46.19 46.12 1ynj s LEU 1102CO 0.01 0.01 1.29 1.51 0.23 0.00 0.00 176.35 179.40 1ynj s ASP 1103N 0.18 2.43 0.46 2.29 -4.77 -0.92 -4.85 116.67 111.48 1ynj s ASP 1103Ca -0.02 0.29 0.14 0.00 -3.30 0.00 0.00 52.55 49.66 1ynj s ASP 1103Cb -0.04 -0.32 1.03 0.00 -1.09 0.00 0.00 42.92 42.50 1ynj s ASP 1103CO -0.00 -3.16 2.02 -0.08 0.70 0.00 0.00 175.17 174.65 1ynj h GLU 1104N -1.93 0.04 0.00 2.11 4.57 -2.02 0.57 114.58 117.92 1ynj h GLU 1104Ca -0.44 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 1ynj h GLU 1104Cb 1.24 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 1ynj h GLU 1104CO 0.34 0.17 0.00 1.63 -1.18 0.00 0.00 179.01 179.97 1ynj n LYS 1105N -4.37 0.59 -0.84 1.92 4.01 -1.26 -4.88 118.16 113.34 1ynj n LYS 1105Ca -0.02 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.78 1ynj n LYS 1105Cb 0.21 -1.38 0.00 0.00 -0.51 0.00 0.00 35.03 33.35 1ynj n LYS 1105CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1ynj n ASP 1106N -0.88 -2.52 -4.71 4.39 8.00 0.20 -5.00 116.55 116.03 1ynj n ASP 1106Ca 0.11 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.36 1ynj n ASP 1106Cb 0.05 -2.08 0.10 0.00 -0.02 0.00 0.00 41.12 39.16 1ynj n ASP 1106CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ynj s ASN 1107N -2.17 4.43 0.61 -2.24 4.22 -1.26 -4.79 114.94 113.74 1ynj s ASN 1107Ca 0.00 0.04 -0.05 0.00 -2.14 0.00 0.00 52.86 50.71 1ynj s ASN 1107Cb 0.00 -0.52 0.03 0.00 1.28 0.00 0.00 41.25 42.04 1ynj s ASN 1107CO 0.00 -1.82 0.90 -2.16 -2.04 0.00 0.00 177.10 171.98 1ynj s PRO 1108N -5.24 2.66 0.00 3.55 0.04 -1.26 -2.18 135.00 132.57 1ynj s PRO 1108Ca 0.64 -0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.46 1ynj s PRO 1108Cb -0.07 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1ynj s PRO 1108CO 0.45 -0.83 0.00 1.55 0.04 0.00 0.00 177.00 178.20 1ynj n VAL 1109N -2.62 0.00 -2.52 -0.36 3.14 -0.96 -4.80 118.33 110.21 1ynj n VAL 1109Ca 0.06 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.42 1ynj n VAL 1109Cb 0.59 -0.62 0.00 0.00 -1.06 0.00 0.00 33.84 32.75 1ynj n VAL 1109CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1ynj n ASP 1110N -2.48 -6.91 -0.83 6.55 2.03 -1.26 -4.85 116.55 108.79 1ynj n ASP 1110Ca 0.00 0.98 0.00 0.00 0.52 0.00 0.00 54.79 56.29 1ynj n ASP 1110Cb 0.44 -4.56 0.00 0.00 -0.72 0.00 0.00 41.12 36.28 1ynj n ASP 1110CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1ynj n ILE 1111N 0.33 0.58 0.00 5.18 -5.35 -1.26 -3.93 119.36 114.91 1ynj n ILE 1111Ca 0.03 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.51 1ynj n ILE 1111Cb 0.10 -0.77 0.00 0.00 -1.74 0.00 0.00 39.64 37.23 1ynj n ILE 1111CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1ynj n PHE 1112N 0.40 0.00 -4.05 4.28 3.01 -1.26 -4.90 117.46 114.94 1ynj n PHE 1112Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.06 1ynj n PHE 1112Cb 0.36 0.17 0.01 0.00 -0.01 0.00 0.00 39.48 40.01 1ynj n PHE 1112CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1ynj n GLU 1113N -2.43 -0.35 0.00 -1.08 0.00 -1.25 -5.19 120.64 110.33 1ynj n GLU 1113Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.14 1ynj n GLU 1113Cb 0.22 -2.06 0.00 0.00 0.00 0.00 0.00 31.44 29.60 1ynj n GLU 1113CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54