#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xcx s SER 3 N 0.00 7.12 0.53 7.72 0.01 -1.26 -4.88 113.70 122.93 1xcx s SER 3 Ca 0.00 1.35 0.28 0.00 1.31 0.00 0.00 55.95 58.88 1xcx s SER 3 Cb 0.00 -2.46 1.46 0.00 0.21 0.00 0.00 66.02 65.23 1xcx s SER 3 CO 0.00 -0.14 2.08 -0.65 0.41 0.00 0.00 173.24 174.94 1xcx h PRO 4 N 6.62 0.00 -0.60 12.44 0.11 -1.96 -3.37 132.00 145.24 1xcx h PRO 4 Ca -0.41 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.51 1xcx h PRO 4 Cb 1.20 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.25 1xcx h PRO 4 CO 0.75 0.11 -0.18 0.09 -0.21 0.00 0.00 178.00 178.56 1xcx n ASN 5 N -3.63 -3.88 -4.88 -2.05 3.02 -1.26 -4.72 115.26 97.86 1xcx n ASN 5 Ca -0.02 0.17 -0.30 0.00 -0.03 0.00 0.00 54.58 54.41 1xcx n ASN 5 Cb 0.23 -2.37 0.05 0.00 -0.61 0.00 0.00 39.78 37.09 1xcx n ASN 5 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1xcx s THR 6 N -2.35 3.35 0.35 3.41 -4.23 -1.26 -4.94 115.64 109.96 1xcx s THR 6 Ca 0.00 0.44 -0.27 0.00 -1.18 0.00 0.00 61.69 60.68 1xcx s THR 6 Cb 0.00 -3.41 -0.09 0.00 1.34 0.00 0.00 72.50 70.33 1xcx s THR 6 CO 0.00 -0.57 1.23 -1.58 -0.54 0.00 0.00 174.62 173.15 1xcx s GLN 7 N -5.36 4.26 0.08 3.99 0.74 -1.26 -4.89 119.66 117.21 1xcx s GLN 7 Ca 0.59 2.02 -0.34 0.00 0.05 0.00 0.00 55.36 57.67 1xcx s GLN 7 Cb -0.11 -2.93 -0.14 0.00 1.10 0.00 0.00 33.01 30.93 1xcx s GLN 7 CO 0.52 -0.20 1.64 0.94 -0.55 0.00 0.00 175.29 177.64 1xcx n GLN 8 N 0.55 2.04 0.00 1.67 7.27 -1.26 -1.79 117.38 125.86 1xcx n GLN 8 Ca 0.02 0.74 0.00 0.00 0.07 0.00 0.00 57.00 57.82 1xcx n GLN 8 Cb 0.44 -2.51 0.00 0.00 2.41 0.00 0.00 30.24 30.58 1xcx n GLN 8 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1xcx n GLY 9 N 3.62 0.37 3.27 1.69 0.00 -1.26 -5.06 105.19 107.81 1xcx n GLY 9 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1xcx n GLY 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xcx s ARG 10 N -0.89 3.28 0.00 1.61 0.52 -0.74 -4.69 118.95 118.05 1xcx s ARG 10 Ca 0.00 -0.68 0.09 0.00 -0.52 0.00 0.00 55.73 54.62 1xcx s ARG 10 Cb 0.00 -2.88 0.17 0.00 0.52 0.00 0.00 34.95 32.75 1xcx s ARG 10 CO 0.00 -0.18 1.01 0.25 0.02 0.00 0.00 175.30 176.40 1xcx n THR 11 N 4.69 0.52 -4.09 0.02 -2.24 -1.26 -4.69 114.28 107.24 1xcx n THR 11 Ca -0.19 -0.76 -0.09 0.00 -2.27 0.00 0.00 64.05 60.74 1xcx n THR 11 Cb 0.51 0.83 -0.10 0.00 -2.10 0.00 0.00 70.33 69.46 1xcx n THR 11 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1xcx s SER 12 N -0.89 0.71 0.19 3.42 0.01 -1.26 -4.16 113.70 111.72 1xcx s SER 12 Ca 0.15 -0.86 0.11 0.00 1.31 0.00 0.00 55.95 56.66 1xcx s SER 12 Cb 0.09 0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.40 1xcx s SER 12 CO 0.12 -0.45 -0.23 0.27 0.41 0.00 0.00 173.24 173.37 1xcx s ILE 13 N -3.06 2.24 -0.00 1.44 -4.36 -0.95 -0.82 121.20 115.68 1xcx s ILE 13 Ca 0.02 -2.02 0.08 0.00 -0.26 0.00 0.00 60.65 58.48 1xcx s ILE 13 Cb 0.02 -2.06 -0.02 0.00 1.25 0.00 0.00 42.46 41.64 1xcx s ILE 13 CO -0.05 -0.17 -0.25 0.54 0.24 0.00 0.00 174.94 175.25 1xcx s VAL 14 N -1.78 1.95 -0.54 8.37 0.11 -0.20 -0.63 120.40 127.69 1xcx s VAL 14 Ca 0.20 -1.12 -0.19 0.00 -2.93 0.00 0.00 61.98 57.94 1xcx s VAL 14 Cb -0.07 -1.63 0.07 0.00 -1.53 0.00 0.00 36.38 33.22 1xcx s VAL 14 CO 0.09 0.49 0.66 -2.28 -3.33 0.00 0.00 175.10 170.73 1xcx s HIS 15 N -0.63 3.02 -1.23 1.54 2.46 0.62 -0.77 115.29 120.30 1xcx s HIS 15 Ca 0.10 -0.66 -0.12 0.00 0.47 0.00 0.00 55.06 54.84 1xcx s HIS 15 Cb -0.09 -3.70 0.17 0.00 -0.13 0.00 0.00 32.58 28.83 1xcx s HIS 15 CO -0.00 -1.13 1.59 1.28 -2.47 0.00 0.00 174.74 174.01 1xcx n LEU 16 N 6.26 5.74 -4.62 8.88 4.77 -1.09 -2.06 117.00 134.88 1xcx n LEU 16 Ca -0.07 -4.54 -0.48 0.00 -0.03 0.00 0.00 56.01 50.89 1xcx n LEU 16 Cb 0.44 -1.56 -0.05 0.00 -2.33 0.00 0.00 43.42 39.92 1xcx n LEU 16 CO 0.56 0.98 1.63 0.33 -1.33 0.00 0.00 177.39 179.55 1xcx n PHE 17 N 4.92 2.12 -1.06 -1.77 7.35 -1.18 -2.46 117.46 125.38 1xcx n PHE 17 Ca 0.38 0.02 -0.02 0.00 -0.76 0.00 0.00 57.45 57.06 1xcx n PHE 17 Cb 0.40 -2.65 -0.01 0.00 0.35 0.00 0.00 39.48 37.57 1xcx n PHE 17 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1xcx n GLU 18 N 7.40 -1.09 -1.87 -4.13 -0.58 -1.26 -4.82 120.64 114.28 1xcx n GLU 18 Ca 0.28 0.41 -0.33 0.00 -0.42 0.00 0.00 57.16 57.09 1xcx n GLU 18 Cb 0.31 -4.29 0.04 0.00 -0.57 0.00 0.00 31.44 26.92 1xcx n GLU 18 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1xcx s TRP 19 N -1.61 2.65 0.33 -0.32 0.52 -1.03 -4.93 118.94 114.55 1xcx s TRP 19 Ca 0.00 1.55 -0.18 0.00 0.02 0.00 0.00 56.10 57.49 1xcx s TRP 19 Cb 0.00 -3.18 -0.09 0.00 -1.15 0.00 0.00 33.47 29.04 1xcx s TRP 19 CO 0.00 -1.63 0.80 1.03 0.02 0.00 0.00 176.95 177.16 1xcx s ARG 20 N -3.94 4.14 0.24 4.98 0.52 -1.26 -4.77 118.95 118.86 1xcx s ARG 20 Ca 0.68 0.85 -0.05 0.00 -0.52 0.00 0.00 55.73 56.69 1xcx s ARG 20 Cb -0.21 -2.49 0.36 0.00 0.52 0.00 0.00 34.95 33.14 1xcx s ARG 20 CO 0.38 0.17 1.81 -1.49 0.02 0.00 0.00 175.30 176.19 1xcx h TRP 21 N 2.47 0.82 -0.68 -0.53 -0.00 -1.54 -1.84 115.95 114.64 1xcx h TRP 21 Ca -0.48 0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 58.42 1xcx h TRP 21 Cb 1.18 -0.25 -0.03 0.00 -0.00 0.00 0.00 29.16 30.06 1xcx h TRP 21 CO 0.62 0.35 0.35 -0.24 -0.00 0.00 0.00 178.44 179.52 1xcx h VAL 22 N 0.77 1.21 -0.20 1.49 3.04 -1.84 -0.74 116.25 119.99 1xcx h VAL 22 Ca 0.38 -0.57 -0.15 0.00 -1.01 0.00 0.00 66.70 65.34 1xcx h VAL 22 Cb 0.32 0.32 -0.01 0.00 -2.01 0.00 0.00 31.29 29.91 