#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a1l s LEU 3 N 0.00 0.93 -0.12 6.55 2.96 0.34 -4.97 118.68 124.38 2a1l s LEU 3 Ca 0.00 -0.00 0.03 0.00 -0.22 0.00 0.00 54.13 53.93 2a1l s LEU 3 Cb 0.00 -0.20 -0.00 0.00 0.50 0.00 0.00 46.19 46.49 2a1l s LEU 3 CO 0.00 -0.14 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.06 2a1l s ILE 4 N 1.31 2.35 0.02 6.68 1.01 -1.26 -0.69 121.20 130.61 2a1l s ILE 4 Ca -0.06 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.68 2a1l s ILE 4 Cb -0.13 -1.93 -0.02 0.00 0.01 0.00 0.00 42.46 40.39 2a1l s ILE 4 CO -0.02 0.55 -0.03 -0.54 0.00 0.00 0.00 174.94 174.90 2a1l s LYS 5 N 0.44 0.26 -0.21 2.79 1.02 -0.48 -3.32 119.74 120.24 2a1l s LYS 5 Ca -0.15 -0.51 -0.01 0.00 0.02 0.00 0.00 55.97 55.32 2a1l s LYS 5 Cb -0.17 0.08 0.01 0.00 -0.52 0.00 0.00 37.83 37.23 2a1l s LYS 5 CO 0.06 -0.04 -0.12 -2.00 -0.92 0.00 0.00 175.35 172.33 2a1l s GLU 6 N -1.21 3.09 -0.22 1.68 2.12 0.60 0.13 118.70 124.88 2a1l s GLU 6 Ca -0.13 -0.79 -0.12 0.00 0.36 0.00 0.00 54.97 54.29 2a1l s GLU 6 Cb -0.08 -2.80 -0.05 0.00 0.26 0.00 0.00 34.13 31.46 2a1l s GLU 6 CO -0.01 -0.24 0.21 -0.06 -0.54 0.00 0.00 175.26 174.61 2a1l s PHE 7 N 1.36 3.35 -0.28 5.30 0.40 0.10 -0.07 117.98 128.14 2a1l s PHE 7 Ca 0.04 0.33 -0.06 0.00 -0.60 0.00 0.00 56.93 56.64 2a1l s PHE 7 Cb -0.14 -2.30 0.00 0.00 0.51 0.00 0.00 43.02 41.09 2a1l s PHE 7 CO -0.08 0.10 0.06 1.03 0.70 0.00 0.00 175.22 177.02 2a1l s ARG 8 N 0.96 3.22 -0.36 0.44 0.52 0.76 -0.22 118.95 124.26 2a1l s ARG 8 Ca 0.10 -0.77 -0.04 0.00 -0.52 0.00 0.00 55.73 54.51 2a1l s ARG 8 Cb -0.13 -3.30 0.07 0.00 0.52 0.00 0.00 34.95 32.11 2a1l s ARG 8 CO 0.04 -0.36 0.12 0.08 0.02 0.00 0.00 175.30 175.20 2a1l s VAL 9 N 1.51 3.42 0.02 3.52 1.01 -0.44 -0.49 120.40 128.95 2a1l s VAL 9 Ca 0.04 -1.56 -0.22 0.00 0.00 0.00 0.00 61.98 60.24 2a1l s VAL 9 Cb -0.16 -3.10 -0.06 0.00 0.00 0.00 0.00 36.38 33.06 2a1l s VAL 9 CO 0.02 -0.37 0.64 -0.69 0.00 0.00 0.00 175.10 174.70 2a1l s VAL 10 N 1.27 4.83 0.08 2.92 1.01 -1.25 -1.29 120.40 127.96 2a1l s VAL 10 Ca 0.01 1.36 0.04 0.00 0.00 0.00 0.00 61.98 63.39 2a1l s VAL 10 Cb -0.21 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2a1l s VAL 10 CO -0.01 0.42 -0.11 -0.76 0.00 0.00 0.00 175.10 174.64 2a1l s LEU 11 N -0.26 2.34 -1.20 3.92 1.43 -0.62 -4.70 118.68 119.58 2a1l s LEU 11 Ca 0.33 -0.71 -0.06 0.00 -1.03 0.00 0.00 54.13 52.66 2a1l s LEU 11 Cb -0.19 -0.33 0.09 0.00 0.03 0.00 0.00 46.19 45.79 2a1l s LEU 11 CO 0.19 -0.21 2.51 -0.81 0.23 0.00 0.00 176.35 178.27 2a1l n PRO 12 N 0.92 4.17 -3.63 1.29 -0.04 -1.26 -2.65 135.00 133.81 2a1l n PRO 12 Ca -0.19 -3.16 -0.10 0.00 -0.04 0.00 0.00 63.50 60.01 2a1l n PRO 12 Cb 0.56 -2.56 -0.04 0.00 -0.04 0.00 0.00 33.50 31.42 2a1l n PRO 12 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a1l s SER 14 N -2.82 5.21 0.28 0.00 1.04 -1.26 -2.93 113.70 113.23 2a1l s SER 14 Ca 0.04 0.87 -0.00 0.00 0.48 0.00 0.00 55.95 57.34 2a1l s SER 14 Cb 0.01 -1.63 0.40 0.00 0.10 0.00 0.00 66.02 64.90 2a1l s SER 14 CO -0.10 -1.42 1.79 0.58 0.98 0.00 0.00 173.24 175.08 2a1l h VAL 15 N -0.61 1.23 0.02 5.02 2.07 -1.90 -1.47 116.25 120.61 2a1l h VAL 15 Ca -0.45 -0.95 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 2a1l h VAL 15 Cb 1.28 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2a1l h VAL 15 CO 0.63 0.33 -0.01 1.56 0.02 0.00 0.00 177.57 180.10 2a1l h GLN 16 N 0.67 -0.03 -0.95 1.57 7.50 -1.98 -2.83 115.11 119.07 2a1l h GLN 16 Ca 0.13 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.28 2a1l h GLN 16 Cb 0.42 0.01 -0.05 0.00 0.05 0.00 0.00 27.48 27.91 2a1l h GLN 16 CO 0.02 0.23 0.58 0.93 -1.50 0.00 0.00 178.83 179.08 2a1l h GLU 17 N -0.28 1.28 -0.36 1.46 5.08 -1.91 -2.51 114.58 117.35 2a1l h GLU 17 Ca -0.00 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2a1l h GLU 17 Cb 0.26 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2a1l h GLU 17 CO 0.00 0.89 0.23 -0.92 -1.00 0.00 0.00 179.01 178.21 2a1l h TYR 18 N 1.30 0.45 -0.93 4.33 3.20 -1.18 -0.02 116.97 124.12 2a1l h TYR 18 Ca 0.34 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.32 2a1l h TYR 18 Cb -0.07 -0.15 -0.08 0.00 1.54 0.00 0.00 36.73 37.98 2a1l h TYR 18 CO 0.00 0.29 0.56 0.37 -1.64 0.00 0.00 178.16 177.75 2a1l h GLN 19 N 0.48 0.91 0.08 1.82 4.15 -1.19 0.43 115.11 121.78 2a1l h GLN 19 Ca 0.13 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.37 2a1l h GLN 19 Cb -0.04 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 27.46 2a1l h GLN 19 CO -0.03 0.60 -0.52 0.28 -1.93 0.00 0.00 178.83 177.23 2a1l h VAL 20 N 0.93 1.58 -0.65 2.39 2.07 -1.49 -3.27 116.25 117.81 2a1l h VAL 20 Ca 0.45 -2.38 0.06 0.00 0.82 0.00 0.00 66.70 65.64 2a1l h VAL 20 Cb 0.39 3.15 -0.05 0.00 -1.52 0.00 0.00 31.29 33.25 2a1l h VAL 20 CO -0.24 0.66 0.36 1.23 0.02 0.00 0.00 177.57 179.59 2a1l h GLY 21 N -0.52 0.95 0.99 2.17 0.00 -0.46 -0.44 103.07 105.76 2a1l h GLY 21 Ca -0.09 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2a1l h GLY 21 CO 0.10 0.15 0.07 -1.61 0.00 0.00 0.00 176.54 175.25 2a1l h GLN 22 N 0.66 0.15 -0.50 4.80 4.15 -0.30 0.41 115.11 124.47 2a1l h GLN 22 Ca 0.29 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.68 2a1l h GLN 22 Cb 0.19 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.82 2a1l h GLN 22 CO -0.18 0.11 0.22 -0.07 -1.93 0.00 0.00 178.83 176.98 2a1l h LEU 23 N 0.13 0.67 -0.13 -2.39 3.38 -1.54 0.13 115.31 115.57 2a1l h LEU 23 Ca 0.04 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2a1l h LEU 23 Cb 0.00 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2a1l h LEU 23 CO -0.01 0.64 0.08 0.22 0.09 0.00 0.00 178.44 179.46 2a1l h TYR 24 N 0.66 0.17 -0.59 1.13 3.20 -0.89 -1.89 116.97 118.76 2a1l h TYR 24 Ca 0.17 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 2a1l h TYR 24 Cb 0.16 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 2a1l h TYR 24 CO -0.00 0.13 0.05 0.77 -1.64 0.00 0.00 178.16 177.47 2a1l h SER 25 N 0.15 0.97 -0.80 -2.11 0.02 -0.69 -2.28 113.55 108.82 2a1l h SER 25 Ca 0.05 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.68 2a1l h SER 25 Cb 0.01 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.25 2a1l h SER 25 CO -0.01 1.01 0.36 0.58 -1.14 0.00 0.00 176.83 177.64 2a1l h VAL 26 N 0.90 1.26 -0.48 2.27 2.07 -0.66 0.11 116.25 121.71 2a1l h VAL 26 Ca 0.17 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 2a1l h VAL 26 Cb 0.48 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2a1l h VAL 26 CO 0.02 0.32 0.26 0.00 0.02 0.00 0.00 177.57 178.19 2a1l h ALA 27 N 1.24 0.62 -0.19 1.67 0.00 -1.10 -0.80 119.26 120.70 2a1l h ALA 27 Ca 0.27 -0.09 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 2a1l h ALA 27 Cb 0.15 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.76 2a1l h ALA 27 CO -0.03 0.15 -0.69 0.93 0.00 0.00 0.00 179.25 179.61 2a1l h GLU 28 N 0.64 0.78 -0.25 0.00 4.39 -1.11 -2.94 114.58 116.08 2a1l h GLU 28 Ca 0.17 -0.58 -0.06 0.00 0.34 0.00 0.00 59.36 59.23 2a1l h GLU 28 Cb 0.06 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2a1l h GLU 28 CO -0.03 1.20 -0.12 0.00 -1.16 0.00 0.00 179.01 178.90 2a1l h ALA 29 N 0.65 1.32 -0.65 3.43 0.00 -0.69 -2.33 119.26 121.00 2a1l h ALA 29 Ca -0.03 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 2a1l h ALA 29 Cb 1.31 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2a1l h ALA 29 CO 0.14 0.45 0.15 0.77 0.00 0.00 0.00 179.25 180.77 2a1l h SER 30 N 0.39 1.00 0.28 0.00 0.02 -1.08 -2.62 113.55 111.54 2a1l h SER 30 Ca 0.07 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.68 2a1l h SER 30 Cb 0.46 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 2a1l h SER 30 CO 0.03 0.98 -0.41 0.11 -1.14 0.00 0.00 176.83 176.40 2a1l h LYS 31 N 0.98 0.18 0.00 3.45 1.57 -1.30 -2.66 116.57 118.78 2a1l h LYS 31 Ca 0.20 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2a1l h LYS 31 Cb 0.38 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2a1l h LYS 31 CO 0.00 0.56 0.00 0.09 -0.57 0.00 0.00 179.45 179.54 2a1l n ASN 32 N -4.03 0.34 -0.30 0.86 3.02 -0.91 -2.49 115.26 111.75 2a1l n ASN 32 Ca -0.02 0.57 0.08 0.00 -0.03 0.00 0.00 54.58 55.19 2a1l n ASN 32 Cb 0.47 -0.65 -0.02 0.00 -0.61 0.00 0.00 39.78 38.97 2a1l n ASN 32 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2a1l n GLU 33 N -1.86 1.73 -4.03 3.52 -0.58 -1.02 -2.75 120.64 115.65 2a1l n GLU 33 Ca 0.03 -0.67 -0.35 0.00 -0.42 0.00 0.00 57.16 55.75 2a1l n GLU 33 Cb 0.23 -1.26 -0.09 0.00 -0.57 0.00 0.00 31.44 29.74 2a1l n GLU 33 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2a1l s THR 34 N -1.98 4.83 0.00 2.62 2.01 -1.04 -3.75 115.64 118.33 2a1l s THR 34 Ca 0.12 -0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.09 2a1l s THR 34 Cb 0.13 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.49 2a1l s THR 34 CO 0.44 0.50 0.00 0.61 -0.69 0.00 0.00 174.62 175.48 2a1l n GLY 35 N 3.18 3.10 3.57 4.40 0.00 0.16 -4.59 105.19 115.00 2a1l n GLY 35 Ca -0.17 -1.03 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 2a1l n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a1l n GLY 36 N -1.16 -0.49 1.81 -0.02 0.00 0.46 -1.18 105.19 104.60 2a1l n GLY 36 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2a1l