1xcx h VAL 22 CO -0.23 0.25 -0.50 0.44 -1.01 0.00 0.00 177.57 176.51 1xcx h ASP 23 N 0.96 0.60 -0.44 3.17 3.32 -1.75 -2.57 116.42 119.71 1xcx h ASP 23 Ca 0.24 -0.30 -0.14 0.00 0.02 0.00 0.00 57.03 56.85 1xcx h ASP 23 Cb 0.07 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1xcx h ASP 23 CO -0.03 1.00 -0.29 0.40 -1.72 0.00 0.00 179.24 178.59 1xcx h ILE 24 N 0.43 1.27 -0.25 0.35 2.04 -0.96 -0.76 117.51 119.63 1xcx h ILE 24 Ca 0.02 -1.46 0.03 0.00 1.00 0.00 0.00 64.86 64.45 1xcx h ILE 24 Cb 1.03 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.33 1xcx h ILE 24 CO 0.09 0.50 0.08 0.00 0.00 0.00 0.00 178.15 178.82 1xcx h ALA 25 N 0.82 0.28 -0.58 1.87 0.00 -1.05 0.74 119.26 121.33 1xcx h ALA 25 Ca 0.09 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1xcx h ALA 25 Cb 0.87 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1xcx h ALA 25 CO 0.08 -0.34 0.29 -0.07 0.00 0.00 0.00 179.25 179.21 1xcx h LEU 26 N 0.19 0.76 -1.17 0.00 3.38 -1.37 -2.77 115.31 114.33 1xcx h LEU 26 Ca 0.11 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1xcx h LEU 26 Cb 0.09 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1xcx h LEU 26 CO -0.13 0.67 0.30 -0.08 0.09 0.00 0.00 178.44 179.29 1xcx h GLU 27 N 0.79 0.88 -0.42 1.13 4.57 -0.54 0.10 114.58 121.08 1xcx h GLU 27 Ca 0.20 -0.11 0.02 0.00 -1.18 0.00 0.00 59.36 58.29 1xcx h GLU 27 Cb 0.11 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 1xcx h GLU 27 CO -0.03 0.68 0.24 0.00 -1.18 0.00 0.00 179.01 178.73 1xcx h GLU 29 N 0.48 0.33 0.00 0.00 5.08 -1.34 -0.40 114.58 118.74 1xcx h GLU 29 Ca 0.17 -0.35 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 1xcx h GLU 29 Cb 0.02 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1xcx h GLU 29 CO -0.09 1.03 -0.57 0.07 -1.00 0.00 0.00 179.01 178.46 1xcx h ARG 30 N -0.23 0.00 0.00 2.33 0.11 -1.03 -3.42 114.38 112.14 1xcx h ARG 30 Ca -0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.02 1xcx h ARG 30 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 1xcx h ARG 30 CO 0.09 0.21 0.00 0.98 0.10 0.00 0.00 179.97 181.35 1xcx n TYR 31 N -3.03 -1.73 -0.14 4.08 9.36 -0.47 -4.81 117.16 120.42 1xcx n TYR 31 Ca 0.01 0.31 -0.04 0.00 3.32 0.00 0.00 57.90 61.49 1xcx n TYR 31 Cb 0.65 0.39 0.02 0.00 -0.63 0.00 0.00 39.34 39.77 1xcx n TYR 31 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1xcx h LEU 32 N 0.00 -0.40 0.20 2.98 3.38 -1.14 0.00 115.31 120.33 1xcx h LEU 32 Ca 0.00 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1xcx h LEU 32 Cb 0.00 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xcx h LEU 32 CO 0.00 -0.14 -0.10 0.00 0.09 0.00 0.00 178.44 178.29 1xcx h ALA 33 N 1.44 -0.27 -0.52 1.53 0.00 -1.28 -0.30 119.26 119.85 1xcx h ALA 33 Ca 0.21 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xcx h ALA 33 Cb 0.32 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1xcx h ALA 33 CO -0.45 -0.53 0.35 -1.35 0.00 0.00 0.00 179.25 177.27 1xcx h PRO 34 N -0.51 0.66 -0.27 0.00 0.11 -1.75 -2.56 132.00 127.68 1xcx h PRO 34 Ca -0.03 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1xcx h PRO 34 Cb 0.39 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.35 1xcx h PRO 34 CO 0.04 0.44 0.00 1.63 -0.21 0.00 0.00 178.00 179.90 1xcx n LYS 35 N -4.46 1.76 -1.61 1.05 4.01 -0.03 -4.95 118.16 113.92 1xcx n LYS 35 Ca 0.05 -1.16 -0.03 0.00 -0.51 0.00 0.00 58.31 56.66 1xcx n LYS 35 Cb 0.07 -1.31 -0.01 0.00 -0.51 0.00 0.00 35.03 33.27 1xcx n LYS 35 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1xcx n GLY 36 N 1.07 0.41 3.75 0.72 0.00 -0.96 -4.66 105.19 105.52 1xcx n GLY 36 Ca 0.13 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 1xcx n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xcx s PHE 37 N -2.13 3.91 0.12 1.61 0.40 -0.16 -4.53 117.98 117.21 1xcx s PHE 37 Ca 0.00 1.83 0.01 0.00 -0.60 0.00 0.00 56.93 58.17 1xcx s PHE 37 Cb 0.00 -2.97 -0.17 0.00 0.51 0.00 0.00 43.02 40.39 1xcx s PHE 37 CO 0.00 0.38 1.26 0.78 0.70 0.00 0.00 175.22 178.34 1xcx h GLY 38 N 4.68 0.20 -1.59 4.36 0.00 -1.26 -3.43 103.07 106.03 1xcx h GLY 38 Ca -0.45 -0.45 0.27 0.00 0.00 0.00 0.00 47.33 46.70 1xcx h GLY 38 CO 0.69 0.39 0.75 0.61 0.00 0.00 0.00 176.54 178.99 1xcx n GLY 39 N 1.26 0.37 3.00 4.60 0.00 -1.11 -1.77 105.19 111.53 1xcx n GLY 39 Ca -0.05 -1.07 -0.21 0.00 0.00 0.00 0.00 46.02 44.70 1xcx n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xcx s VAL 40 N -2.04 0.79 -0.25 1.61 1.01 0.12 -1.03 120.40 120.61 1xcx s VAL 40 Ca 0.26 -0.36 -0.13 0.00 0.00 0.00 0.00 61.98 61.75 1xcx s VAL 40 Cb -0.01 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 1xcx s VAL 40 CO 0.01 0.25 0.27 -1.58 0.00 0.00 0.00 175.10 174.05 1xcx s GLN 41 N 0.24 4.06 0.23 2.72 0.74 0.05 -0.10 119.66 127.59 1xcx s GLN 41 Ca -0.04 -0.10 0.05 0.00 0.05 0.00 0.00 55.36 55.32 1xcx s GLN 41 Cb -0.09 -3.59 -0.03 0.00 1.10 0.00 0.00 33.01 30.40 1xcx s GLN 41 CO 0.01 -0.09 0.32 0.14 -0.55 0.00 0.00 175.29 175.12 1xcx s VAL 42 N 1.49 5.13 0.74 1.34 -7.23 -0.39 -2.68 120.40 118.80 1xcx s VAL 42 Ca 0.12 -1.01 -0.11 0.00 -1.81 0.00 0.00 61.98 59.17 1xcx s VAL 42 Cb -0.15 -3.76 0.04 0.00 0.56 0.00 0.00 36.38 33.06 1xcx s VAL 42 CO 0.08 -0.30 1.08 -0.44 -0.31 0.00 0.00 175.10 175.21 1xcx s SER 43 N -3.84 4.90 -0.31 4.85 0.01 -1.26 -3.14 113.70 114.91 1xcx s SER 43 Ca 0.34 1.66 -0.42 0.00 1.31 0.00 0.00 55.95 58.84 1xcx s SER 43 Cb -0.09 -2.45 -0.18 0.00 0.21 0.00 0.00 66.02 63.51 1xcx s SER 43 CO 0.28 -1.76 1.61 -2.65 0.41 0.00 0.00 173.24 171.13 1xcx n PRO 44 N -3.33 0.64 -0.00 12.44 -0.02 -1.26 -4.62 135.00 138.85 1xcx n PRO 44 Ca 0.08 0.23 0.14 0.00 -2.02 0.00 0.00 63.50 61.93 1xcx n PRO 44 Cb 0.54 -1.83 0.56 0.00 -0.02 0.00 0.00 33.50 32.74 1xcx n PRO 44 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1xcx n PRO 45 N 4.34 1.61 -3.44 0.52 -0.04 -1.26 -4.93 135.00 131.79 1xcx n PRO 45 Ca 0.27 -0.88 -0.28 0.00 -0.04 0.00 0.00 63.50 62.57 1xcx n PRO 45 Cb 0.06 -1.48 -0.03 0.00 -0.04 0.00 0.00 33.50 32.01 1xcx n PRO 45 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1xcx s ASN 46 N -1.98 6.42 0.17 3.54 4.22 -1.26 -3.07 114.94 122.98 1xcx s ASN 46 Ca 0.39 0.62 -0.34 0.00 -2.14 0.00 0.00 52.86 51.39 1xcx s ASN 46 Cb 0.21 -2.10 -0.14 0.00 1.28 0.00 0.00 41.25 40.50 1xcx s ASN 46 CO 0.33 -0.15 1.52 1.21 -2.04 0.00 0.00 177.10 177.98 1xcx n GLU 47 N -0.87 2.05 -4.52 3.55 2.13 0.28 -4.76 120.64 118.50 1xcx n GLU 47 Ca -0.03 0.74 -0.24 0.00 0.66 0.00 0.00 57.16 58.29 1xcx n GLU 47 Cb 0.54 -2.47 -0.10 0.00 0.27 0.00 0.00 31.44 29.68 1xcx n GLU 47 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1xcx s ASN 48 N 0.74 2.86 0.24 4.31 4.22 -1.26 -1.19 114.94 124.86 1xcx s ASN 48 Ca 0.77 -1.46 -0.30 0.00 -2.14 0.00 0.00 52.86 49.73 1xcx s ASN 48 Cb -0.69 0.04 -0.09 0.00 1.28 0.00 0.00 41.25 41.79 1xcx s ASN 48 CO 0.41 -0.67 1.21 -0.69 -2.04 0.00 0.00 177.10 175.32 1xcx s VAL 49 N -3.15 3.32 -0.44 3.54 1.01 -0.66 -1.38 120.40 122.65 1xcx s VAL 49 Ca 0.31 1.20 -0.20 0.00 0.00 0.00 0.00 61.98 63.29 1xcx s VAL 49 Cb 0.07 -3.77 0.02 0.00 0.00 0.00 0.00 36.38 32.71 1xcx s VAL 49 CO 0.14 0.24 0.63 0.00 0.00 0.00 0.00 175.10 176.11 1xcx s ALA 50 N -0.54 3.35 -0.21 5.51 0.00 0.37 -4.71 121.76 125.53 1xcx s ALA 50 Ca 0.50 -1.23 -0.08 0.00 0.00 0.00 0.00 51.96 51.15 1xcx s ALA 50 Cb -0.34 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 1xcx s ALA 50 CO 0.41 -1.77 0.09 0.42 0.00 0.00 0.00 175.76 174.92 1xcx s ILE 51 N 2.77 4.87 -0.84 0.00 1.01 -1.26 -4.76 121.20 122.98 1xcx s ILE 51 Ca 0.22 0.00 0.16 0.00 0.00 0.00 0.00 60.65 61.03 1xcx s ILE 51 Cb -0.14 -3.23 -0.15 0.00 0.01 0.00 0.00 42.46 38.94 1xcx s ILE 51 CO 0.19 0.41 0.70 -1.22 0.00 0.00 0.00 174.94 175.01 1xcx n TYR 52 N 3.97 0.00 -3.59 3.97 4.01 -1.26 -0.40 117.16 123.86 1xcx n TYR 52 Ca -0.16 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.29 1xcx n TYR 52 Cb 0.52 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.40 1xcx n TYR 52 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1xcx s ASN 53 N -2.43 3.62 1.05 7.72 2.47 -1.26 -2.61 114.94 123.50 1xcx s ASN 53 Ca 0.07 -1.52 -0.12 0.00 0.42 0.00 0.00 52.86 51.70 1xcx s ASN 53 Cb 0.12 -0.52 0.22 0.00 -1.45 0.00 0.00 41.25 39.62 1xcx s ASN 53 CO 0.62 -0.41 1.07 -2.16 -3.72 0.00 0.00 177.10 172.50 1xcx s PRO 54 N 1.81 -0.03 -0.46 0.43 0.04 -1.26 -5.05 135.00 130.47 1xcx s PRO 54 Ca 0.10 0.66 -0.27 0.00 0.04 0.00 0.00 61.00 61.53 1xcx s PRO 54 Cb -0.17 -1.67 -0.02 0.00 0.04 0.00 0.00 34.50 32.67 1xcx s PRO 54 CO -0.29 -3.08 1.88 0.12 0.04 0.00 0.00 177.00 175.67 1xcx s PHE 55 N -2.78 1.68 -0.92 0.56 5.36 -1.07 -4.18 117.98 116.63 1xcx s PHE 55 Ca 0.66 0.78 -0.08 0.00 -0.96 0.00 0.00 56.93 57.33 1xcx s PHE 55 Cb -0.21 -4.06 0.01 0.00 -0.34 0.00 0.00 43.02 38.42 1xcx s PHE 55 CO 0.60 -2.64 0.63 0.54 -1.46 0.00 0.00 175.22 172.88 1xcx n ARG 56 N 8.79 -1.24 -1.96 10.12 5.12 0.47 -4.59 116.66 133.36 1xcx n ARG 56 Ca 0.23 0.62 -0.33 0.00 -1.93 0.00 0.00 57.85 56.45 1xcx n ARG 56 Cb 0.50 -2.49 0.02 0.00 -1.16 0.00 0.00 32.46 29.32 1xcx n ARG 56 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1xcx s PRO 57 N -5.45 3.16 0.34 5.56 0.04 -1.26 -3.65 135.00 133.74 1xcx s PRO 57 Ca 0.12 1.27 0.05 0.00 0.04 0.00 0.00 61.00 62.48 1xcx s PRO 57 Cb -0.06 -2.01 0.69 0.00 0.04 0.00 0.00 34.50 33.16 1xcx s PRO 57 CO 0.91 -0.95 1.92 0.11 0.04 0.00 0.00 177.00 179.03 1xcx h TRP 58 N 0.33 0.87 0.00 0.56 5.08 -1.66 -2.41 115.95 118.72 1xcx h TRP 58 Ca -0.47 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.52 1xcx h TRP 58 Cb 1.23 -0.28 0.00 0.00 -3.00 0.00 0.00 29.16 27.11 1xcx h TRP 58 CO 0.57 0.42 0.00 -2.67 -1.28 0.00 0.00 178.44 175.49 1xcx n TRP 59 N -4.50 0.00 0.27 0.12 4.27 -1.26 -2.60 117.44 113.73 1xcx n TRP 59 Ca 0.13 0.00 0.16 0.00 -3.89 0.00 0.00 57.50 53.90 1xcx n TRP 59 Cb 0.28 -0.05 0.63 0.00 -1.36 0.00 0.00 31.31 30.81 1xcx n TRP 59 CO 0.00 0.00 0.00 1.05 -2.29 0.00 0.00 177.69 176.45 1xcx h GLU 60 N 0.00 0.00 0.00 -2.67 4.11 -1.74 -2.57 114.58 111.71 1xcx h GLU 60 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1xcx h GLU 60 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1xcx h GLU 60 CO 0.00 0.04 0.00 0.54 0.07 0.00 0.00 179.01 179.66 1xcx n ARG 61 N -3.16 0.19 -0.74 1.06 1.74 -1.07 -2.48 116.66 112.20 1xcx n ARG 61 Ca 0.01 0.13 0.04 0.00 -0.77 0.00 0.00 57.85 57.26 1xcx n ARG 61 Cb 0.33 -1.50 0.31 0.00 -1.02 0.00 0.00 32.46 30.58 1xcx n ARG 61 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1xcx n TYR 62 N -1.35 1.63 -3.72 -1.55 4.01 -0.97 -4.67 117.16 110.54 1xcx n TYR 62 Ca 0.08 -0.97 -0.28 0.00 -0.16 0.00 0.00 57.90 56.57 1xcx n TYR 62 Cb 0.17 -0.47 -0.12 0.00 -0.31 0.00 0.00 39.34 38.61 1xcx n TYR 62 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1xcx s GLN 63 N -2.89 1.81 0.49 -0.72 -0.21 -1.03 -4.87 119.66 112.24 1xcx s GLN 63 Ca 0.49 -2.76 -0.24 0.00 0.02 