n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a1l n GLY 37 N -1.40 2.21 3.54 -0.02 0.00 0.24 -4.62 105.19 105.14 2a1l n GLY 37 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2a1l n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a1l s GLU 38 N -0.46 1.94 0.00 1.61 2.02 -0.33 -4.88 118.70 118.60 2a1l s GLU 38 Ca 0.00 -1.44 0.00 0.00 0.02 0.00 0.00 54.97 53.55 2a1l s GLU 38 Cb 0.00 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 32.20 2a1l s GLU 38 CO 0.00 0.40 0.00 0.41 0.02 0.00 0.00 175.26 176.09 2a1l n GLY 39 N -0.22 0.88 3.82 -1.39 0.00 -0.70 0.38 105.19 107.96 2a1l n GLY 39 Ca -0.09 -1.97 -0.36 0.00 0.00 0.00 0.00 46.02 43.59 2a1l n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a1l s ILE 40 N -2.28 5.18 -0.12 -0.61 1.09 -1.26 -0.94 121.20 122.26 2a1l s ILE 40 Ca 0.00 0.08 0.01 0.00 -1.10 0.00 0.00 60.65 59.65 2a1l s ILE 40 Cb 0.00 -3.24 0.02 0.00 -1.06 0.00 0.00 42.46 38.18 2a1l s ILE 40 CO 0.00 0.61 -0.15 -0.70 -0.10 0.00 0.00 174.94 174.60 2a1l s GLU 41 N -0.94 2.25 -0.25 2.79 2.12 0.00 -4.76 118.70 119.91 2a1l s GLU 41 Ca 0.14 -0.56 -0.13 0.00 0.36 0.00 0.00 54.97 54.78 2a1l s GLU 41 Cb -0.12 -1.96 -0.04 0.00 0.26 0.00 0.00 34.13 32.27 2a1l s GLU 41 CO 0.03 -0.11 0.27 0.08 -0.54 0.00 0.00 175.26 174.99 2a1l s VAL 42 N 1.12 5.27 -0.23 3.70 1.01 -1.26 -0.34 120.40 129.67 2a1l s VAL 42 Ca -0.03 0.37 0.05 0.00 0.00 0.00 0.00 61.98 62.36 2a1l s VAL 42 Cb -0.14 -3.60 -0.20 0.00 0.00 0.00 0.00 36.38 32.44 2a1l s VAL 42 CO -0.04 0.25 -0.07 0.18 0.00 0.00 0.00 175.10 175.42 2a1l n LEU 43 N 4.80 2.26 -3.84 3.92 4.77 0.12 -5.00 117.00 124.03 2a1l n LEU 43 Ca -0.12 -0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 55.69 2a1l n LEU 43 Cb 0.51 -0.61 -0.11 0.00 -2.33 0.00 0.00 43.42 40.89 2a1l n LEU 43 CO 0.36 0.82 -0.14 -0.54 -1.33 0.00 0.00 177.39 176.56 2a1l s LYS 44 N -2.52 0.41 -0.45 3.23 1.02 -0.84 -4.93 119.74 115.66 2a1l s LYS 44 Ca -0.27 -0.13 0.07 0.00 0.02 0.00 0.00 55.97 55.66 2a1l s LYS 44 Cb 0.08 0.18 0.18 0.00 -0.52 0.00 0.00 37.83 37.75 2a1l s LYS 44 CO 0.67 -0.09 0.65 1.21 -0.92 0.00 0.00 175.35 176.88 2a1l s ASN 45 N -0.84 -1.36 0.09 2.83 2.47 -1.22 -0.84 114.94 116.08 2a1l s ASN 45 Ca -0.09 -1.20 -0.05 0.00 0.42 0.00 0.00 52.86 51.94 2a1l s ASN 45 Cb -0.05 1.85 -0.02 0.00 -1.45 0.00 0.00 41.25 41.58 2a1l s ASN 45 CO 0.01 -0.13 0.11 -1.83 -3.72 0.00 0.00 177.10 171.54 2a1l s GLU 46 N 1.44 0.83 0.75 0.43 -1.05 0.25 -4.96 118.70 116.39 2a1l s GLU 46 Ca 0.21 -1.17 -0.11 0.00 -0.15 0.00 0.00 54.97 53.76 2a1l s GLU 46 Cb -0.03 0.28 0.04 0.00 -0.44 0.00 0.00 34.13 33.98 2a1l s GLU 46 CO -0.06 -0.24 1.08 -2.14 0.95 0.00 0.00 175.26 174.85 2a1l s PRO 47 N -3.93 2.51 0.27 -4.83 0.02 -1.26 0.14 135.00 127.92 2a1l s PRO 47 Ca 0.11 0.88 -0.12 0.00 0.02 0.00 0.00 61.00 61.89 2a1l s PRO 47 Cb 0.06 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.63 2a1l s PRO 47 CO -0.07 -1.38 0.50 1.52 -0.33 0.00 0.00 177.00 177.25 2a1l s TYR 48 N -3.06 0.42 -0.46 6.54 -0.85 0.53 -4.69 117.35 115.78 2a1l s TYR 48 Ca 0.59 -0.79 0.07 0.00 -0.52 0.00 0.00 57.07 56.42 2a1l s TYR 48 Cb -0.15 0.21 0.26 0.00 0.38 0.00 0.00 41.96 42.66 2a1l s TYR 48 CO 0.55 -1.05 0.86 -1.91 -1.52 0.00 0.00 175.55 172.47 2a1l n GLU 49 N -0.42 0.81 -2.47 -3.49 2.13 -1.26 -2.32 120.64 113.63 2a1l n GLU 49 Ca -0.02 -2.07 -0.42 0.00 0.66 0.00 0.00 57.16 55.31 2a1l n GLU 49 Cb 0.62 -1.37 -0.03 0.00 0.27 0.00 0.00 31.44 30.93 2a1l n GLU 49 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 2a1l s ASN 50 N -1.58 7.12 0.88 4.31 3.84 -0.83 -4.75 114.94 123.94 2a1l s ASN 50 Ca 0.31 1.92 0.00 0.00 0.21 0.00 0.00 52.86 55.31 2a1l s ASN 50 Cb 0.23 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.36 2a1l s ASN 50 CO -0.19 -0.46 0.00 -0.67 -2.79 0.00 0.00 177.10 172.99 2a1l n ASP 51 N 4.16 0.00 -2.08 -4.21 -0.08 -1.26 -0.56 116.55 112.51 2a1l n ASP 51 Ca 0.09 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 53.14 2a1l n ASP 51 Cb 0.47 0.00 0.13 0.00 2.34 0.00 0.00 41.12 44.06 2a1l n ASP 51 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2a1l n GLY 52 N 0.00 4.47 3.10 0.27 0.00 -1.26 -4.90 105.19 106.87 2a1l n GLY 52 Ca 0.00 -1.22 -0.26 0.00 0.00 0.00 0.00 46.02 44.54 2a1l n GLY 52 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2a1l s GLU 53 N -2.91 1.93 0.05 1.61 2.12 0.27 -5.13 118.70 116.64 2a1l s GLU 53 Ca 0.50 -0.57 0.04 0.00 0.36 0.00 0.00 54.97 55.29 2a1l s GLU 53 Cb 0.41 -1.60 -0.04 0.00 0.26 0.00 0.00 34.13 33.17 2a1l s GLU 53 CO 0.06 0.15 -0.02 0.15 -0.54 0.00 0.00 175.26 175.06 2a1l s LYS 54 N 0.31 2.57 0.00 4.30 1.02 -1.26 -1.96 119.74 124.72 2a1l s LYS 54 Ca -0.10 -0.78 0.00 0.00 0.02 0.00 0.00 55.97 55.12 2a1l s LYS 54 Cb -0.14 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.62 2a1l s LYS 54 CO 0.04 0.57 0.00 0.41 -0.92 0.00 0.00 175.35 175.45 2a1l n GLY 55 N 0.97 -1.26 3.46 -3.33 0.00 -0.98 -4.56 105.19 99.50 2a1l n GLY 55 Ca -0.13 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 2a1l n GLY 55 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a1l s GLN 56 N -0.50 3.53 -0.12 1.61 2.00 0.71 -0.34 119.66 126.54 2a1l s GLN 56 Ca 0.00 -0.57 -0.04 0.00 -2.00 0.00 0.00 55.36 52.75 2a1l s GLN 56 Cb 0.00 -2.81 -0.03 0.00 0.80 0.00 0.00 33.01 30.97 2a1l s GLN 56 CO 0.00 0.26 0.01 -0.47 -0.50 0.00 0.00 175.29 174.59 2a1l s TYR 57 N 0.28 3.18 0.01 1.67 5.04 0.37 -0.61 117.35 127.28 2a1l s TYR 57 Ca -0.05 0.09 0.03 0.00 -2.44 0.00 0.00 57.07 54.70 2a1l s TYR 57 Cb -0.15 -1.89 -0.01 0.00 0.35 0.00 0.00 41.96 40.26 2a1l s TYR 57 CO 0.04 0.31 -0.10 0.95 -1.34 0.00 0.00 175.55 175.41 2a1l s THR 58 N -0.37 0.78 -0.11 4.34 -4.23 -0.61 -0.59 115.64 114.85 2a1l s THR 58 Ca 0.08 -0.62 -0.01 0.00 -1.18 0.00 0.00 61.69 59.96 2a1l s THR 58 Cb -0.12 -0.69 0.03 0.00 1.34 0.00 0.00 72.50 73.05 2a1l s THR 58 CO 0.02 0.08 -0.05 -2.28 -0.54 0.00 0.00 174.62 171.85 2a1l s HIS 59 N -0.51 1.27 0.11 3.99 2.46 -0.02 -1.26 115.29 121.34 2a1l s HIS 59 Ca 0.01 -0.64 0.03 0.00 0.47 0.00 0.00 55.06 54.94 2a1l s HIS 59 Cb -0.05 -1.12 -0.04 0.00 -0.13 0.00 0.00 32.58 31.24 2a1l s HIS 59 CO 0.00 -0.48 -0.09 0.15 -2.47 0.00 0.00 174.74 171.85 2a1l s LYS 60 N 1.78 0.91 -0.07 2.88 1.02 -0.35 0.11 119.74 126.02 2a1l s LYS 60 Ca 0.04 -1.30 0.03 0.00 0.02 0.00 0.00 55.97 54.75 2a1l s LYS 60 Cb -0.13 -0.46 0.01 0.00 -0.52 0.00 0.00 37.83 36.73 2a1l s LYS 60 CO -0.07 0.05 -0.15 0.42 -0.92 0.00 0.00 175.35 174.68 2a1l s ILE 61 N -3.09 1.32 -0.21 2.17 1.01 0.53 0.19 121.20 123.13 2a1l s ILE 61 Ca 0.11 -0.60 -0.08 0.00 0.00 0.00 0.00 60.65 60.08 2a1l s ILE 61 Cb 0.01 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 2a1l s ILE 61 CO -0.01 0.39 0.08 -0.31 0.00 0.00 0.00 174.94 175.09 2a1l s TYR 62 N 0.48 3.23 -0.42 3.97 1.51 0.17 -0.81 117.35 125.47 2a1l s TYR 62 Ca -0.13 0.01 -0.11 0.00 -1.01 0.00 0.00 57.07 55.82 2a1l s TYR 62 Cb -0.15 -2.14 0.06 0.00 -0.11 0.00 0.00 41.96 39.62 2a1l s TYR 62 CO 0.04 0.04 0.28 -1.01 -1.11 0.00 0.00 175.55 173.79 2a1l s HIS 63 N 0.74 3.29 -0.29 2.71 3.76 -0.11 -1.71 115.29 123.67 2a1l s HIS 63 Ca 0.04 -1.22 0.08 0.00 -0.15 0.00 0.00 55.06 53.81 2a1l s HIS 63 Cb -0.13 -2.88 0.45 0.00 1.11 0.00 0.00 32.58 31.13 2a1l s HIS 63 CO 0.02 -0.78 1.29 1.28 -0.85 0.00 0.00 174.74 175.69 2a1l n LEU 64 N 5.02 4.43 -0.09 0.89 4.77 -1.10 -1.72 117.00 129.19 2a1l n LEU 64 Ca -0.11 -4.38 -0.04 0.00 -0.03 0.00 0.00 56.01 51.45 2a1l n LEU 64 Cb 0.44 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 2a1l n LEU 64 CO 0.41 1.78 0.50 0.11 -1.33 0.00 0.00 177.39 178.85 2a1l h LYS 65 N 1.71 -0.06 -0.01 3.23 1.57 -1.93 -2.31 116.57 118.77 2a1l h LYS 65 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 2a1l h LYS 65 Cb 1.36 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.69 2a1l h LYS 65 CO 0.57 -0.04 -0.02 -1.13 -0.57 0.00 0.00 179.45 178.26 2a1l n SER 66 N -3.65 1.36 0.12 0.86 3.41 -1.26 -3.91 113.62 110.54 2a1l n SER 66 Ca -0.00 -1.41 0.12 0.00 -0.26 0.00 0.00 58.87 57.31 2a1l n SER 66 Cb 0.10 0.01 0.08 0.00 -0.26 0.00 0.00 64.21 64.13 2a1l n SER 66 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2a1l h LYS 67 N 2.10 0.00 -6.96 4.33 1.57 -1.76 -3.45 116.57 112.40 2a1l h LYS 67 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 2a1l h LYS 67 Cb 0.47 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.81 2a1l h LYS 67 CO 0.00 0.00 0.12 0.14 -0.57 0.00 0.00 179.45 179.14 2a1l s VAL 68 N -3.29 4.69 0.67 0.50 -7.23 -1.02 -0.95 120.40 113.77 2a1l s VAL 68 Ca 0.03 0.16 -0.14 0.00 -1.81 0.00 0.00 61.98 60.22 2a1l s VAL 68 Cb 0.09 -3.79 0.00 0.00 0.56 0.00 0.00 36.38 33.24 2a1l s VAL 68 CO 0.75 -0.78 1.10 -2.16 -0.31 0.00 0.00 175.10 173.69 2a1l s PRO 69 N -4.78 2.79 0.30 4.82 0.04 -1.12 -4.76 135.00 132.29 2a1l s PRO 69 Ca 0.48 1.30 0.06 0.00 0.04 0.00 0.00 61.00 62.88 2a1l s PRO 69 Cb -0.10 -1.96 0.77 0.00 0.04 0.00 0.00 34.50 33.25 2a1l s PRO 69 CO 0.45 -1.24 1.73 0.00 0.04 0.00 0.00 177.00 177.97 2a1l h ALA 70 N -0.15 1.58 0.00 8.56 0.00 -1.92 0.47 119.26 127.80 2a1l h ALA 70 Ca -0.46 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2a1l h ALA 70 Cb 1.24 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2a1l h ALA 70 CO 0.54 -0.25 -0.07 0.27 0.00 0.00 0.00 179.25 179.75 2a1l h PHE 71 N 0.54 0.00 0.12 0.00 -5.15 -1.93 -1.38 116.94 109.14 2a1l h PHE 71 Ca 0.58 0.00 -0.28 0.00 -0.20 0.00 0.00 57.97 58.08 2a1l h PHE 71 Cb 1.06 0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.24 2a1l h PHE 71 CO -0.06 0.07 -1.21 0.28 -2.00 0.00 0.00 178.31 175.39 2a1l h VAL 72 N 0.00 1.42 0.00 0.88 2.07 -1.26 -3.02 116.25 116.33 2a1l h VAL 72 Ca -0.00 -2.78 -0.07 0.00 0.82 0.00 0.00 66.70 64.66 2a1l h VAL 72 Cb 0.19 2.