0.00 0.00 55.36 52.87 1xcx s GLN 63 Cb 0.39 -2.66 -0.07 0.00 1.00 0.00 0.00 33.01 31.67 1xcx s GLN 63 CO 0.11 -1.29 1.36 -2.30 -2.12 0.00 0.00 175.29 171.05 1xcx n PRO 64 N 2.49 1.93 -0.00 2.91 -0.02 -1.26 -1.66 135.00 139.39 1xcx n PRO 64 Ca 0.21 0.70 -0.00 0.00 -2.02 0.00 0.00 63.50 62.38 1xcx n PRO 64 Cb 0.39 -2.55 -0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1xcx n PRO 64 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xcx n VAL 65 N -0.59 0.01 -3.83 -1.45 0.31 -0.34 -2.10 118.33 110.34 1xcx n VAL 65 Ca 0.08 -0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.38 1xcx n VAL 65 Cb 0.42 -0.80 0.02 0.00 -0.91 0.00 0.00 33.84 32.58 1xcx n VAL 65 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1xcx n SER 66 N -1.94 -1.43 -1.31 4.52 3.41 -1.21 -4.76 113.62 110.91 1xcx n SER 66 Ca -0.00 -1.73 0.08 0.00 -0.26 0.00 0.00 58.87 56.95 1xcx n SER 66 Cb 0.44 2.32 0.31 0.00 -0.26 0.00 0.00 64.21 67.02 1xcx n SER 66 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1xcx n TYR 67 N -0.61 1.32 -2.22 7.33 4.01 -1.26 -3.48 117.16 122.25 1xcx n TYR 67 Ca -0.02 -0.72 -0.41 0.00 -0.16 0.00 0.00 57.90 56.60 1xcx n TYR 67 Cb 0.49 -0.31 -0.03 0.00 -0.31 0.00 0.00 39.34 39.18 1xcx n TYR 67 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1xcx s LYS 68 N -2.31 4.41 -1.37 -0.72 1.02 -1.26 -4.76 119.74 114.75 1xcx s LYS 68 Ca 0.46 2.07 -0.16 0.00 0.02 0.00 0.00 55.97 58.35 1xcx s LYS 68 Cb 0.33 -3.16 0.06 0.00 -0.52 0.00 0.00 37.83 34.54 1xcx s LYS 68 CO 0.16 -0.18 1.96 1.28 -0.92 0.00 0.00 175.35 177.65 1xcx n LEU 69 N 1.97 5.86 -3.43 3.17 4.32 -1.26 -0.55 117.00 127.09 1xcx n LEU 69 Ca 0.04 -4.05 -0.17 0.00 -0.02 0.00 0.00 56.01 51.80 1xcx n LEU 69 Cb 0.43 -1.70 -0.11 0.00 -1.62 0.00 0.00 43.42 40.42 1xcx n LEU 69 CO 0.58 0.63 -0.18 0.00 -1.22 0.00 0.00 177.39 177.19 1xcx n THR 71 N 5.31 0.00 0.25 0.00 -2.24 -0.77 -3.74 114.28 113.09 1xcx n THR 71 Ca -0.03 -2.02 0.10 0.00 -2.27 0.00 0.00 64.05 59.83 1xcx n THR 71 Cb 0.47 1.12 0.47 0.00 -2.10 0.00 0.00 70.33 70.29 1xcx n THR 71 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1xcx n ARG 72 N -0.59 0.13 0.19 -0.78 1.74 -1.26 -1.09 116.66 115.01 1xcx n ARG 72 Ca 0.04 0.52 0.12 0.00 -0.77 0.00 0.00 57.85 57.76 1xcx n ARG 72 Cb 0.58 -1.85 0.14 0.00 -1.02 0.00 0.00 32.46 30.31 1xcx n ARG 72 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1xcx h SER 73 N 0.00 0.00 -3.29 0.55 0.02 -1.92 -3.43 113.55 105.48 1xcx h SER 73 Ca 0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1xcx h SER 73 Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1xcx h SER 73 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1xcx n GLY 74 N 1.12 0.89 1.73 -3.77 0.00 -0.25 -1.30 105.19 103.61 1xcx n GLY 74 Ca 0.03 -1.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.14 1xcx n GLY 74 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xcx n ASN 75 N 0.00 0.85 0.04 1.61 0.23 -1.26 -1.85 115.26 114.88 1xcx n ASN 75 Ca 0.00 -1.64 -0.00 0.00 -0.53 0.00 0.00 54.58 52.41 1xcx n ASN 75 Cb 0.00 -0.21 0.29 0.00 -2.08 0.00 0.00 39.78 37.78 1xcx n ASN 75 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1xcx h GLU 76 N 0.00 0.42 -0.30 -3.83 4.81 -1.56 -1.22 114.58 112.90 1xcx h GLU 76 Ca -0.13 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 58.94 1xcx h GLU 76 Cb 0.55 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1xcx h GLU 76 CO 0.17 0.54 -0.02 -0.44 -0.73 0.00 0.00 179.01 178.54 1xcx h ASP 77 N 0.40 0.53 -0.16 1.04 3.32 -1.95 -0.18 116.42 119.42 1xcx h ASP 77 Ca 0.08 -0.32 -0.08 0.00 0.02 0.00 0.00 57.03 56.72 1xcx h ASP 77 Cb 0.45 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1xcx h ASP 77 CO 0.03 0.73 -0.15 -0.33 -1.72 0.00 0.00 179.24 177.79 1xcx h GLU 78 N 0.33 0.55 -0.10 3.56 5.08 -1.91 -0.34 114.58 121.76 1xcx h GLU 78 Ca 0.08 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1xcx h GLU 78 Cb 0.46 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1xcx h GLU 78 CO 0.02 0.68 -0.01 0.35 -1.00 0.00 0.00 179.01 179.05 1xcx h PHE 79 N 0.50 0.20 -0.58 4.33 3.57 -0.99 -1.44 116.94 122.53 1xcx h PHE 79 Ca 0.09 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1xcx h PHE 79 Cb 0.55 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1xcx h PHE 79 CO 0.02 0.45 0.23 0.00 -2.23 0.00 0.00 178.31 176.79 1xcx h ARG 80 N -0.12 0.84 -0.50 1.11 3.08 -0.84 -1.95 114.38 115.99 1xcx h ARG 80 Ca 0.03 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1xcx h ARG 80 Cb 0.38 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1xcx h ARG 80 CO 0.01 0.68 0.28 -0.97 -1.07 0.00 0.00 179.97 178.90 1xcx h ASN 81 N 0.83 0.62 -0.26 7.04 -0.73 -0.88 -1.70 115.58 120.49 1xcx h ASN 81 Ca 0.20 -0.09 -0.01 0.00 1.87 0.00 0.00 56.30 58.28 1xcx h ASN 81 Cb 0.16 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 1xcx h ASN 81 CO -0.02 0.52 0.14 -0.03 -0.37 0.00 0.00 177.43 177.67 1xcx h MET 82 N 0.66 0.37 -0.63 6.67 4.05 -0.77 -1.61 114.93 123.66 1xcx h MET 82 Ca 0.18 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.53 1xcx h MET 82 Cb 0.04 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.74 1xcx h MET 82 CO -0.03 0.33 0.32 0.28 0.23 0.00 0.00 176.91 178.05 1xcx h VAL 83 N 0.31 1.21 0.15 -5.77 2.07 -1.21 -1.09 116.25 111.92 1xcx h VAL 83 Ca 0.09 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1xcx h VAL 83 Cb 0.08 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1xcx