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 2a1l h VAL 72 CO 0.01 0.82 -0.35 0.03 0.02 0.00 0.00 177.57 178.10 2a1l h ARG 73 N 0.15 0.00 -0.44 1.57 3.08 -1.09 -1.52 114.38 116.13 2a1l h ARG 73 Ca -0.15 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.78 2a1l h ARG 73 Cb 1.90 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.94 2a1l h ARG 73 CO 0.21 0.35 -0.21 1.98 -1.07 0.00 0.00 179.97 181.23 2a1l h MET 74 N 0.00 0.92 0.00 0.04 4.05 -1.24 -3.31 114.93 115.39 2a1l h MET 74 Ca -0.00 -0.40 -0.03 0.00 -0.28 0.00 0.00 59.70 58.98 2a1l h MET 74 Cb 0.62 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.39 2a1l h MET 74 CO 0.05 1.06 -1.20 0.44 0.23 0.00 0.00 176.91 177.48 2a1l n ILE 75 N -4.17 0.65 -2.93 1.77 -5.35 -1.15 -4.92 119.36 103.26 2a1l n ILE 75 Ca -0.01 -0.57 -0.41 0.00 -0.27 0.00 0.00 62.75 61.50 2a1l n ILE 75 Cb 0.45 -0.37 -0.04 0.00 -1.74 0.00 0.00 39.64 37.94 2a1l n ILE 75 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2a1l s ALA 76 N -3.30 3.29 0.81 -1.28 0.00 -0.58 -5.04 121.76 115.66 2a1l s ALA 76 Ca -0.02 0.26 -0.13 0.00 0.00 0.00 0.00 51.96 52.08 2a1l s ALA 76 Cb 0.10 -3.10 0.09 0.00 0.00 0.00 0.00 23.12 20.21 2a1l s ALA 76 CO 0.81 -0.18 1.18 -1.25 0.00 0.00 0.00 175.76 176.33 2a1l s PRO 77 N 0.95 1.63 0.11 0.00 0.04 -1.26 -4.87 135.00 131.59 2a1l s PRO 77 Ca 0.42 1.67 -0.31 0.00 0.04 0.00 0.00 61.00 62.82 2a1l s PRO 77 Cb -0.19 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 2a1l s PRO 77 CO 0.21 -2.20 1.62 -2.00 0.04 0.00 0.00 177.00 174.66 2a1l s GLU 78 N -4.26 4.21 0.00 4.56 2.12 -1.26 -2.41 118.70 121.65 2a1l s GLU 78 Ca 0.71 2.34 0.00 0.00 0.36 0.00 0.00 54.97 58.38 2a1l s GLU 78 Cb -0.27 -3.40 0.00 0.00 0.26 0.00 0.00 34.13 30.72 2a1l s GLU 78 CO 0.51 -0.68 0.00 0.41 -0.54 0.00 0.00 175.26 174.97 2a1l n GLY 79 N 3.89 0.75 0.50 -1.50 0.00 -1.26 -4.94 105.19 102.63 2a1l n GLY 79 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 2a1l n GLY 79 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2a1l n SER 80 N 0.00 1.86 -2.96 1.61 3.41 -1.01 -4.57 113.62 111.96 2a1l n SER 80 Ca 0.00 -1.42 -0.32 0.00 -0.26 0.00 0.00 58.87 56.87 2a1l n SER 80 Cb 0.00 0.26 -0.06 0.00 -0.26 0.00 0.00 64.21 64.16 2a1l n SER 80 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2a1l n LEU 81 N 0.04 7.49 -4.17 1.04 4.77 -1.26 -4.80 117.00 120.11 2a1l n LEU 81 Ca 0.12 -4.23 -0.28 0.00 -0.03 0.00 0.00 56.01 51.59 2a1l n LEU 81 Cb 0.45 -1.42 -0.16 0.00 -2.33 0.00 0.00 43.42 39.95 2a1l n LEU 81 CO 0.24 1.94 -0.52 -0.69 -1.33 0.00 0.00 177.39 177.03 2a1l s VAL 82 N 0.30 1.64 -0.06 4.08 1.01 -1.26 -2.70 120.40 123.41 2a1l s VAL 82 Ca 0.63 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.80 2a1l s VAL 82 Cb 0.24 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 35.23 2a1l s VAL 82 CO -0.08 0.47 -0.09 -0.36 0.00 0.00 0.00 175.10 175.03 2a1l s PHE 83 N 0.03 1.13 -0.08 5.22 0.40 -0.69 -4.52 117.98 119.47 2a1l s PHE 83 Ca -0.05 -0.39 -0.17 0.00 -0.60 0.00 0.00 56.93 55.73 2a1l s PHE 83 Cb -0.13 -0.88 -0.05 0.00 0.51 0.00 0.00 43.02 42.47 2a1l s PHE 83 CO 0.03 -0.24 0.44 -1.01 0.70 0.00 0.00 175.22 175.14 2a1l s HIS 84 N 0.76 3.58 -0.23 0.36 3.76 -0.63 -0.65 115.29 122.25 2a1l s HIS 84 Ca -0.13 0.90 0.02 0.00 -0.15 0.00 0.00 55.06 55.70 2a1l s HIS 84 Cb -0.15 -2.44 0.05 0.00 1.11 0.00 0.00 32.58 31.14 2a1l s HIS 84 CO 0.02 0.34 -0.12 -2.00 -0.85 0.00 0.00 174.74 172.13 2a1l s GLU 85 N 0.01 2.30 -0.15 1.40 2.12 0.13 -0.60 118.70 123.91 2a1l s GLU 85 Ca 0.24 -1.09 -0.03 0.00 0.36 0.00 0.00 54.97 54.44 2a1l s GLU 85 Cb -0.15 -2.69 -0.03 0.00 0.26 0.00 0.00 34.13 31.52 2a1l s GLU 85 CO 0.11 -0.46 -0.04 0.15 -0.54 0.00 0.00 175.26 174.48 2a1l s LYS 86 N 1.23 3.63 -0.03 4.30 1.02 -0.15 -1.22 119.74 128.52 2a1l s LYS 86 Ca -0.04 -0.52 0.01 0.00 0.02 0.00 0.00 55.97 55.44 2a1l s LYS 86 Cb -0.18 -2.90 0.02 0.00 -0.52 0.00 0.00 37.83 34.25 2a1l s LYS 86 CO -0.08 0.27 -0.05 0.00 -0.92 0.00 0.00 175.35 174.57 2a1l s ALA 87 N 0.29 0.62 -0.63 5.17 0.00 -0.38 -0.45 121.76 126.38 2a1l s ALA 87 Ca -0.03 -0.08 -0.05 0.00 0.00 0.00 0.00 51.96 51.79 2a1l s ALA 87 Cb -0.14 -0.35 0.16 0.00 0.00 0.00 0.00 23.12 22.80 2a1l s ALA 87 CO 0.03 0.02 0.47 -1.58 0.00 0.00 0.00 175.76 174.71 2a1l s TRP 88 N 0.68 3.49 -0.63 0.00 0.51 0.45 -1.58 118.94 121.86 2a1l s TRP 88 Ca -0.09 -2.48 -0.24 0.00 -2.12 0.00 0.00 56.10 51.16 2a1l s TRP 88 Cb -0.12 -3.34 0.05 0.00 -0.81 0.00 0.00 33.47 29.25 2a1l s TRP 88 CO 0.00 -0.89 1.03 1.21 -0.51 0.00 0.00 176.95 177.79 2a1l s ASN 89 N 1.22 6.24 -0.59 2.95 3.84 0.22 -2.23 114.94 126.59 2a1l s ASN 89 Ca 0.15 -0.60 0.03 0.00 0.21 0.00 0.00 52.86 52.65 2a1l s ASN 89 Cb -0.19 -2.46 0.39 0.00 -0.55 0.00 0.00 41.25 38.44 2a1l s ASN 89 CO -0.04 -1.45 1.39 0.00 -2.79 0.00 0.00 177.10 174.21 2a1l n ALA 90 N 8.00 5.50 -0.95 1.71 0.00 0.16 -0.21 120.51 134.72 2a1l n ALA 90 Ca 0.00 -4.31 -0.34 0.00 0.00 0.00 0.00 53.44 48.79 2a1l n ALA 90 Cb 0.47 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.85 2a1l n ALA 90 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2a1l n TYR 91 N -0.46 -0.20 1.15 0.00 9.36 -1.26 -1.51 117.16 124.24 2a1l n TYR 91 Ca 0.43 0.66 0.01 0.00 3.32 0.00 0.00 57.90 62.32 2a1l n TYR 91 Cb 0.50 -1.33 0.05 0.00 -0.63 0.00 0.00 39.34 37.92 2a1l n TYR 91 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2a1l n PRO 92 N 0.73 0.58 -4.88 2.98 -0.04 -1.26 -5.04 135.00 128.06 2a1l n PRO 92 Ca 0.12 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.27 2a1l n PRO 92 Cb 0.15 -1.04 -0.14 0.00 -0.04 0.00 0.00 33.50 32.43 2a1l n PRO 92 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2a1l s TYR 93 N -2.00 2.56 -0.01 0.54 5.04 -0.57 -1.09 117.35 121.81 2a1l s TYR 93 Ca 0.02 -0.26 -0.04 0.00 -2.44 0.00 0.00 57.07 54.35 2a1l s TYR 93 Cb 0.01 -1.53 0.00 0.00 0.35 0.00 0.00 41.96 40.79 2a1l s TYR 93 CO 0.02 0.17 0.09 0.00 -1.34 0.00 0.00 175.55 174.49 2a1l s ARG 95 N -0.72 1.25 0.03 0.00 3.52 -0.95 -0.98 118.95 121.10 2a1l s ARG 95 Ca -0.08 -0.24 0.08 0.00 -0.13 0.00 0.00 55.73 55.37 2a1l s ARG 95 Cb -0.05 -1.57 -0.02 0.00 -1.56 0.00 0.00 34.95 31.75 2a1l s ARG 95 CO 0.00 -0.33 -0.24 0.99 -0.81 0.00 0.00 175.30 174.92 2a1l s THR 96 N 1.76 1.91 -0.03 4.11 2.01 0.18 -0.41 115.64 125.17 2a1l s THR 96 Ca 0.04 -1.22 0.00 0.00 0.31 0.00 0.00 61.69 60.82 2a1l s THR 96 Cb -0.13 -1.63 0.03 0.00 0.01 0.00 0.00 72.50 70.78 2a1l s THR 96 CO -0.07 0.36 0.01 -0.63 -0.69 0.00 0.00 174.62 173.59 2a1l s ILE 97 N -0.73 0.15 -0.12 1.82 1.01 0.40 -0.84 121.20 122.89 2a1l s ILE 97 Ca 0.10 0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.85 2a1l s ILE 97 Cb -0.09 -0.26 -0.02 0.00 0.01 0.00 0.00 42.46 42.10 2a1l s ILE 97 CO 0.01 0.14 -0.08 -0.69 0.00 0.00 0.00 174.94 174.32 2a1l s VAL 98 N 1.09 3.50 0.30 2.92 1.01 0.74 -0.97 120.40 128.98 2a1l s VAL 98 Ca -0.09 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.40 2a1l s VAL 98 Cb -0.13 -2.49 -0.05 0.00 0.00 0.00 0.00 36.38 33.71 2a1l s VAL 98 CO -0.02 0.53 0.10 0.42 0.00 0.00 0.00 175.10 176.13 2a1l s THR 99 N 0.08 0.68 -0.03 3.92 -4.23 0.23 -1.40 115.64 114.89 2a1l s THR 99 Ca -0.03 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.47 2a1l s THR 99 Cb -0.14 -2.62 0.03 0.00 1.34 0.00 0.00 72.50 71.11 2a1l s THR 99 CO 0.04 0.00 0.06 0.21 -0.54 0.00 0.00 174.62 174.39 2a1l s ASN 100 N -3.40 0.27 0.16 3.99 3.84 -1.26 -1.60 114.94 116.94 2a1l s ASN 100 Ca 0.36 0.10 -0.17 0.00 0.21 0.00 0.00 52.86 53.36 2a1l s ASN 100 Cb 0.07 -0.02 0.08 0.00 -0.55 0.00 0.00 41.25 40.82 2a1l s ASN 100 CO 0.15 -0.16 1.70 -0.33 -2.79 0.00 0.00 177.10 175.67 2a1l h GLU 101 N 7.56 0.09 -0.41 0.43 4.39 -1.89 -1.50 114.58 123.24 2a1l h GLU 101 Ca -0.38 -0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.25 2a1l h GLU 101 Cb 1.12 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.73 2a1l h GLU 101 CO 0.39 0.06 -0.05 -0.92 -1.16 0.00 0.00 179.01 177.34 2a1l h TYR 102 N 0.09 0.72 0.00 4.33 3.20 -1.93 -2.72 116.97 120.67 2a1l h TYR 102 Ca 0.17 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2a1l h TYR 102 Cb 0.24 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.31 2a1l h TYR 102 CO -0.25 0.71 0.00 0.52 -1.64 0.00 0.00 178.16 177.50 2a1l h MET 103 N 0.63 0.00 0.00 1.82 2.86 -1.89 -3.48 114.93 114.87 2a1l h MET 103 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2a1l h MET 103 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 2a1l h MET 103 CO 0.02 0.00 0.00 1.63 1.06 0.00 0.00 176.91 179.62 2a1l n LYS 104 N -2.58 0.00 0.00 1.72 5.02 -0.59 -1.14 118.16 120.59 2a1l n LYS 104 Ca 0.05 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.48 2a1l n LYS 104 Cb 0.45 0.00 0.72 0.00 -0.02 0.00 0.00 35.03 36.18 2a1l n LYS 104 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2a1l n ASP 105 N 3.67 0.00 -0.32 4.39 5.75 -1.26 -3.62 116.55 125.16 2a1l n ASP 105 Ca 0.00 -0.09 0.12 0.00 -0.01 0.00 0.00 54.79 54.80 2a1l n ASP 105 Cb 0.00 -0.30 0.52 0.00 -1.03 0.00 0.00 41.12 40.32 2a1l n ASP 105 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2a1l n ASP 106 N -1.30 0.96 -3.81 -1.12 8.00 -0.29 -4.84 116.55 114.15 2a1l n ASP 106 Ca 0.13 -1.50 -0.13 0.00 0.71 0.00 0.00 54.79 54.01 2a1l n ASP 106 Cb 0.23 -0.04 -0.14 0.00 -0.02 0.00 0.00 41.12 41.16 2a1l n ASP 106 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2a1l s PHE 107 N -1.91 -0.11 -0.19 1.24 5.36 -1.24 -0.16 117.98 120.97 2a1l s PHE 107 Ca 0.34 0.31 -0.29 0.00 -0.96 0.00 0.00 56.93 56.32 2a1l s PHE 107 Cb 0.17 -0.01 0.13 0.00 -0.34 0.00 0.00 43.02 42.98 2a1l s PHE 107 CO 0.28 -0.08 1.04 -0.59 -1.46 0.00 0.00 175.22 174.41 2a1l s PHE 108 N 0.38 -0.34 -0.20 10.12 -0.12 -0.39 -4.54 117.98 122.89 2a1l s PHE 108 Ca -0.03 0.61 0.01 0.00 -0.05 0.00 0.00 56.93 57.47 2a1l s PHE 108 Cb -0.04 0.45 0.04 0.00 -0.63 0.00 0.00 43.02 42.84 2a1l s PHE 108 CO -0.01 -0.30 -0.10 0.42 -0.05 0.00 0.00 175.22 175.18 2a1l s ILE 109 N -0.96 1.60 -0.17 -4.49 1.01 -0.49 -1.37 121.20 116.33 2a1l s ILE 109 Ca -0.00 -0.97 -0.03 0.00 0.00 0.00 0.00 60.65 59.65 2a1l s ILE 109 Cb -0.01 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 40.76 2a1l s ILE 109 CO -0.00 0.17 -0.06 -0.75 0.00 0.00 0.00 174.94 174.30 2a1l s LYS 110 N 1.41 3.55 -0.18 2.79 2.20 0.18 -0.19 119.74 129.51 2a1l s LYS 110 Ca -0.01 -0.58 0.01 0.00 -0.36 0.00 0.00 55.97 55.03 2a1l s LYS 110 Cb -0.16 -2.88 0.03 0.00 -1.51 0.00 0.00 37.83 33.30 2a1l s LYS 110 CO -0.08 0.14 -0.17 0.42 -0.36 0.00 0.00 175.35 175.29 2a1l s ILE 111 N 0.62 1.92 -0.16 5.43 1.09 -0.02 -0.48 121.20 129.59 2a1l s ILE 111 Ca -0.04 -0.93 0.01 0.00 -1.10 0.00 0.00 60.65 58.60 2a1l s ILE 111 Cb -0.15 -1.79 0.01 0.00 -1.06 0.00 0.00 42.46 39.47 2a1l s ILE 111 CO 0.03 0.45 -0.18 -1.61 -0.10 0.00 0.00 174.94 173.53 2a1l s GLU 112 N 1.33 3.11 -0.05 2.79 2.02 -0.16 -0.64 118.70 127.09 2a1l s GLU 112 Ca 0.03 -0.79 0.05 0.00 0.02 0.00 0.00 54.97 54.29 2a1l s GLU 112 Cb -0.14 -2.59 -0.01 0.00 0.10 0.00 0.00 34.13 31.49 2a1l s GLU 112 CO -0.11 -0.08 -0.21 0.99 0.02 0.00 0.00 175.26 175.86 2a1l s THR 113 N 1.03 1.75 -0.11 3.63 2.01 -0.16 -0.29 115.64 123.49 2a1l s THR 113 Ca -0.02 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.11 2a1l s THR 113 Cb -0.15 -1.49 -0.01 0.00 0.01 0.00 0.00 72.50 70.87 2a1l s THR 113 CO -0.05 0.49 -0.17 0.26 -0.69 0.00 0.00 174.62 174.46 2a1l s TRP 114 N -0.07 2.71 -0.29 4.92 0.52 -0.89 -1.19 118.94 124.66 2a1l s TRP 114 Ca -0.04 -0.73 -0.07 0.00 0.02 0.00 0.00 56.10 55.29 2a1l s TRP 114 Cb -0.13 -1.77 0.00 0.00 -1.15 0.00 0.00 33.47 30.42 2a1l s TRP 114 CO 0.03 -0.24 0.08 -1.01 0.02 0.00 0.00 176.95 175.83 2a1l s HIS 115 N 0.23 3.13 0.17 -1.98 3.76 -0.25 -0.93 115.29 119.43 2a1l s HIS 115 Ca -0.11 -0.88 0.11 0.00 -0.15 0.00 0.00 55.06 54.03 2a1l s HIS 115 Cb -0.16 -2.25 -0.04 0.00 1.11 0.00 0.00 32.58 31.24 2a1l s HIS 115 CO 0.06 -0.54 -0.24 0.15 -0.85 0.00 0.00 174.74 173.32 2a1l s LYS 116 N 1.52 1.45 -1.47 1.40 -0.14 -0.58 -4.87 119.74 117.05 2a1l s LYS 116 Ca 0.03 -1.46 -0.09 0.00 -1.36 0.00 0.00 55.97 53.09 2a1l s LYS 116 Cb -0.17 -1.78 0.02 0.00 -1.68 0.00 0.00 37.83 34.23 2a1l s LYS 116 CO 0.03 0.39 2.55 -0.35 -0.76 0.00 0.00 175.35 177.21 2a1l n PRO 117 N 0.43 3.86 -0.77 -1.68 -0.04 -1.26 -0.65 135.00 134.89 2a1l n PRO 117 Ca -0.14 -2.81 0.00 0.00 -0.04 0.00 0.00 63.50 60.51 2a1l n PRO 117 Cb 0.55 -2.83 0.00 0.00 -0.04 0.00 0.00 33.50 31.18 2a1l n PRO 117 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2a1l n ASP 118 N 3.37 0.00 -2.25 3.54 5.68 -1.26 -4.85 116.55 120.79 2a1l n ASP 118 Ca 0.65 -0.50 -0.26 0.00 -0.50 0.00 0.00 54.79 54.18 2a1l n ASP 118 Cb 0.27 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.27 2a1l n ASP 118 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2a1l n LEU 119 N 0.00 4.96 -2.37 -2.12 4.77 -1.26 -2.96 117.00 118.02 2a1l n LEU 119 Ca 0.00 -4.94 -0.14 0.00 -0.03 0.00 0.00 56.01 50.90 2a1l n LEU 119 Cb 0.00 -0.42 0.05 0.00 -2.33 0.00 0.00 43.42 40.71 2a1l n LEU 119 CO 0.00 2.14 0.14 0.61 -1.33 0.00 0.00 177.39 178.95 2a1l n GLY 120 N -0.61 0.05 0.00 -0.72 0.00 -1.26 -4.95 105.19 97.70 2a1l n GLY 120 Ca 0.43 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 46.39 2a1l n GLY 120 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2a1l n THR 121 N -3.90 0.00 -1.87 2.61 -2.24 -1.26 -5.00 114.28 102.62 2a1l n THR 121 Ca -0.01 -0.27 -0.40 0.00 -2.27 0.00 0.00 64.05 61.10 2a1l n THR 121 Cb 0.54 0.40 0.01 0.00 -2.10 0.00 0.00 70.33 69.19 2a1l n THR 121 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2a1l s LEU 122 N -3.58 4.11 -0.15 3.22 1.43 -1.26 -5.00 118.68 117.45 2a1l s LEU 122 Ca -0.02 2.82 0.01 0.00 -1.03 0.00 0.00 54.13 55.91 2a1l s LEU 122 Cb 0.09 -3.97 0.00 0.00 0.03 0.00 0.00 46.19 42.34 2a1l s LEU 122 CO 0.54 -1.13 -0.17 -1.61 0.23 0.00 0.00 176.35 174.20 2a1l s GLU 123 N -2.45 3.15 -1.18 1.70 0.41 -1.26 -4.67 118.70 114.40 2a1l s GLU 123 Ca 0.61 -0.78 -0.07 0.00 -0.41 0.00 0.00 54.97 54.32 2a1l s GLU 123 Cb -0.42 -2.56 0.01 0.00 -1.78 0.00 0.00 34.13 29.38 2a1l s GLU 123 CO 0.53 0.01 1.02 -1.71 -0.49 0.00 0.00 175.26 174.62 2a1l n ASN 124 N 4.05 -5.43 0.09 -0.19 5.15 -1.26 -4.89 115.26 112.79 2a1l n ASN 124 Ca -0.19 -0.48 0.20 0.00 -0.60 0.00 0.00 54.58 53.51 2a1l n ASN 124 Cb 0.52 -4.49 0.75 0.00 -0.53 0.00 0.00 39.78 36.03 2a1l n ASN 124 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 2a1l h VAL 125 N -2.30 0.44 -0.07 3.44 3.04 -2.00 0.56 116.25 119.35 2a1l h VAL 125 Ca -0.50 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 2a1l h VAL 125 Cb 1.32 0.69 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 2a1l h VAL 125 CO 0.48 0.00 0.00 1.41 -1.01 0.00 0.00 177.57 178.45 2a1l n HIS 126 N -3.82 0.08 -3.97 3.17 8.25 -1.26 -4.93 115.22 112.74 2a1l n HIS 126 Ca 0.07 -0.04 -0.31 0.00 -0.26 0.00 0.00 57.72 57.18 2a1l n HIS 126 Cb 0.58 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.70 2a1l n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2a1l n GLY 127 N 0.97 -0.47 3.74 -1.41 0.00 0.20 -4.97 105.19 103.25 2a1l n GLY 127 Ca 0.16 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 46.06 2a1l n GLY 127 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a1l s LEU 128 N -7.25 2.29 0.13 0.99 1.43 -1.26 -4.92 118.68 110.09 2a1l s LEU 128 Ca 0.64 1.39 -0.34 0.00 -1.03 0.00 0.00 54.13 54.78 2a1l s LEU 128 Cb -0.33 -3.84 -0.14 0.00 0.03 0.00 0.00 46.19 41.91 2a1l s LEU 128 CO 0.85 -2.49 1.55 -0.67 0.23 0.00 0.00 176.35 175.83 2a1l n ASP 129 N -3.78 2.87 -0.30 2.29 2.03 -1.26 -4.71 116.55 113.69 2a1l n ASP 129 Ca 0.07 1.08 0.11 0.00 0.52 0.00 0.00 54.79 56.57 2a1l n ASP 129 Cb 0.56 -1.38 0.25 0.00 -0.72 0.00 0.00 41.12 39.82 2a1l n ASP 129 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2a1l h PRO 130 N 5.87 0.12 -0.18 -0.67 0.11 -1.98 0.47 132.00 135.73 2a1l h PRO 130 Ca -0.46 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 65.47 2a1l h PRO 130 Cb 1.27 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2a1l h PRO 130 CO 0.87 0.08 -0.60 -0.91 -0.21 0.00 0.00 178.00 177.23 2a1l h ASN 131 N 0.12 0.67 -0.23 -2.05 2.35 -2.00 -2.63 115.58 111.82 2a1l h ASN 131 Ca 0.52 -0.38 -0.08 0.00 -0.55 0.00 0.00 56.30 55.80 2a1l h ASN 131 Cb 1.02 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 39.19 2a1l h ASN 131 CO -0.73 1.12 -0.19 0.74 -1.65 0.00 0.00 177.43 176.72 2a1l h THR 132 N 0.45 1.32 -0.90 2.81 2.02 -1.51 -3.03 112.91 114.07 2a1l h THR 132 Ca -0.00 -1.33 0.16 0.00 0.77 0.00 0.00 66.41 66.01 2a1l h THR 132 Cb 1.16 1.67 -0.07 0.00 -1.74 0.00 0.00 68.15 69.17 2a1l h THR 132 CO 0.11 0.41 0.58 -0.25 0.37 0.00 0.00 175.52 176.75 2a1l h TRP 133 N 0.23 0.77 0.00 3.16 2.91 -0.06 0.11 115.95 123.06 2a1l h TRP 133 Ca 0.04 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.08 2a1l h TRP 133 Cb 0.73 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 29.14 2a1l h TRP 133 CO 0.07 0.25 0.00 1.63 -1.03 0.00 0.00 178.44 179.37 2a1l n LYS 134 N -4.57 0.01 -0.10 2.65 5.02 -1.00 -1.69 118.16 118.48 2a1l n LYS 134 Ca 0.18 0.31 0.09 0.00 -2.02 0.00 0.00 58.31 56.87 2a1l n LYS 134 Cb 0.53 -1.50 0.13 0.00 -0.02 0.00 0.00 35.03 34.18 2a1l n LYS 134 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2a1l n THR 135 N -1.49 0.37 -3.20 -0.18 -2.24 0.36 -4.94 114.28 102.97 2a1l n THR 135 Ca 0.03 -0.69 -0.39 0.00 -2.27 0.00 0.00 64.05 60.73 2a1l n THR 135 Cb 0.12 1.04 -0.06 0.00 -2.10 0.00 0.00 70.33 69.33 2a1l n THR 135 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2a1l s VAL 136 N -1.27 5.10 0.07 2.28 1.01 -0.68 -4.90 120.40 122.01 2a1l s VAL 136 Ca 0.26 1.10 -0.30 0.00 0.00 0.00 0.00 61.98 63.04 2a1l s VAL 136 Cb 0.16 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 2a1l s VAL 136 CO 0.22 0.21 0.98 -0.70 0.00 0.00 0.00 175.10 175.81 2a1l s GLU 137 N 1.29 4.64 -0.26 2.72 2.12 -1.21 -4.86 118.70 123.15 2a1l s GLU 137 Ca 0.28 1.45 -0.11 0.00 0.36 0.00 0.00 54.97 56.95 2a1l s GLU 137 Cb -0.16 -3.40 -0.05 0.00 0.26 0.00 0.00 34.13 30.78 