h VAL 83 CO -0.01 0.24 -0.07 0.74 0.02 0.00 0.00 177.57 178.48 1xcx h THR 84 N 0.87 0.95 -0.72 2.57 2.02 -1.21 -0.61 112.91 116.78 1xcx h THR 84 Ca 0.22 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1xcx h THR 84 Cb 0.09 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 1xcx h THR 84 CO -0.03 0.10 0.38 0.03 0.37 0.00 0.00 175.52 176.37 1xcx h ARG 85 N -0.40 1.02 -0.21 6.66 3.08 -1.24 -0.72 114.38 122.57 1xcx h ARG 85 Ca -0.02 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 1xcx h ARG 85 Cb 0.31 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1xcx h ARG 85 CO 0.03 0.77 0.06 0.00 -1.07 0.00 0.00 179.97 179.77 1xcx h ASN 87 N 0.17 0.96 0.44 0.00 2.35 -0.90 -0.30 115.58 118.29 1xcx h ASN 87 Ca 0.07 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1xcx h ASN 87 Cb 0.25 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1xcx h ASN 87 CO -0.00 0.77 0.00 0.59 -1.65 0.00 0.00 177.43 177.14 1xcx n ASN 88 N -4.35 0.34 -0.62 5.81 3.02 -0.29 -1.28 115.26 117.88 1xcx n ASN 88 Ca 0.08 0.60 0.06 0.00 -0.03 0.00 0.00 54.58 55.29 1xcx n ASN 88 Cb 0.10 -0.67 0.13 0.00 -0.61 0.00 0.00 39.78 38.73 1xcx n ASN 88 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1xcx n VAL 89 N -1.89 0.66 -0.94 2.41 3.14 -0.53 -4.98 118.33 116.20 1xcx n VAL 89 Ca 0.02 -0.83 0.00 0.00 -2.96 0.00 0.00 64.34 60.57 1xcx n VAL 89 Cb 0.15 0.75 0.00 0.00 -1.06 0.00 0.00 33.84 33.68 1xcx n VAL 89 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1xcx n GLY 90 N 0.62 0.48 3.37 7.55 0.00 -0.41 -4.78 105.19 112.03 1xcx n GLY 90 Ca 0.11 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 1xcx n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xcx s VAL 91 N -2.00 3.86 0.56 1.61 1.01 -0.24 -4.40 120.40 120.81 1xcx s VAL 91 Ca 0.00 -0.39 -0.11 0.00 0.00 0.00 0.00 61.98 61.48 1xcx s VAL 91 Cb 0.00 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 1xcx s VAL 91 CO 0.00 0.33 0.96 -0.13 0.00 0.00 0.00 175.10 176.26 1xcx s ARG 92 N 1.54 3.67 -0.11 2.72 1.81 -0.73 -3.14 118.95 124.71 1xcx s ARG 92 Ca 0.05 0.67 0.03 0.00 -1.72 0.00 0.00 55.73 54.77 1xcx s ARG 92 Cb -0.15 -2.16 -0.00 0.00 -0.45 0.00 0.00 34.95 32.18 1xcx s ARG 92 CO 0.01 -0.42 -0.21 0.42 -0.68 0.00 0.00 175.30 174.42 1xcx s ILE 93 N -2.95 2.30 -0.12 1.52 -1.09 -1.26 0.13 121.20 119.73 1xcx s ILE 93 Ca 0.54 -0.93 0.03 0.00 -2.23 0.00 0.00 60.65 58.06 1xcx s ILE 93 Cb -0.11 -1.90 0.00 0.00 -1.58 0.00 0.00 42.46 38.88 1xcx s ILE 93 CO 0.47 0.55 -0.23 -0.31 -1.23 0.00 0.00 174.94 174.19 1xcx s TYR 94 N 0.32 2.62 -0.07 3.97 2.02 0.86 -1.07 117.35 125.99 1xcx s TYR 94 Ca -0.16 -1.18 -0.15 0.00 -0.37 0.00 0.00 57.07 55.21 1xcx s TYR 94 Cb -0.17 -1.77 -0.05 0.00 -0.40 0.00 0.00 41.96 39.57 1xcx s TYR 94 CO 0.08 -0.51 0.39 0.08 -1.57 0.00 0.00 175.55 174.02 1xcx s VAL 95 N 0.57 5.16 -0.68 0.71 1.01 -0.65 -1.26 120.40 125.26 1xcx s VAL 95 Ca -0.13 0.77 -0.27 0.00 0.00 0.00 0.00 61.98 62.35 1xcx s VAL 95 Cb -0.17 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.54 1xcx s VAL 95 CO 0.04 0.47 1.23 -0.62 0.00 0.00 0.00 175.10 176.22 1xcx s ASP 96 N -0.28 6.25 -0.40 3.32 -1.08 -1.19 -0.58 116.67 122.72 1xcx s ASP 96 Ca 0.22 -0.30 -0.20 0.00 -0.52 0.00 0.00 52.55 51.75 1xcx s ASP 96 Cb -0.15 -2.55 0.01 0.00 -1.46 0.00 0.00 42.92 38.77 1xcx s ASP 96 CO 0.10 -1.69 0.59 0.00 0.52 0.00 0.00 175.17 174.68 1xcx s ALA 97 N 5.37 3.41 -0.90 3.66 0.00 0.09 -4.16 121.76 129.21 1xcx s ALA 97 Ca 0.37 -1.13 -0.15 0.00 0.00 0.00 0.00 51.96 51.05 1xcx s ALA 97 Cb -0.08 -3.18 0.20 0.00 0.00 0.00 0.00 23.12 20.05 1xcx s ALA 97 CO 0.18 -1.55 0.93 0.08 0.00 0.00 0.00 175.76 175.40 1xcx s VAL 98 N 2.62 5.40 -0.77 0.00 1.01 -1.26 -1.61 120.40 125.79 1xcx s VAL 98 Ca 0.21 -2.35 0.07 0.00 0.00 0.00 0.00 61.98 59.91 1xcx s VAL 98 Cb -0.15 -4.59 0.04 0.00 0.00 0.00 0.00 36.38 31.68 1xcx s VAL 98 CO 0.16 -1.20 0.65 2.30 0.00 0.00 0.00 175.10 177.01 1xcx n ILE 99 N 4.27 0.00 0.08 2.22 -5.35 -1.26 -4.63 119.36 114.69 1xcx n ILE 99 Ca 0.19 -0.48 -0.07 0.00 -0.27 0.00 0.00 62.75 62.12 1xcx n ILE 99 Cb 0.47 1.12 -0.06 0.00 -1.74 0.00 0.00 39.64 39.43 1xcx n ILE 99 CO 0.00 0.00 0.00 -1.13 -1.76 0.00 0.00 176.55 173.66 1xcx h ASN 100 N 1.14 0.07 -5.40 7.28 -1.24 -1.87 -3.46 115.58 112.10 1xcx h ASN 100 Ca 0.00 -0.07 -0.20 0.00 0.71 0.00 0.00 56.30 56.74 1xcx h ASN 100 Cb 0.26 -0.02 -0.07 0.00 0.73 0.00 0.00 38.32 39.22 1xcx h ASN 100 CO 0.00 0.97 -0.13 -1.38 -1.29 0.00 0.00 177.43 175.60 1xcx s HIS 101 N -2.92 0.81 0.00 0.67 -3.43 -1.26 -1.91 115.29 107.26 1xcx s HIS 101 Ca -0.00 -1.12 0.00 0.00 -0.80 0.00 0.00 55.06 53.13 1xcx s HIS 101 Cb 0.10 0.07 0.00 0.00 -1.43 0.00 0.00 32.58 31.32 1xcx s HIS 101 CO 0.82 -1.15 0.00 -1.33 -2.00 0.00 0.00 174.74 171.08 1xcx n MET 102 N -0.52 3.77 -1.48 -0.38 2.81 -0.30 -4.59 117.12 116.44 1xcx n MET 102 Ca -0.01 0.00 -0.30 0.00 -1.81 0.00 0.00 57.70 55.58 1xcx n MET 102 Cb 0.62 0.00 0.22 0.00 -0.71 0.00 0.00 33.22 33.34 1xcx n MET 102 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xcx s GLY 104 N -4.38 2.56 0.63 0.00 0.00 -1.26 -1.80 107.32 103.08 1xcx s GLY 104 Ca 0.73 1.54 0.41 0.00 0.00 0.00 0.00 44.72 47.40 1xcx s GLY 104 CO 0.55 2.37 2.26 3.45 0.00 0.00 0.00 173.10 181.72 1xcx h ASN 105 N 3.92 0.00 -0.20 1.64 -1.07 -1.65 -2.14 115.58 116.07 1xcx h ASN 105 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.88 1xcx h ASN 105 Cb 1.23 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.48 