2a1l s GLU 137 CO 0.11 0.10 0.20 0.42 -0.54 0.00 0.00 175.26 175.56 2a1l s ILE 138 N 0.39 5.32 -0.22 -3.70 -1.09 -1.26 -0.29 121.20 120.34 2a1l s ILE 138 Ca 0.49 0.23 -0.03 0.00 -2.23 0.00 0.00 60.65 59.11 2a1l s ILE 138 Cb -0.23 -3.54 0.00 0.00 -1.58 0.00 0.00 42.46 37.12 2a1l s ILE 138 CO 0.29 0.28 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.53 2a1l s VAL 139 N 1.46 3.07 -0.42 2.92 1.01 0.90 -4.96 120.40 124.38 2a1l s VAL 139 Ca 0.08 -0.66 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 2a1l s VAL 139 Cb -0.15 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.84 2a1l s VAL 139 CO 0.08 0.40 0.60 -1.00 0.00 0.00 0.00 175.10 175.18 2a1l s HIS 140 N 1.42 3.10 -0.24 5.22 3.76 -1.26 -0.17 115.29 127.12 2a1l s HIS 140 Ca 0.05 -0.04 -0.19 0.00 -0.15 0.00 0.00 55.06 54.73 2a1l s HIS 140 Cb -0.14 -3.22 -0.03 0.00 1.11 0.00 0.00 32.58 30.30 2a1l s HIS 140 CO -0.05 -0.79 0.54 0.42 -0.85 0.00 0.00 174.74 174.01 2a1l s ILE 141 N 2.66 5.07 -0.36 0.60 1.01 0.35 -4.95 121.20 125.58 2a1l s ILE 141 Ca 0.21 0.95 -0.05 0.00 0.00 0.00 0.00 60.65 61.76 2a1l s ILE 141 Cb -0.15 -3.85 0.07 0.00 0.01 0.00 0.00 42.46 38.54 2a1l s ILE 141 CO 0.17 0.11 0.13 -0.62 0.00 0.00 0.00 174.94 174.73 2a1l s ASP 142 N 1.38 5.24 0.00 3.58 -1.08 -1.26 -3.90 116.67 120.64 2a1l s ASP 142 Ca 0.23 -1.46 0.09 0.00 -0.52 0.00 0.00 52.55 50.89 2a1l s ASP 142 Cb -0.16 -1.84 0.42 0.00 -1.46 0.00 0.00 42.92 39.88 2a1l s ASP 142 CO 0.09 -0.40 1.21 2.30 0.52 0.00 0.00 175.17 178.90 2a1l n ILE 143 N 4.73 1.07 0.36 4.11 -5.35 -1.26 -1.84 119.36 121.18 2a1l n ILE 143 Ca -0.10 0.27 0.11 0.00 -0.27 0.00 0.00 62.75 62.76 2a1l n ILE 143 Cb 0.43 -1.12 -0.12 0.00 -1.74 0.00 0.00 39.64 37.09 2a1l n ILE 143 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2a1l n ALA 144 N -1.38 3.42 -2.53 -1.28 0.00 -1.26 -4.43 120.51 113.05 2a1l n ALA 144 Ca 0.03 -0.51 -0.42 0.00 0.00 0.00 0.00 53.44 52.54 2a1l n ALA 144 Cb 0.08 -0.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 2a1l n ALA 144 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2a1l s ASP 145 N -4.05 6.40 0.51 0.00 3.68 -0.76 -4.62 116.67 117.83 2a1l s ASP 145 Ca -0.02 0.22 0.18 0.00 2.13 0.00 0.00 52.55 55.07 2a1l s ASP 145 Cb 0.14 -2.55 1.30 0.00 -1.45 0.00 0.00 42.92 40.37 2a1l s ASP 145 CO 0.88 -1.50 2.13 -0.09 0.13 0.00 0.00 175.17 176.72 2a1l h ARG 146 N 9.86 0.00 0.00 4.34 9.65 -1.90 -2.20 114.38 134.14 2a1l h ARG 146 Ca -0.25 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.62 2a1l h ARG 146 Cb 1.07 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.64 2a1l h ARG 146 CO 1.17 0.05 -0.04 0.66 2.80 0.00 0.00 179.97 184.60 2a1l h SER 147 N 0.00 0.00 -0.07 -3.80 4.64 -1.96 -2.52 113.55 109.84 2a1l h SER 147 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a1l h SER 147 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2a1l h SER 147 CO 0.01 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 2a1l n GLN 148 N -3.18 1.48 -4.09 4.77 6.02 -0.83 -4.84 117.38 116.72 2a1l n GLN 148 Ca -0.00 -0.71 -0.36 0.00 -0.01 0.00 0.00 57.00 55.92 2a1l n GLN 148 Cb 0.30 -1.41 -0.08 0.00 1.02 0.00 0.00 30.24 30.07 2a1l n GLN 148 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2a1l s VAL 149 N -1.91 4.89 -0.01 5.09 1.01 -0.95 -4.99 120.40 123.53 2a1l s VAL 149 Ca 0.35 -0.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.01 2a1l s VAL 149 Cb 0.18 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 2a1l s VAL 149 CO 0.28 0.57 1.14 -1.61 0.00 0.00 0.00 175.10 175.49 2a1l s GLU 150 N -0.57 4.42 0.35 2.72 2.02 -1.26 -4.91 118.70 121.47 2a1l s GLU 150 Ca 0.11 1.64 0.15 0.00 0.02 0.00 0.00 54.97 56.89 2a1l s GLU 150 Cb -0.12 -3.46 1.13 0.00 0.10 0.00 0.00 34.13 31.78 2a1l s GLU 150 CO 0.02 -0.30 1.63 -1.35 0.02 0.00 0.00 175.26 175.29 2a1l h PRO 151 N 7.07 0.20 0.00 0.39 0.11 -1.97 0.47 132.00 138.27 2a1l h PRO 151 Ca -0.38 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.68 2a1l h PRO 151 Cb 1.19 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2a1l h PRO 151 CO 0.83 0.13 -0.20 0.00 -0.21 0.00 0.00 178.00 178.55 2a1l h ALA 152 N 1.90 1.24 0.00 -0.75 0.00 -2.03 -2.99 119.26 116.63 2a1l h ALA 152 Ca 0.75 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2a1l h ALA 152 Cb 1.79 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.55 2a1l h ALA 152 CO -0.67 0.25 -1.08 -0.25 0.00 0.00 0.00 179.25 177.50 2a1l n ASP 153 N -3.68 0.77 -4.70 0.00 8.00 0.16 -4.96 116.55 112.14 2a1l n ASP 153 Ca -0.01 0.29 -0.44 0.00 0.71 0.00 0.00 54.79 55.33 2a1l n ASP 153 Cb 0.32 0.58 -0.03 0.00 -0.02 0.00 0.00 41.12 41.97 2a1l n ASP 153 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a1l n TYR 154 N -2.61 2.51 -3.68 1.24 9.36 -0.91 -5.00 117.16 118.06 2a1l n TYR 154 Ca -0.00 0.23 -0.18 0.00 3.32 0.00 0.00 57.90 61.27 2a1l n TYR 154 Cb 0.55 -2.58 -0.17 0.00 -0.63 0.00 0.00 39.34 36.51 2a1l n TYR 154 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 2a1l s LYS 155 N 0.45 -0.03 0.57 2.98 1.02 -1.26 -5.03 119.74 118.43 2a1l s LYS 155 Ca 0.73 0.42 0.26 0.00 0.02 0.00 0.00 55.97 57.39 2a1l s LYS 155 Cb -0.59 -0.40 1.65 0.00 -0.52 0.00 0.00 37.83 37.98 2a1l s LYS 155 CO 0.41 -0.30 2.21 0.00 -0.92 0.00 0.00 175.35 176.75 2a1l h ALA 156 N 8.25 1.69 -0.10 5.17 0.00 -1.97 -0.34 119.26 131.97 2a1l h ALA 156 Ca -0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2a1l h ALA 156 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2a1l h ALA 156 CO 0.19 -0.03 0.00 -0.40 0.00 0.00 0.00 179.25 179.02 2a1l n ASP 157 N -4.05 1.00 -0.47 0.00 5.75 -1.26 -3.09 116.55 114.44 2a1l n ASP 157 Ca -0.03 -1.59 0.06 0.00 -0.01 0.00 0.00 54.79 53.22 2a1l n ASP 157 Cb 0.10 -0.06 0.09 0.00 -1.03 0.00 0.00 41.12 40.23 2a1l n ASP 157 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2a1l n GLU 158 N -0.12 0.79 -3.27 0.11 1.02 -0.15 -4.99 120.64 114.03 2a1l n GLU 158 Ca 0.15 -2.16 -0.45 0.00 -0.02 0.00 0.00 57.16 54.69 2a1l n GLU 158 Cb 0.22 -1.03 -0.06 0.00 -0.02 0.00 0.00 31.44 30.55 2a1l n GLU 158 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2a1l s ASP 159 N -2.27 6.18 0.28 1.62 -1.08 -1.11 -4.55 116.67 115.74 2a1l s ASP 159 Ca 0.24 -1.40 0.19 0.00 -0.52 0.00 0.00 52.55 51.06 2a1l s ASP 159 Cb 0.22 -2.23 1.02 0.00 -1.46 0.00 0.00 42.92 40.47 2a1l s ASP 159 CO -0.02 -0.84 1.59 -0.81 0.52 0.00 0.00 175.17 175.61 2a1l n PRO 160 N 5.62 0.13 0.00 4.34 -0.04 -1.26 -0.20 135.00 143.59 2a1l n PRO 160 Ca -0.11 0.60 0.15 0.00 -0.04 0.00 0.00 63.50 64.10 2a1l n PRO 160 Cb 0.43 -1.90 0.76 0.00 -0.04 0.00 0.00 33.50 32.75 2a1l n PRO 160 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a1l n ALA 161 N -1.74 2.65 -0.83 0.55 0.00 -1.26 -1.20 120.51 118.67 2a1l n ALA 161 Ca -0.01 -0.23 0.01 0.00 0.00 0.00 0.00 53.44 53.21 2a1l n ALA 161 Cb 0.05 -1.42 0.02 0.00 0.00 0.00 0.00 19.45 18.10 2a1l n ALA 161 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2a1l n LEU 162 N -0.93 0.91 -4.33 0.00 4.77 0.72 -4.49 117.00 113.64 2a1l n LEU 162 Ca 0.18 -1.14 -0.30 0.00 -0.03 0.00 0.00 56.01 54.72 2a1l n LEU 162 Cb 0.22 -0.05 -0.15 0.00 -2.33 0.00 0.00 43.42 41.11 2a1l n LEU 162 CO 0.21 0.28 -0.56 0.12 -1.33 0.00 0.00 177.39 176.10 2a1l s PHE 163 N -0.65 2.26 -0.05 -1.77 5.36 -0.97 -4.95 117.98 117.21 2a1l s PHE 163 Ca 0.04 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 55.61 2a1l s PHE 163 Cb 0.03 -1.36 0.02 0.00 -0.34 0.00 0.00 43.02 41.37 2a1l s PHE 163 CO 0.00 0.11 -0.08 -1.14 -1.46 0.00 0.00 175.22 172.66 2a1l s GLN 164 N -1.19 1.18 0.17 10.12 0.74 -1.26 -1.71 119.66 127.71 2a1l s GLN 164 Ca 0.11 -0.24 -0.30 0.00 0.05 0.00 0.00 55.36 54.98 2a1l s GLN 164 Cb -0.10 -1.06 -0.08 0.00 1.10 0.00 0.00 33.01 32.87 2a1l s GLN 164 CO 0.02 -0.02 1.24 0.45 -0.55 0.00 0.00 175.29 176.42 2a1l s SER 165 N 0.76 7.02 0.10 6.67 0.15 -1.09 -4.95 113.70 122.35 2a1l s SER 165 Ca -0.12 2.26 0.01 0.00 0.70 0.00 0.00 55.95 58.80 2a1l s SER 165 Cb -0.15 -2.60 -0.24 0.00 -1.71 0.00 0.00 66.02 61.31 2a1l s SER 165 CO 0.02 -0.44 1.21 0.58 1.20 0.00 0.00 173.24 175.81 2a1l h VAL 166 N 3.84 1.59 0.00 4.45 2.07 -1.95 -1.04 116.25 125.22 2a1l h VAL 166 Ca -0.44 -3.21 0.00 0.00 0.82 0.00 0.00 66.70 63.87 2a1l h VAL 166 Cb 1.21 2.89 0.00 0.00 -1.52 0.00 0.00 31.29 33.88 2a1l h VAL 166 CO 0.76 0.93 -0.79 0.29 0.02 0.00 0.00 177.57 178.78 2a1l n LYS 167 N -3.46 0.28 0.00 1.57 5.02 -1.26 -4.36 118.16 115.96 2a1l n LYS 167 Ca -0.05 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2a1l n LYS 167 Cb 0.98 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 2a1l n LYS 167 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2a1l n THR 168 N -2.03 0.00 -0.94 -0.18 -2.24 -1.26 -5.00 114.28 102.63 2a1l n THR 168 Ca 0.03 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2a1l n THR 168 Cb 0.44 0.62 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 2a1l n THR 168 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2a1l n LYS 169 N -0.85 -1.06 -1.77 -0.78 4.01 -0.39 -4.86 118.16 112.46 2a1l n LYS 169 Ca 0.00 0.26 -0.19 0.00 -0.51 0.00 0.00 58.31 57.87 2a1l n LYS 169 Cb 0.00 -4.21 -0.07 0.00 -0.51 0.00 0.00 35.03 30.24 2a1l n LYS 169 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2a1l s ARG 