1xcx h ASN 105 CO 0.71 0.00 0.00 0.00 0.07 0.00 0.00 177.43 178.22 1xcx n ALA 106 N -2.09 2.49 -1.83 4.14 0.00 -1.26 -4.18 120.51 117.78 1xcx n ALA 106 Ca -0.02 -0.67 -0.41 0.00 0.00 0.00 0.00 53.44 52.35 1xcx n ALA 106 Cb 0.14 -1.01 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 1xcx n ALA 106 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xcx s VAL 107 N -1.75 3.38 0.30 0.00 1.01 -0.81 -4.98 120.40 117.55 1xcx s VAL 107 Ca 0.34 1.34 -0.29 0.00 0.00 0.00 0.00 61.98 63.37 1xcx s VAL 107 Cb 0.20 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 32.62 1xcx s VAL 107 CO 0.29 0.30 1.37 -0.44 0.00 0.00 0.00 175.10 176.62 1xcx s SER 108 N -0.59 6.69 0.66 3.32 0.01 -1.26 -4.36 113.70 118.17 1xcx s SER 108 Ca 0.47 2.70 -0.15 0.00 1.31 0.00 0.00 55.95 60.28 1xcx s SER 108 Cb -0.33 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.26 1xcx s SER 108 CO 0.42 -0.63 1.12 0.00 0.41 0.00 0.00 173.24 174.56 1xcx s ALA 109 N -0.63 2.45 0.00 1.44 0.00 -1.26 -4.83 121.76 118.93 1xcx s ALA 109 Ca 0.54 0.59 0.00 0.00 0.00 0.00 0.00 51.96 53.09 1xcx s ALA 109 Cb -0.41 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1xcx s ALA 109 CO 0.49 -1.30 0.00 0.41 0.00 0.00 0.00 175.76 175.36 1xcx n GLY 110 N -0.40 0.32 1.02 0.00 0.00 -0.27 -4.92 105.19 100.94 1xcx n GLY 110 Ca 0.11 -1.32 0.03 0.00 0.00 0.00 0.00 46.02 44.84 1xcx n GLY 110 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xcx n THR 111 N 9.00 1.53 -1.62 2.61 -2.24 -1.26 -1.45 114.28 120.84 1xcx n THR 111 Ca 0.00 -2.62 -0.41 0.00 -2.27 0.00 0.00 64.05 58.76 1xcx n THR 111 Cb 0.00 0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 68.35 1xcx n THR 111 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1xcx n SER 112 N -0.59 6.22 -4.39 3.42 2.88 -1.26 -4.42 113.62 115.48 1xcx n SER 112 Ca 0.16 -2.77 -0.20 0.00 -1.33 0.00 0.00 58.87 54.73 1xcx n SER 112 Cb 0.85 -1.59 -0.10 0.00 -0.75 0.00 0.00 64.21 62.62 1xcx n SER 112 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1xcx s SER 113 N 2.42 2.76 0.00 -3.46 1.04 -1.26 -0.48 113.70 114.72 1xcx s SER 113 Ca 0.56 -1.09 0.16 0.00 0.48 0.00 0.00 55.95 56.06 1xcx s SER 113 Cb 0.16 -0.17 0.84 0.00 0.10 0.00 0.00 66.02 66.94 1xcx s SER 113 CO -0.07 -0.21 1.43 0.35 0.98 0.00 0.00 173.24 175.72 1xcx n THR 114 N -0.48 0.43 -0.75 2.02 -2.24 -0.48 -2.85 114.28 109.93 1xcx n THR 114 Ca -0.07 0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1xcx n THR 114 Cb 0.61 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 1xcx n THR 114 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xcx n GLY 116 N -0.18 0.96 3.77 0.00 0.00 -1.13 -5.00 105.19 103.61 1xcx n GLY 116 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1xcx n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xcx s SER 117 N -2.92 6.20 0.21 1.61 0.01 -1.26 -4.83 113.70 112.72 1xcx s SER 117 Ca 0.00 2.85 -0.19 0.00 1.31 0.00 0.00 55.95 59.92 1xcx s SER 117 Cb 0.00 -2.65 -0.08 0.00 0.21 0.00 0.00 66.02 63.50 1xcx s SER 117 CO 0.00 -0.95 0.71 -0.47 0.41 0.00 0.00 173.24 172.94 1xcx s TYR 118 N -1.19 3.65 -0.03 2.43 5.04 -1.26 -4.44 117.35 121.54 1xcx s TYR 118 Ca 0.57 1.36 -0.23 0.00 -2.44 0.00 0.00 57.07 56.32 1xcx s TYR 118 Cb -0.42 -2.60 0.05 0.00 0.35 0.00 0.00 41.96 39.34 1xcx s TYR 118 CO 0.55 0.35 0.51 -0.59 -1.34 0.00 0.00 175.55 175.04 1xcx s PHE 119 N -1.50 -0.44 -0.35 4.97 -0.71 -0.53 -4.35 117.98 115.08 1xcx s PHE 119 Ca 0.42 0.72 -0.01 0.00 -1.04 0.00 0.00 56.93 57.02 1xcx s PHE 119 Cb -0.17 0.27 0.13 0.00 -1.21 0.00 0.00 43.02 42.04 1xcx s PHE 119 CO 0.21 -0.51 0.19 1.21 -1.34 0.00 0.00 175.22 174.97 1xcx s ASN 120 N -1.28 3.30 0.22 1.98 3.84 0.23 -1.11 114.94 122.11 1xcx s ASN 120 Ca -0.12 -2.00 -0.09 0.00 0.21 0.00 0.00 52.86 50.86 1xcx s ASN 120 Cb -0.02 -0.53 0.23 0.00 -0.55 0.00 0.00 41.25 40.38 1xcx s ASN 120 CO 0.07 -0.34 1.84 -0.65 -2.79 0.00 0.00 177.10 175.23 1xcx h PRO 121 N 7.39 0.82 -0.94 0.43 0.11 -1.80 -0.08 132.00 137.93 1xcx h PRO 121 Ca -0.03 -0.05 0.14 0.00 0.11 0.00 0.00 66.00 66.17 1xcx h PRO 121 Cb 0.98 -0.19 -0.09 0.00 0.11 0.00 0.00 31.00 31.81 1xcx h PRO 121 CO 0.35 0.55 0.56 0.78 -0.21 0.00 0.00 178.00 180.03 1xcx h GLY 122 N 0.85 1.57 -2.60 -0.55 0.00 -1.80 -1.35 103.07 99.19 1xcx h GLY 122 Ca 0.31 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1xcx h GLY 122 CO -0.14 0.05 0.00 -1.14 0.00 0.00 0.00 176.54 175.31 1xcx n SER 123 N -4.74 4.27 -3.36 0.19 3.41 -1.11 -4.96 113.62 107.33 1xcx n SER 123 Ca 0.19 -2.34 -0.24 0.00 -0.26 0.00 0.00 58.87 56.22 1xcx n SER 123 Cb 0.42 -0.51 0.05 0.00 -0.26 0.00 0.00 64.21 63.91 1xcx n SER 123 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xcx n ARG 124 N 1.00 -6.17 -3.91 4.33 3.00 -0.51 -4.36 116.66 110.04 1xcx n ARG 124 Ca 0.23 0.83 -0.35 0.00 -0.01 0.00 0.00 57.85 58.54 1xcx n ARG 124 Cb 0.77 -5.77 -0.14 0.00 0.00 0.00 0.00 32.46 27.33 1xcx n ARG 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1xcx s ASP 125 N -3.01 4.44 -0.51 0.55 1.11 -0.10 -2.93 116.67 116.21 1xcx s ASP 125 Ca 0.46 -0.35 0.05 0.00 0.18 0.00 0.00 52.55 52.89 1xcx s ASP 125 Cb -0.21 -1.77 0.20 0.00 1.07 0.00 0.00 42.92 42.21 1xcx s ASP 125 CO 0.57 -0.01 0.48 0.49 1.18 0.00 0.00 175.17 177.88 1xcx n PHE 126 N 4.77 0.93 0.30 4.23 3.01 -0.69 -0.60 117.46 129.41 1xcx n PHE 126 Ca -0.18 -3.74 0.19 0.00 1.01 0.00 0.00 57.45 54.73 1xcx n PHE 126 Cb 0.51 -0.22 1.00 0.00 -0.01 0.00 0.00 39.48 40.76 1xcx n PHE 126 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1xcx h PRO 127 N 4.97 0.00 0.00 -1.08 0.13 -1.76 -0.26 132.00 134.00 1xcx h PRO 127 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1xcx h PRO 127 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1xcx h PRO 127 CO 0.55 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.32 1xcx n ALA 128 N -2.11 1.89 -0.07 -0.56 0.00 -1.26 -4.04 120.51 114.36 1xcx n ALA 128 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.39 1xcx n ALA 128 Cb 0.22 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.27 1xcx n ALA 128 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xcx h VAL 129 N 0.00 0.00 -2.68 0.00 2.07 -1.73 -3.44 116.25 110.47 1xcx h VAL 129 Ca 0.00 -1.00 -0.57 0.00 0.82 0.00 0.00 66.70 65.96 1xcx h VAL 129 Cb 0.44 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 1xcx h VAL 129 CO 0.00 0.00 -0.53 -2.16 0.02 0.00 0.00 177.57 174.90 1xcx s PRO 130 N -2.14 3.10 0.07 1.57 0.04 -1.26 -5.03 135.00 131.36 1xcx s PRO 130 Ca -0.13 -0.76 0.06 0.00 0.04 0.00 0.00 61.00 60.22 1xcx s PRO 130 Cb 0.02 -2.77 -0.03 0.00 0.04 0.00 0.00 34.50 31.76 1xcx s PRO 130 CO 0.19 0.50 -0.16 0.71 0.04 0.00 0.00 177.00 178.28 1xcx s TYR 131 N -1.73 1.39 0.15 0.56 2.02 -0.16 -4.97 117.35 114.62 1xcx s TYR 131 Ca 0.32 -0.43 0.02 0.00 -0.37 0.00 0.00 57.07 56.61 1xcx s TYR 131 Cb -0.11 -0.79 -0.01 0.00 -0.40 0.00 0.00 41.96 40.66 1xcx s TYR 131 CO 0.25 0.09 0.07 -1.13 -1.57 0.00 0.00 175.55 173.27 1xcx n SER 132 N 1.35 0.62 0.19 2.29 3.41 -1.24 -1.70 113.62 118.54 1xcx n SER 132 Ca -0.20 -1.83 0.15 0.00 -0.26 0.00 0.00 58.87 56.73 1xcx n SER 132 Cb 0.54 0.47 0.78 0.00 -0.26 0.00 0.00 64.21 65.74 1xcx n SER 132 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1xcx h GLY 133 N 0.67 0.00 2.00 5.00 0.00 -1.73 -1.25 103.07 107.76 1xcx h GLY 133 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.22 1xcx h GLY 133 CO 0.17 0.00 0.00 0.79 0.00 0.00 0.00 176.54 177.50 1xcx n TRP 134 N -4.06 0.02 -0.30 5.60 7.02 -1.26 -3.20 117.44 121.26 1xcx n TRP 134 Ca 0.01 0.01 0.11 0.00 -1.02 0.00 0.00 57.50 56.62 1xcx n TRP 134 Cb 0.29 -0.51 0.30 0.00 -2.42 0.00 0.00 31.31 28.97 1xcx n TRP 134 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1xcx n ASP 135 N -1.52 3.85 -4.46 -0.99 8.00 -0.47 -4.94 116.55 116.01 1xcx n ASP 135 Ca 0.04 -2.00 -0.24 0.00 0.71 0.00 0.00 54.79 53.30 1xcx n ASP 135 Cb 0.20 -0.45 -0.10 0.00 -0.02 0.00 0.00 41.12 40.75 1xcx n ASP 135 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1xcx s PHE 136 N -1.04 2.27 -1.02 1.24 0.08 -1.19 -0.77 117.98 117.54 1xcx s PHE 136 Ca 0.46 -0.34 0.05 0.00 0.12 0.00 0.00 56.93 57.22 1xcx s PHE 136 Cb 0.24 -0.99 0.24 0.00 -0.57 0.00 0.00 43.02 41.95 1xcx s PHE 136 CO 0.32 0.70 0.94 0.09 -0.10 0.00 0.00 175.22 177.17 1xcx n ASN 137 N -0.59 2.20 -0.34 1.36 3.02 0.75 -4.47 115.26 117.20 1xcx n ASN 137 Ca -0.05 -2.23 0.12 0.00 -0.03 0.00 0.00 54.58 52.39 1xcx n ASN 137 Cb 0.60 -0.48 0.31 0.00 -0.61 0.00 0.00 39.78 39.60 1xcx n ASN 137 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1xcx h ASP 138 N 1.24 0.67 0.74 6.41 3.32 -1.87 0.14 116.42 127.07 1xcx h ASP 138 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1xcx h ASP 138 Cb 0.82 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 1xcx h ASP 138 CO 0.12 0.21 -0.14 0.61 -1.72 0.00 0.00 179.24 178.32 1xcx n GLY 139 N -1.33 -1.33 0.11 2.75 0.00 -1.26 -3.87 105.19 100.25 1xcx n GLY 139 Ca 0.22 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1xcx n GLY 139 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xcx n LYS 140 N -1.40 0.68 -2.06 1.61 4.81 0.32 -4.94 118.16 117.18 1xcx n LYS 140 Ca 0.08 0.14 -0.41 0.00 -0.87 0.00 0.00 58.31 57.26 1xcx n LYS 140 Cb 0.32 -1.62 -0.02 0.00 0.02 0.00 0.00 35.03 33.73 1xcx n LYS 140 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1xcx n LYS 142 N 1.33 1.87 -2.11 0.00 4.01 -1.26 -4.99 118.16 117.00 1xcx n LYS 142 Ca 0.02 -1.71 -0.32 0.00 -0.51 0.00 0.00 58.31 55.80 1xcx n LYS 142 Cb 0.41 -1.27 -0.01 0.00 -0.51 0.00 0.00 35.03 33.66 1xcx n LYS 142 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1xcx s THR 143 N -1.01 4.42 0.29 -0.18 -4.23 -1.26 -4.96 115.64 108.71 1xcx s THR 143 Ca 0.20 1.01 0.19 0.00 -1.18 0.00 0.00 61.69 61.92 1xcx s THR 143 Cb 0.12 -3.68 0.16 0.00 1.34 0.00 0.00 72.50 70.44 1xcx s THR 143 CO 0.16 -0.81 1.85 1.23 -0.54 0.00 0.00 174.62 176.51 1xcx h GLY 144 N 0.34 0.00 0.47 3.99 0.00 -1.95 -3.00 103.07 102.91 1xcx h GLY 144 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1xcx h GLY 144 CO 0.61 0.00 -1.04 -1.14 0.00 0.00 0.00 176.54 174.97 1xcx n SER 145 N -3.73 0.64 0.00 0.19 3.41 -1.26 -4.95 113.62 107.92 1xcx n SER 145 Ca -0.01 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 1xcx n SER 145 Cb 0.41 0.87 0.00 0.00 -0.26 0.00 0.00 64.21 65.23 1xcx n SER 145 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xcx n GLY 146 N 1.40 1.79 3.88 5.00 0.00 -1.14 -5.02 105.19 111.11 1xcx n GLY 146 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1xcx n GLY 146 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xcx s ASP 147 N -3.30 4.96 -0.11 1.61 1.01 -1.26 -2.48 116.67 117.11 1xcx s ASP 147 Ca 0.00 -0.83 -0.30 0.00 0.71 0.00 0.00 52.55 52.13 1xcx s ASP 147 Cb 0.00 -0.40 -0.03 0.00 1.01 0.00 0.00 42.92 43.50 1xcx s ASP 147 CO 0.00 -0.74 1.30 -0.63 0.21 0.00 0.00 