170 N -1.18 1.89 0.45 1.97 0.52 -1.26 -4.69 118.95 116.65 2a1l s ARG 170 Ca 0.00 -0.09 -0.06 0.00 -0.52 0.00 0.00 55.73 55.06 2a1l s ARG 170 Cb 0.00 -4.95 0.09 0.00 0.52 0.00 0.00 34.95 30.61 2a1l s ARG 170 CO 0.00 -4.29 0.21 0.41 0.02 0.00 0.00 175.30 171.65 2a1l n GLY 171 N 6.59 -2.13 3.76 -3.53 0.00 -1.26 -2.68 105.19 105.94 2a1l n GLY 171 Ca 0.44 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 2a1l n GLY 171 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2a1l s PRO 172 N -2.54 4.18 -0.57 1.61 0.04 -0.69 -4.61 135.00 132.41 2a1l s PRO 172 Ca 0.16 2.47 -0.28 0.00 0.04 0.00 0.00 61.00 63.39 2a1l s PRO 172 Cb -0.03 -3.02 0.02 0.00 0.04 0.00 0.00 34.50 31.51 2a1l s PRO 172 CO 0.13 -0.48 1.28 -0.51 0.04 0.00 0.00 177.00 177.47 2a1l s LEU 173 N -1.37 3.43 1.05 -3.56 1.43 -0.34 -4.97 118.68 114.34 2a1l s LEU 173 Ca 0.56 0.19 -0.17 0.00 -1.03 0.00 0.00 54.13 53.68 2a1l s LEU 173 Cb -0.45 -3.13 0.23 0.00 0.03 0.00 0.00 46.19 42.87 2a1l s LEU 173 CO 0.54 -1.57 1.23 -0.83 0.23 0.00 0.00 176.35 175.95 2a1l s GLY 174 N 3.55 1.69 0.36 -3.19 0.00 -1.26 -4.26 107.32 104.21 2a1l s GLY 174 Ca 0.47 -1.04 0.10 0.00 0.00 0.00 0.00 44.72 44.24 2a1l s GLY 174 CO 0.25 -0.25 1.85 -2.55 0.00 0.00 0.00 173.10 172.40 2a1l h PRO 175 N -1.97 0.64 -0.60 2.90 0.11 -1.95 -2.50 132.00 128.63 2a1l h PRO 175 Ca -0.45 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 2a1l h PRO 175 Cb 1.27 -0.14 -0.13 0.00 0.11 0.00 0.00 31.00 32.10 2a1l h PRO 175 CO 0.39 0.42 0.20 0.09 -0.21 0.00 0.00 178.00 178.90 2a1l n ASN 176 N -4.58 3.95 -0.30 -2.05 3.02 -1.26 -4.69 115.26 109.35 2a1l n ASN 176 Ca 0.19 -3.38 0.07 0.00 -0.03 0.00 0.00 54.58 51.43 2a1l n ASN 176 Cb 0.52 -0.70 0.28 0.00 -0.61 0.00 0.00 39.78 39.27 2a1l n ASN 176 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 2a1l h TRP 177 N 1.87 1.00 0.75 3.10 5.08 -1.79 -2.05 115.95 123.90 2a1l h TRP 177 Ca 0.27 0.03 -0.04 0.00 1.08 0.00 0.00 58.89 60.23 2a1l h TRP 177 Cb 2.11 -0.32 0.00 0.00 -3.00 0.00 0.00 29.16 27.95 2a1l h TRP 177 CO 1.14 0.46 -0.38 -0.22 -1.28 0.00 0.00 178.44 178.15 2a1l h LYS 178 N 0.92 -1.00 -0.70 0.12 3.64 -1.85 0.14 116.57 117.83 2a1l h LYS 178 Ca 0.43 0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.92 2a1l h LYS 178 Cb 0.40 0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 32.41 2a1l h LYS 178 CO -0.19 -0.67 0.46 0.87 -2.27 0.00 0.00 179.45 177.66 2a1l h LYS 179 N -1.04 0.79 0.23 1.90 1.79 -1.91 -0.32 116.57 118.01 2a1l h LYS 179 Ca -0.10 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.31 2a1l h LYS 179 Cb 0.81 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 2a1l h LYS 179 CO 0.15 0.53 -0.11 0.93 -1.08 0.00 0.00 179.45 179.87 2a1l h GLU 180 N 0.82 -0.30 -0.93 3.15 5.08 -1.05 -2.59 114.58 118.76 2a1l h GLU 180 Ca 0.29 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.76 2a1l h GLU 180 Cb 0.12 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.36 2a1l h GLU 180 CO -0.09 -0.14 0.60 1.25 -1.00 0.00 0.00 179.01 179.63 2a1l h LEU 181 N -0.38 0.87 -0.64 1.33 6.46 -0.15 -2.01 115.31 120.79 2a1l h LEU 181 Ca -0.03 0.03 0.12 0.00 -0.12 0.00 0.00 57.88 57.87 2a1l h LEU 181 Cb 0.29 -0.15 -0.09 0.00 -0.73 0.00 0.00 40.66 39.98 2a1l h LEU 181 CO 0.05 0.51 0.18 0.00 -0.62 0.00 0.00 178.44 178.55 2a1l h ALA 182 N 1.54 0.81 -0.50 1.25 0.00 -0.68 -0.41 119.26 121.26 2a1l h ALA 182 Ca 0.43 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2a1l h ALA 182 Cb 0.39 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2a1l h ALA 182 CO -0.19 -0.28 0.00 0.09 0.00 0.00 0.00 179.25 178.87 2a1l n ASN 183 N -5.09 4.89 -3.76 0.00 3.02 -0.80 -4.67 115.26 108.83 2a1l n ASN 183 Ca 0.10 -2.72 -0.30 0.00 -0.03 0.00 0.00 54.58 51.64 2a1l n ASN 183 Cb 0.35 -0.64 -0.09 0.00 -0.61 0.00 0.00 39.78 38.79 2a1l n ASN 183 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2a1l n THR 184 N 0.61 2.36 -0.15 3.41 -1.04 -0.16 -5.08 114.28 114.23 2a1l n THR 184 Ca 0.23 -5.11 -0.12 0.00 -2.04 0.00 0.00 64.05 57.02 2a1l n THR 184 Cb 1.01 -2.18 -0.03 0.00 -1.82 0.00 0.00 70.33 67.31 2a1l n THR 184 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2a1l n PRO 185 N 1.56 0.07 -0.01 -2.82 -0.02 -1.26 -4.78 135.00 127.73 2a1l n PRO 185 Ca 0.24 -0.66 0.00 0.00 -2.02 0.00 0.00 63.50 61.07 2a1l n PRO 185 Cb 0.37 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2a1l n PRO 185 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a1l s PRO 188 N -0.02 3.09 0.02 0.00 0.04 -1.26 -5.03 135.00 131.83 2a1l s PRO 188 Ca 0.00 1.65 -0.16 0.00 0.04 0.00 0.00 61.00 62.54 2a1l s PRO 188 Cb 0.00 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.60 2a1l s PRO 188 CO 0.00 -1.07 0.34 -1.59 0.04 0.00 0.00 177.00 174.72 2a1l s LYS 189 N -3.46 0.78 0.14 4.56 -2.85 -1.19 -3.44 119.74 114.29 2a1l s LYS 189 Ca 0.73 -0.32 -0.25 0.00 -1.00 0.00 0.00 55.97 55.13 2a1l s LYS 189 Cb -0.26 0.34 0.07 0.00 -2.06 0.00 0.00 37.83 35.93 2a1l s LYS 189 CO 0.32 -0.24 1.02 0.00 0.10 0.00 0.00 175.35 176.55 2a1l s MET 190 N -1.99 1.12 -0.16 1.78 0.23 -1.08 -4.19 119.30 115.01 2a1l s MET 190 Ca -0.09 -0.64 -0.09 0.00 -1.03 0.00 0.00 55.69 53.84 2a1l s MET 190 Cb -0.03 0.37 0.05 0.00 -1.53 0.00 0.00 34.83 33.69 2a1l s MET 190 CO 0.00 -0.51 0.39 0.00 -2.03 0.00 0.00 175.02 172.87 2a1l s ALA 192 N 1.25 3.55 -0.52 0.00 0.00 -0.42 -1.53 121.76 124.09 2a1l s ALA 192 Ca -0.08 -0.93 -0.16 0.00 0.00 0.00 0.00 51.96 50.79 2a1l s ALA 192 Cb -0.08 -2.62 0.11 0.00 0.00 0.00 0.00 23.12 20.53 2a1l s ALA 192 CO -0.11 -0.61 0.48 0.71 0.00 0.00 0.00 175.76 176.23 2a1l s TYR 193 N 1.94 3.23 -0.46 0.00 1.51 -0.11 -1.32 117.35 122.14 2a1l s TYR 193 Ca 0.12 -1.14 -0.15 0.00 -1.01 0.00 0.00 57.07 54.89 2a1l s TYR 193 Cb -0.16 -3.59 0.06 0.00 -0.11 0.00 0.00 41.96 38.16 2a1l s TYR 193 CO 0.10 -0.96 0.37 0.15 -1.11 0.00 0.00 175.55 174.10 2a1l s LYS 194 N 1.69 2.94 -0.30 -0.62 1.02 0.69 -2.09 119.74 123.08 2a1l s LYS 194 Ca 0.04 -1.30 -0.21 0.00 0.02 0.00 0.00 55.97 54.51 2a1l s LYS 194 Cb -0.28 -4.07 -0.01 0.00 -0.52 0.00 0.00 37.83 32.95 2a1l s LYS 194 CO 0.05 -0.97 0.68 -1.17 -0.92 0.00 0.00 175.35 173.01 2a1l s LEU 195 N 1.63 4.12 -0.21 3.17 2.96 0.60 0.01 118.68 130.95 2a1l s LEU 195 Ca 0.04 0.54 -0.03 0.00 -0.22 0.00 0.00 54.13 54.46 2a1l s LEU 195 Cb -0.23 -2.90 -0.01 0.00 0.50 0.00 0.00 46.19 43.55 2a1l s LEU 195 CO 0.07 -0.50 -0.06 -0.69 -1.32 0.00 0.00 176.35 173.85 2a1l s VAL 196 N 2.70 3.25 -0.23 1.68 1.01 0.12 -0.99 120.40 127.94 2a1l s VAL 196 Ca 0.27 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.69 2a1l s VAL 196 Cb -0.15 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2a1l s VAL 196 CO 0.11 0.44 -0.05 -0.89 0.00 0.00 0.00 175.10 174.71 2a1l s THR 197 N 1.42 3.16 -0.06 3.92 2.01 0.36 -1.38 115.64 125.07 2a1l s THR 197 Ca 0.05 -0.68 0.04 0.00 0.31 0.00 0.00 61.69 61.41 2a1l s THR 197 Cb -0.14 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.86 2a1l s THR 197 CO -0.04 0.36 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.44 2a1l s ILE 198 N 1.42 2.78 -0.05 1.82 -1.09 0.13 -0.65 121.20 125.57 2a1l s ILE 198 Ca 0.04 -0.82 -0.00 0.00 -2.23 0.00 0.00 60.65 57.64 2a1l s ILE 198 Cb -0.15 -2.07 0.03 0.00 -1.58 0.00 0.00 42.46 38.68 2a1l s ILE 198 CO -0.04 0.58 0.00 -0.75 -1.23 0.00 0.00 174.94 173.50 2a1l s LYS 199 N -0.51 0.45 -0.40 2.79 2.20 -0.47 -0.50 119.74 123.30 2a1l s LYS 199 Ca 0.07 0.09 0.03 0.00 -0.36 0.00 0.00 55.97 55.80 2a1l s LYS 199 Cb -0.12 -0.71 0.16 0.00 -1.51 0.00 0.00 37.83 35.65 2a1l s LYS 199 CO 0.01 -0.21 0.32 0.12 -0.36 0.00 0.00 175.35 175.24 2a1l s PHE 200 N 1.46 0.81 -0.41 4.03 5.36 -1.25 -1.26 117.98 126.71 2a1l s PHE 200 Ca -0.03 -1.99 -0.29 0.00 -0.96 0.00 0.00 56.93 53.65 2a1l s PHE 200 Cb -0.13 -0.84 0.02 0.00 -0.34 0.00 0.00 43.02 41.73 2a1l s PHE 200 CO -0.03 -0.85 1.26 0.21 -1.46 0.00 0.00 175.22 174.35 2a1l s LYS 201 N 0.44 3.73 -0.30 10.12 2.20 0.77 -4.13 119.74 132.57 2a1l s LYS 201 Ca 0.28 0.85 0.00 0.00 -0.36 0.00 0.00 55.97 56.75 2a1l s LYS 201 Cb -0.05 -3.93 0.19 0.00 -1.51 0.00 0.00 37.83 32.54 2a1l s LYS 201 CO -0.13 -1.37 0.66 -0.46 -0.36 0.00 0.00 175.35 173.70 2a1l s TRP 202 N 4.74 -1.56 -0.09 4.03 -0.11 -1.26 -4.89 118.94 119.81 2a1l s TRP 202 Ca 0.54 1.25 -0.38 0.00 1.22 0.00 0.00 56.10 58.73 2a1l s TRP 202 Cb -0.11 0.40 -0.16 0.00 -1.50 0.00 0.00 33.47 32.09 2a1l s TRP 202 CO 0.29 -0.88 1.52 1.87 -4.62 0.00 0.00 176.95 175.13 2a1l n TRP 203 N 5.41 1.74 0.00 5.86 -0.00 -1.26 -0.74 117.44 128.45 2a1l n TRP 203 Ca 0.02 0.61 0.00 0.00 -0.00 0.00 0.00 57.50 58.13 2a1l n TRP 203 Cb 0.53 -2.38 0.00 0.00 -0.00 0.00 0.00 31.31 29.46 2a1l n TRP 203 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2a1l n GLY 204 N 3.26 2.78 0.00 5.87 0.00 -1.26 -4.82 105.19 111.02 2a1l n GLY 204 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2a1l n GLY 204 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2a1l n LEU 205 N 0.00 0.33 0.11 0.99 4.77 0.09 -4.86 117.00 118.42 2a1l n LEU 205 Ca 0.00 -0.46 -0.16 0.00 -0.03 0.00 0.00 56.01 55.36 2a1l n LEU 205 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 2a1l n LEU 205 CO 0.00 0.08 0.54 -0.61 -1.33 0.00 0.00 177.39 176.07 2a1l h GLN 206 N 0.00 -0.69 -0.52 3.23 4.15 -1.57 0.19 115.11 119.90 2a1l h GLN 206 Ca 0.00 0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.52 2a1l h GLN 206 Cb 0.11 0.16 -0.05 0.00 0.21 0.00 0.00 27.48 27.91 2a1l h GLN 206 CO 0.00 -0.46 0.24 0.77 -1.93 0.00 0.00 178.83 177.45 2a1l h SER 207 N -0.72 0.31 0.00 -0.69 0.02 -1.90 -0.61 113.55 109.97 2a1l h SER 207 Ca 0.01 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2a1l h SER 207 Cb 0.74 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2a1l h SER 207 CO -0.28 0.21 -0.00 0.50 -1.14 0.00 0.00 176.83 176.12 2a1l h LYS 208 N 0.46 -0.00 -0.34 3.45 3.64 -1.79 -2.31 116.57 119.68 2a1l h LYS 208 Ca 0.24 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.47 2a1l h LYS 208 Cb 0.19 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2a1l h LYS 208 CO -0.19 0.08 -0.39 0.28 -2.27 0.00 0.00 179.45 176.96 2a1l h VAL 209 N -0.09 1.28 -0.54 2.00 2.07 -0.49 -0.93 116.25 119.56 2a1l h VAL 209 Ca -0.00 -1.56 -0.07 0.00 0.82 0.00 0.00 66.70 65.89 2a1l h VAL 209 Cb 0.08 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2a1l h VAL 209 CO 0.00 0.51 0.08 -0.33 0.02 0.00 0.00 177.57 177.85 2a1l h GLU 210 N 0.68 0.90 -0.54 1.57 5.08 -1.12 -0.33 114.58 120.81 2a1l h GLU 210 Ca 0.06 -0.25 -0.11 0.00 -1.00 0.00 0.00 59.36 58.06 2a1l h GLU 210 Cb 0.95 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 2a1l h GLU 210 CO 0.09 0.88 -0.10 -0.97 -1.00 0.00 0.00 179.01 177.90 2a1l h ASN 211 N 0.78 1.00 -0.55 1.42 -1.24 -1.39 -1.73 115.58 113.88 2a1l h ASN 211 Ca 0.16 -0.33 -0.01 0.00 0.71 0.00 0.00 56.30 56.84 2a1l h ASN 211 Cb 0.42 -0.27 -0.03 0.00 0.73 0.00 0.00 38.32 39.17 2a1l h ASN 211 CO 0.01 1.11 0.30 0.15 -1.29 0.00 0.00 177.43 177.72 2a1l h PHE 212 N 0.90 0.75 -0.43 0.67 3.04 -0.83 -1.11 116.94 119.93 2a1l h PHE 212 Ca 0.14 -0.02 -0.10 0.00 3.98 0.00 0.00 57.97 61.97 2a1l h PHE 212 Cb 0.66 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.92 2a1l h PHE 212 CO 0.04 0.55 -0.15 0.82 -2.02 0.00 0.00 178.31 177.55 2a1l h ILE 213 N 0.74 1.26 -0.55 1.41 2.04 -0.91 -0.70 117.51 120.80 2a1l h ILE 213 Ca 0.19 -1.24 -0.07 0.00 1.00 0.00 0.00 64.86 64.74 2a1l h ILE 213 Cb 0.04 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2a1l h ILE 213 CO -0.03 0.42 0.05 1.56 0.00 0.00 0.00 178.15 180.16 2a1l h GLN 214 N 0.72 0.93 -0.65 2.37 1.08 -1.01 0.79 115.11 119.35 2a1l h GLN 214 Ca 0.11 -0.27 0.00 0.00 -1.45 0.00 0.00 58.65 57.05 2a1l h GLN 214 Cb 0.65 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.95 2a1l h GLN 214 CO 0.05 0.92 0.42 -0.22 -0.95 0.00 0.00 178.83 179.04 2a1l h LYS 215 N 0.82 0.86 -0.12 1.46 3.64 -0.95 -0.32 116.57 121.95 2a1l h LYS 215 Ca 0.16 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.36 2a1l h LYS 215 Cb 0.46 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2a1l h LYS 215 CO 0.02 0.59 -0.44 1.96 -2.27 0.00 0.00 179.45 179.30 2a1l h GLN 216 N 0.88 0.29 -0.40 1.90 1.08 -0.74 -2.00 115.11 116.11 2a1l h GLN 216 Ca 0.24 -0.15 -0.12 0.00 -1.45 0.00 0.00 58.65 57.17 2a1l h GLN 216 Cb -0.08 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 2a1l h GLN 216 CO -0.05 0.68 -0.23 0.93 -0.95 0.00 0.00 178.83 179.21 2a1l h GLU 217 N 0.24 0.79 -0.20 1.46 4.39 -0.35 -0.08 114.58 120.84 2a1l h GLU 217 Ca 0.02 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.40 2a1l h GLU 217 Cb 0.87 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.48 2a1l h GLU 217 CO 0.07 0.95 0.13 -0.22 -1.16 0.00 0.00 179.01 178.77 2a1l h LYS 218 N 0.69 0.25 -0.42 2.33 3.64 -0.73 -0.20 116.57 122.13 2a1l h LYS 218 Ca 0.09 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2a1l h LYS 218 Cb 0.75 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2a1l h LYS 218 CO 0.06 0.17 0.26 -0.09 -2.27 0.00 0.00 179.45 177.58 2a1l h ARG 219 N 0.26 0.57 -0.64 1.90 2.43 -1.18 -0.55 114.38 117.18 2a1l h ARG 219 Ca 0.07 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 2a1l h ARG 219 Cb -0.03 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 2a1l h ARG 219 CO -0.02 0.41 0.06 0.82 -1.51 0.00 0.00 179.97 179.74 2a1l h ILE 220 N 0.56 1.26 -0.38 1.20 2.04 -0.82 -1.45 117.51 119.92 2a1l h ILE 220 Ca 0.15 -1.07 -0.12 0.00 1.00 0.00 0.00 64.86 64.82 2a1l h ILE 220 Cb -0.02 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2a1l h ILE 220 CO -0.03 0.40 -0.25 -0.26 0.00 0.00 0.00 178.15 178.01 2a1l h PHE 221 N 0.99 0.89 0.30 1.37 0.05 -0.78 -1.78 116.94 117.99 2a1l h PHE 221 Ca 0.19 -0.21 -0.01 0.00 3.82 0.00 0.00 57.97 61.75 2a1l h PHE 221 Cb 0.48 -0.21 0.00 0.00 2.00 0.00 0.00 35.95 38.22 2a1l h PHE 221 CO 0.03 0.95 -0.15 1.15 -0.18 0.00 0.00 178.31 180.12 2a1l h THR 222 N 0.68 0.70 -0.67 -1.55 2.02 -0.90 -2.31 112.91 110.87 2a1l h THR 222 Ca 0.09 -0.58 -0.06 0.00 0.77 0.00 0.00 66.41 66.64 2a1l h THR 222 Cb 0.77 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.15 2a1l h THR 222 CO 0.06 0.11 0.20 0.78 0.37 0.00 0.00 175.52 177.05 2a1l h ASN 223 N -0.74 0.98 -0.67 4.18 2.35 -1.33 -2.04 115.58 118.31 2a1l h ASN 223 Ca -0.04 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2a1l h ASN 223 Cb 0.50 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 2a1l h ASN 223 CO 0.07 0.93 0.43 0.25 -1.65 0.00 0.00 177.43 177.46 2a1l h LEU 224 N 0.97 0.77 -0.12 1.61 5.85 -1.34 -1.14 115.31 121.91 2a1l h LEU 224 Ca 0.21 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.79 2a1l h LEU 224 Cb 0.31 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2a1l h LEU 224 CO -0.01 0.57 -0.54 0.45 -0.34 0.00 0.00 178.44 178.57 2a1l h HIS 225 N 0.90 0.00 -0.53 1.25 3.86 -1.32 0.17 115.15 119.49 2a1l h HIS 225 Ca 0.24 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.33 2a1l h HIS 225 Cb -0.09 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.37 2a1l h HIS 225 CO -0.02 0.54 -0.14 0.00 0.86 0.00 0.00 177.93 179.17 2a1l h ARG 226 N 0.00 1.02 -0.19 2.45 3.08 -1.15 -1.82 114.38 117.77 2a1l h ARG 226 Ca -0.01 -0.40 -0.06 0.00 0.07 0.00 0.00 59.98 59.59 2a1l h ARG 226 Cb 1.37 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.36 2a1l h ARG 226 CO 0.07 1.08 -0.11 1.96 -1.07 0.00 0.00 179.97 181.90 2a1l h GLN 227 N 0.90 0.42 -0.54 0.04 4.20 -1.04 -2.41 115.11 116.68 2a1l h GLN 227 Ca 0.13 -0.19 0.11 0.00 0.06 0.00 0.00 58.65 58.76 2a1l h GLN 227 Cb 0.71 -0.01 -0.10 0.00 0.30 0.00 0.00 27.48 28.38 2a1l h GLN 227 CO 0.05 0.73 -0.12 1.25 -0.67 0.00 0.00 178.83 180.07 2a1l h LEU 228 N 0.10 -0.48 -0.33 1.46 6.46 -0.48 0.34 115.31 122.38 2a1l h LEU 228 Ca 0.04 0.16 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 2a1l h LEU 228 Cb 0.61 0.33 -0.02 0.00 -0.73 0.00 0.00 40.66 40.85 2a1l h LEU 228 CO 0.03 -0.17 0.19 0.15 -0.62 0.00 0.00 178.44 178.02 2a1l h PHE 229 N 0.01 0.45 0.00 1.25 3.57 -1.28 -2.59 116.94 118.35 2a1l h PHE 229 Ca 0.26 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.75 2a1l h PHE 229 Cb 0.40 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.00 2a1l h PHE 229 CO -0.44 0.35 0.00 0.00 -2.23 0.00 0.00 178.31 175.99 2a1l n TRP 231 N -1.91 0.61 -0.30 0.00 8.01 -0.00 -4.66 117.44 119.18 2a1l n TRP 231 Ca 0.03 -0.40 0.24 0.00 -1.31 0.00 0.00 57.50 56.05 2a1l n TRP 231 Cb 0.20 -0.01 0.55 0.00 -2.01 0.00 0.00 31.31 30.05 2a1l n TRP 231 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.69 177.65 2a1l h ILE 232 N 3.33 0.54 0.00 -0.99 2.10 -0.97 0.39 117.51 121.91 2a1l h ILE 232 Ca 0.00 -0.11 -0.01 0.00 1.08 0.00 0.00 64.86 65.82 2a1l h ILE 232 Cb 0.85 0.19 -0.00 0.00 -1.09 0.00 0.00 36.82 36.77 2a1l h ILE 232 CO 0.00 0.06 -0.06 0.44 -1.08 0.00 0.00 178.15 177.51 2a1l h ASP 233 N 0.32 0.00 0.39 2.19 3.32 -1.84 0.17 116.42 120.98 2a1l h ASP 233 Ca 0.56 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 57.38 2a1l h ASP 233 Cb 1.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.10 2a1l h ASP 233 CO -0.22 0.06 -0.96 0.11 -1.72 0.00 0.00 179.24 176.51 2a1l h LYS 234 N 0.00 0.37 0.00 3.56 1.79 -0.57 -3.39 116.57 118.33 2a1l h LYS 234 Ca -0.00 -0.42 0.00 0.00 -2.18 0.00 0.00 60.65 58.05 2a1l h LYS 234 Cb 0.62 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 2a1l h LYS 234 CO 0.01 1.10 -0.29 -2.67 -1.08 0.00 0.00 179.45 176.52 2a1l n TRP 235 N -3.72 0.00 -0.13 -1.35 4.27 -1.12 -4.73 117.44 110.67 2a1l n TRP 235 Ca -0.06 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 53.64 2a1l n TRP 235 Cb 0.85 -0.00 0.43 0.00 -1.36 0.00 0.00 31.31 31.23 2a1l n TRP 235 CO 0.00 0.00 0.00 0.97 -2.29 0.00 0.00 177.69 176.37 2a1l h ILE 236 N 0.00 0.94 -0.57 -1.67 6.09 -0.85 -2.02 117.51 119.43 2a1l h ILE 236 Ca 0.00 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.30 2a1l h ILE 236 Cb 0.13 0.33 0.00 0.00 0.47 0.00 0.00 36.82 37.75 2a1l h ILE 236 CO 0.00 0.10 0.00 0.47 -3.07 0.00 0.00 178.15 175.65 2a1l n ASP 237 N -4.48 3.52 -4.87 2.19 8.00 -1.26 -4.97 116.55 114.68 2a1l n ASP 237 Ca 0.11 -2.15 -0.32 0.00 0.71 0.00 0.00 54.79 53.14 2a1l n ASP 237 Cb 0.32 -0.45 -0.05 0.00 -0.02 0.00 0.00 41.12 40.92 2a1l n ASP 237 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2a1l s LEU 238 N -1.24 4.06 0.30 0.64 1.43 -0.76 -5.09 118.68 118.02 2a1l s LEU 238 Ca 0.41 1.08 0.06 0.00 -1.03 0.00 0.00 54.13 54.66 2a1l s LEU 238 Cb 0.23 -3.89 -0.02 0.00 0.03 0.00 0.00 46.19 42.54 2a1l s LEU 238 CO 0.24 -0.19 0.38 0.42 0.23 0.00 0.00 176.35 177.43 2a1l s THR 239 N -2.00 4.31 0.42 5.49 -4.23 -1.26 -4.98 115.64 113.40 2a1l s THR 239 Ca 0.50 -1.11 0.12 0.00 -1.18 0.00 0.00 61.69 60.02 2a1l s THR 239 Cb -0.11 -3.48 0.31 0.00 1.34 0.00 0.00 72.50 70.56 2a1l s THR 239 CO 0.22 -0.23 2.00 -0.03 -0.54 0.00 0.00 174.62 176.04 2a1l h MET 240 N 1.10 0.45 -0.59 3.99 4.05 -1.99 -0.50 114.93 121.43 2a1l h MET 240 Ca -0.47 -0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 58.88 2a1l h MET 240 Cb 1.25 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.92 2a1l h MET 240 CO 0.57 0.30 0.20 0.93 0.23 0.00 0.00 176.91 179.13 2a1l h GLU 241 N 0.47 0.88 -0.31 0.39 4.39 -2.00 -1.11 114.58 117.29 2a1l h GLU 241 Ca 0.25 -0.16 -0.12 0.00 0.34 0.00 0.00 59.36 59.67 2a1l h GLU 241 Cb 0.37 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2a1l h GLU 241 CO -0.07 0.75 -0.30 -0.44 -1.16 0.00 0.00 179.01 177.79 2a1l h ASP 242 N 0.86 0.67 -0.25 1.42 3.32 -1.49 -2.56 116.42 118.39 2a1l h ASP 242 Ca 0.20 -0.26 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2a1l h ASP 242 Cb 0.23 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2a1l h ASP 242 CO -0.01 0.94 0.07 0.40 -1.72 0.00 0.00 179.24 178.92 2a1l h ILE 243 N 0.56 1.20 0.00 0.35 1.08 -0.87 -0.20 117.51 119.62 2a1l h ILE 243 Ca 0.07 -0.64 -0.02 0.00 -0.39 0.00 0.00 64.86 63.88 2a1l h ILE 243 Cb 0.80 1.15 -0.00 0.00 -3.07 0.00 0.00 36.82 35.69 2a1l h ILE 243 CO 0.07 0.21 -0.08 0.03 -0.69 0.00 0.00 178.15 177.69 2a1l h ARG 244 N 0.24 0.00 -0.17 2.37 2.47 -1.14 0.26 114.38 118.41 2a1l h ARG 244 Ca 0.08 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.65 2a1l h ARG 244 Cb 0.25 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 2a1l h ARG 244 CO -0.00 0.08 -0.50 0.00 0.56 0.00 0.00 179.97 180.11 2a1l h ARG 245 N 0.00 0.64 -0.40 0.04 3.08 -1.03 -2.77 114.38 113.93 2a1l h ARG 245 Ca -0.00 -0.46 -0.07 0.00 0.07 0.00 0.00 59.98 59.52 2a1l h ARG 245 Cb 0.13 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2a1l h ARG 245 CO 0.01 1.08 -0.05 1.98 -1.07 0.00 0.00 179.97 181.92 2a1l h MET 246 N 0.31 0.67 -0.22 0.04 4.05 0.15 -2.28 114.93 117.65 2a1l h MET 246 Ca -0.01 -0.18 -0.11 0.00 -0.28 0.00 0.00 59.70 59.11 2a1l h MET 246 Cb 1.12 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.83 2a1l h MET 246 CO 0.11 0.72 -0.33 0.93 0.23 0.00 0.00 176.91 178.57 2a1l h GLU 247 N 0.62 0.47 -0.27 0.39 5.08 -0.53 0.15 114.58 120.50 2a1l h GLU 247 Ca 0.12 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 2a1l h GLU 247 Cb 0.47 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2a1l h GLU 247 CO 0.02 0.75 -0.06 -0.44 -1.00 0.00 0.00 179.01 178.28 2a1l h ASP 248 N 0.40 0.52 -0.06 1.42 3.32 -1.19 -0.67 116.42 120.16 2a1l h ASP 248 Ca 0.05 -0.36 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 2a1l h ASP 248 Cb 0.78 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.18 2a1l h ASP 248 CO 0.06 0.76 0.03 -0.33 -1.72 0.00 0.00 179.24 178.04 2a1l h GLU 249 N 0.27 0.08 -0.65 3.56 4.39 -1.24 -3.02 114.58 117.98 2a1l h GLU 249 Ca 0.07 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.82 2a1l h GLU 249 Cb 0.53 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.11 2a1l h GLU 249 CO 0.03 0.20 0.33 1.15 -1.16 0.00 0.00 179.01 179.55 2a1l h THR 250 N -0.05 0.91 -0.57 1.13 2.02 -0.63 -0.33 112.91 115.40 2a1l h THR 250 Ca 0.02 -0.20 0.10 0.00 0.77 0.00 0.00 66.41 67.09 2a1l h THR 250 Cb 0.14 0.26 -0.08 0.00 -1.74 0.00 0.00 68.15 66.73 2a1l h THR 250 CO -0.00 0.11 0.13 -0.61 0.37 0.00 0.00 175.52 175.52 2a1l h GLN 251 N 0.60 0.26 -0.24 6.66 4.15 -1.03 0.08 115.11 125.59 2a1l h GLN 251 Ca 0.30 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.66 2a1l h GLN 251 Cb 0.25 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 2a1l h GLN 251 CO -0.22 0.17 -0.03 0.87 -1.93 0.00 0.00 178.83 177.70 2a1l h LYS 252 N 0.27 0.44 0.00 1.69 1.57 -1.23 -2.98 116.57 116.33 2a1l h LYS 252 Ca 0.29 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2a1l h LYS 252 Cb 0.41 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 2a1l h LYS 252 CO -0.36 0.64 -0.09 0.93 -0.57 0.00 0.00 179.45 180.00 2a1l h GLU 253 N 0.19 0.00 -0.19 3.15 5.08 -0.53 -2.54 114.58 119.74 2a1l h GLU 253 Ca 0.06 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 2a1l h GLU 253 Cb 0.46 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 2a1l h GLU 253 CO 0.02 0.09 -0.24 -0.07 -1.00 0.00 0.00 179.01 177.81 2a1l h LEU 254 N 0.00 0.55 -1.00 1.33 3.38 -0.88 -1.50 115.31 117.18 2a1l h LEU 254 Ca -0.00 -0.50 0.12 0.00 0.09 0.00 0.00 57.88 57.59 2a1l h LEU 254 Cb 0.17 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.68 2a1l h LEU 254 CO 0.01 0.94 0.63 -0.08 0.09 0.00 0.00 178.44 180.03 2a1l h GLU 255 N 0.17 0.97 0.16 1.13 4.81 -1.31 -1.23 114.58 119.29 2a1l h GLU 255 Ca 0.02 -0.06 -0.29 0.00 -0.13 0.00 0.00 59.36 58.91 2a1l h GLU 255 Cb 0.80 -0.22 0.03 0.00 0.63 0.00 0.00 28.75 30.00 2a1l h GLU 255 CO 0.06 0.64 -1.23 0.00 -0.73 0.00 0.00 179.01 177.75 2a1l h THR 256 N 1.00 1.32 -0.22 0.32 1.03 -1.48 -3.33 112.91 111.55 2a1l h THR 256 Ca 0.49 -2.52 -0.01 0.00 -0.01 0.00 0.00 66.41 64.37 2a1l h THR 256 Cb 0.47 2.86 -0.01 0.00 -1.07 0.00 0.00 68.15 70.40 2a1l h THR 256 CO -0.26 0.75 0.11 0.24 -0.01 0.00 0.00 175.52 176.36 2a1l h MET 257 N 0.13 0.32 -0.35 0.00 2.86 -0.92 -2.90 114.93 114.07 2a1l h MET 257 Ca -0.20 -0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.50 2a1l h MET 257 Cb 1.93 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 33.52 2a1l h MET 257 CO 0.23 0.32 0.33 -0.09 1.06 0.00 0.00 176.91 178.76 2a1l h ARG 258 N 0.24 0.00 0.08 1.72 2.43 -1.37 -2.44 114.38 115.04 2a1l h ARG 258 Ca 0.08 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.14 2a1l h ARG 258 Cb 0.10 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.66 2a1l h ARG 258 CO -0.01 0.00 -0.48 0.87 -1.51 0.00 0.00 179.97 178.84 2a1l h LYS 259 N 0.00 0.18 0.00 0.20 1.79 -1.62 0.70 116.57 117.82 2a1l h LYS 259 Ca 0.17 -0.30 -0.26 0.00 -2.18 0.00 0.00 60.65 58.08 2a1l h LYS 259 Cb 0.82 0.11 0.04 0.00 -1.58 0.00 0.00 32.23 31.63 2a1l h LYS 259 CO -0.00 1.14 0.04 0.36 -1.08 0.00 0.00 179.45 179.91 2a1l n LYS 260 N -4.32 0.33 0.00 3.15 2.85 -0.92 -4.48 118.16 114.76 2a1l n LYS 260 Ca -0.12 -1.53 0.00 0.00 -1.05 0.00 0.00 58.31 55.61 2a1l n LYS 260 Cb 0.68 -0.32 0.00 0.00 -0.65 0.00 0.00 35.03 34.74 2a1l n LYS 260 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2a1l n GLY 261 N 0.87 -0.53 3.96 2.58 0.00 -1.26 -0.40 105.19 110.41 2a1l n GLY 261 Ca 0.09 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 45.03 2a1l n GLY 261 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a1l s SER 262 N -4.00 4.82 0.32 1.61 1.04 -1.26 -3.10 113.70 113.13 2a1l s SER 262 Ca 0.00 -1.09 -0.28 0.00 0.48 0.00 0.00 55.95 55.06 2a1l s SER 262 Cb 0.00 0.40 -0.09 0.00 0.10 0.00 0.00 66.02 66.42 2a1l s SER 262 CO 0.00 -1.22 1.13 -0.69 0.98 0.00 0.00 173.24 173.44 2a1l s VAL 263 N -2.74 3.37 0.05 5.02 1.01 -1.26 -2.63 120.40 123.23 2a1l s VAL 263 Ca 0.46 1.28 -0.05 0.00 0.00 0.00 0.00 61.98 63.67 2a1l s VAL 263 Cb -0.04 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 2a1l s VAL 263 CO 0.29 0.24 0.09 0.00 0.00 0.00 0.00 175.10 175.71 2a1l s ARG 264 N -1.79 0.64 0.00 2.72 1.70 -1.26 -4.97 118.95 115.99 2a1l s ARG 264 Ca 0.49 -0.90 0.00 0.00 -0.47 0.00 0.00 55.73 54.85 2a1l s ARG 264 Cb -0.31 0.25 0.00 0.00 -0.57 0.00 0.00 34.95 34.32 2a1l s ARG 264 CO 0.40 -0.16 0.00 0.41 -1.08 0.00 0.00 175.30 174.87 2a1l n GLY 265 N 0.46 -0.73 3.77 3.88 0.00 -1.11 -4.19 105.19 107.26 2a1l n GLY 265 Ca -0.17 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.46 2a1l n GLY 265 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a1l s THR 266 N 0.00 3.18 0.02 2.61 2.01 -1.26 -5.05 115.64 117.15 2a1l s THR 266 Ca 0.00 0.96 0.02 0.00 0.31 0.00 0.00 61.69 62.98 2a1l s THR 266 Cb 0.00 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 68.97 2a1l s THR 266 CO 0.00 0.06 -0.07 -0.55 -0.69 0.00 0.00 174.62 173.38 2a1l s SER 267 N -1.21 0.73 -0.11 3.53 0.15 -1.26 -4.88 113.70 110.65 2a1l s SER 267 Ca 0.59 -0.33 0.02 0.00 0.70 0.00 0.00 55.95 56.93 2a1l s SER 267 Cb -0.30 -0.01 -0.01 0.00 -1.71 0.00 0.00 66.02 63.99 2a1l s SER 267 CO 0.37 -0.07 -0.18 0.00 1.20 0.00 0.00 173.24 174.55 2a1l s ALA 268 N -0.76 2.40 -0.08 5.45 0.00 -0.12 -5.06 121.76 123.58 2a1l s ALA 268 Ca -0.04 -0.94 -0.04 0.00 0.00 0.00 0.00 51.96 50.95 2a1l s ALA 268 Cb -0.06 -1.00 0.04 0.00 0.00 0.00 0.00 23.12 22.11 2a1l s ALA 268 CO 0.00 0.29 0.18 0.00 0.00 0.00 0.00 175.76 176.23 2a1l s ALA 269 N 0.27 -0.32 -0.77 0.00 0.00 -1.26 -2.79 121.76 116.88 2a1l s ALA 269 Ca -0.13 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 52.54 2a1l s ALA 269 Cb -0.16 -0.64 0.38 0.00 0.00 0.00 0.00 23.12 22.69 2a1l s ALA 269 CO 0.07 -0.32 2.05 -3.47 0.00 0.00 0.00 175.76 174.09 2a1l n ASP 270 N 4.63 7.56 0.00 0.00 -0.08 -1.26 -5.02 116.55 122.37 2a1l n ASP 270 Ca -0.18 -3.80 0.02 0.00 -1.51 0.00 0.00 54.79 49.32 2a1l n ASP 270 Cb 0.51 -1.04 0.15 0.00 2.34 0.00 0.00 41.12 43.08 2a1l n ASP 270 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32