175.17 175.31 1xcx s ILE 148 N -2.53 4.15 -0.06 0.77 1.01 -0.67 -4.68 121.20 119.19 1xcx s ILE 148 Ca 0.47 1.43 0.09 0.00 0.00 0.00 0.00 60.65 62.63 1xcx s ILE 148 Cb -0.03 -3.92 -0.12 0.00 0.01 0.00 0.00 42.46 38.40 1xcx s ILE 148 CO 0.27 -0.08 0.09 -0.62 0.00 0.00 0.00 174.94 174.61 1xcx n GLU 149 N 6.15 1.75 -3.63 2.79 1.02 -1.26 -4.81 120.64 122.64 1xcx n GLU 149 Ca 0.13 -0.03 -0.16 0.00 -0.02 0.00 0.00 57.16 57.08 1xcx n GLU 149 Cb 0.45 -1.23 -0.14 0.00 -0.02 0.00 0.00 31.44 30.50 1xcx n GLU 149 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1xcx s ASN 150 N -3.74 0.80 0.00 1.62 3.04 -1.26 -5.01 114.94 110.38 1xcx s ASN 150 Ca -0.04 0.28 0.22 0.00 0.04 0.00 0.00 52.86 53.35 1xcx s ASN 150 Cb 0.04 0.40 1.30 0.00 -1.54 0.00 0.00 41.25 41.45 1xcx s ASN 150 CO 0.38 -0.26 1.69 -1.22 -3.04 0.00 0.00 177.10 174.65 1xcx n TYR 151 N 5.33 0.00 1.31 0.43 4.02 -1.26 -2.69 117.16 124.29 1xcx n TYR 151 Ca -0.05 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.97 1xcx n TYR 151 Cb 0.50 0.00 0.45 0.00 -0.02 0.00 0.00 39.34 40.26 1xcx n TYR 151 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1xcx n ASN 152 N -0.97 0.94 -4.13 7.72 5.03 -1.26 -4.44 115.26 118.15 1xcx n ASN 152 Ca 0.16 -0.87 -0.37 0.00 0.87 0.00 0.00 54.58 54.37 1xcx n ASN 152 Cb 0.07 0.07 -0.10 0.00 -1.02 0.00 0.00 39.78 38.81 1xcx n ASN 152 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1xcx s ASP 153 N -2.45 5.34 0.62 6.41 2.15 -1.10 -4.79 116.67 122.86 1xcx s ASP 153 Ca 0.27 -2.36 0.31 0.00 0.43 0.00 0.00 52.55 51.20 1xcx s ASP 153 Cb 0.20 -1.87 1.75 0.00 -0.30 0.00 0.00 42.92 42.69 1xcx s ASP 153 CO 0.49 -0.50 2.07 0.00 -0.17 0.00 0.00 175.17 177.07 1xcx h ALA 154 N 7.69 1.61 -0.00 3.66 0.00 -1.86 -2.79 119.26 127.58 1xcx h ALA 154 Ca -0.09 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xcx h ALA 154 Cb 1.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1xcx h ALA 154 CO 0.73 -0.31 -0.01 1.15 0.00 0.00 0.00 179.25 180.81 1xcx h THR 155 N 0.00 1.53 0.00 0.00 2.02 -1.94 -3.23 112.91 111.29 1xcx h THR 155 Ca 0.07 -1.58 -0.03 0.00 0.77 0.00 0.00 66.41 65.63 1xcx h THR 155 Cb 0.54 2.60 -0.00 0.00 -1.74 0.00 0.00 68.15 69.55 1xcx h THR 155 CO -0.00 0.41 -0.14 0.06 0.37 0.00 0.00 175.52 176.22 1xcx h GLN 156 N -0.66 0.00 -0.15 6.66 3.07 -1.84 -0.89 115.11 121.31 1xcx h GLN 156 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.69 1xcx h GLN 156 Cb 0.68 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.23 1xcx h GLN 156 CO 0.00 0.14 -0.12 0.28 0.09 0.00 0.00 178.83 179.23 1xcx h VAL 157 N 0.00 1.17 0.06 1.86 2.07 -1.55 -1.44 116.25 118.42 1xcx h VAL 157 Ca -0.00 -0.75 -0.36 0.00 0.82 0.00 0.00 66.70 66.41 1xcx h VAL 157 Cb 0.52 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 1xcx h VAL 157 CO 0.02 0.23 -2.08 0.54 0.02 0.00 0.00 177.57 176.30 1xcx n ARG 158 N -4.29 0.70 0.00 1.57 3.00 -0.82 -4.48 116.66 112.36 1xcx n ARG 158 Ca -0.01 0.22 0.11 0.00 -0.01 0.00 0.00 57.85 58.16 1xcx n ARG 158 Cb 0.26 -1.67 0.04 0.00 0.00 0.00 0.00 32.46 31.09 1xcx n ARG 158 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1xcx n ASP 159 N -3.28 0.77 -4.86 0.55 8.00 -0.40 -4.69 116.55 112.64 1xcx n ASP 159 Ca -0.32 -0.64 -0.21 0.00 0.71 0.00 0.00 54.79 54.33 1xcx n ASP 159 Cb 1.05 0.69 -0.04 0.00 -0.02 0.00 0.00 41.12 42.80 1xcx n ASP 159 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xcx s ARG 161 N -4.07 4.29 -0.38 0.00 0.52 -1.03 -4.66 118.95 113.62 1xcx s ARG 161 Ca 0.45 1.65 -0.28 0.00 -0.52 0.00 0.00 55.73 57.03 1xcx s ARG 161 Cb -0.04 -3.66 -0.01 0.00 0.52 0.00 0.00 34.95 31.76 1xcx s ARG 161 CO 0.27 -0.57 1.73 -1.17 0.02 0.00 0.00 175.30 175.58 1xcx s LEU 162 N 2.85 3.50 -1.50 2.53 2.96 -1.25 -1.67 118.68 126.09 1xcx s LEU 162 Ca 0.55 1.09 -0.01 0.00 -0.22 0.00 0.00 54.13 55.54 1xcx s LEU 162 Cb -0.23 -3.40 0.01 0.00 0.50 0.00 0.00 46.19 43.07 1xcx s LEU 162 CO 0.18 -1.73 0.19 0.35 -1.32 0.00 0.00 176.35 174.02 1xcx n THR 163 N 7.33 -1.82 0.00 3.68 -2.24 -1.26 -1.38 114.28 118.59 1xcx n THR 163 Ca 0.21 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1xcx n THR 163 Cb 0.48 -1.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.03 1xcx n THR 163 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xcx n GLY 164 N -2.30 2.68 3.68 3.38 0.00 -1.21 -4.96 105.19 106.46 1xcx n GLY 164 Ca -0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 1xcx n GLY 164 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xcx s LEU 165 N 0.00 4.39 -0.14 0.99 1.02 -0.48 -1.62 118.68 122.84 1xcx s LEU 165 Ca 0.00 2.63 -0.34 0.00 0.02 0.00 0.00 54.13 56.44 1xcx s LEU 165 Cb 0.00 -3.56 -0.12 0.00 0.02 0.00 0.00 46.19 42.54 1xcx s LEU 165 CO 0.00 -0.98 1.93 0.18 0.02 0.00 0.00 176.35 177.50 1xcx n LEU 166 N 6.15 3.23 -4.62 1.79 4.77 -0.74 -3.92 117.00 123.65 1xcx n LEU 166 Ca 0.18 0.87 -0.42 0.00 -0.03 0.00 0.00 56.01 56.61 1xcx n LEU 166 Cb 0.40 -1.35 -0.05 0.00 -2.33 0.00 0.00 43.42 40.08 1xcx n LEU 166 CO 0.65 -0.19 0.57 -0.62 -1.33 0.00 0.00 177.39 176.47 1xcx s ASP 167 N 4.68 6.68 0.28 -1.43 2.15 -1.26 -1.15 116.67 126.61 1xcx s ASP 167 Ca 0.96 0.74 -0.29 0.00 0.43 0.00 0.00 52.55 54.38 1xcx s ASP 167 Cb -0.72 -2.40 -0.10 0.00 -0.30 0.00 0.00 42.92 39.41 1xcx s ASP 167 CO 0.52 -0.56 1.18 -0.76 -0.17 0.00 0.00 175.17 175.38 1xcx s LEU 168 N 2.86 4.49 -1.32 -1.34 1.43 -0.80 -0.17 118.68 123.83 1xcx s LEU 168 Ca 0.32 2.39 -0.18 0.00 -1.03 0.00 0.00 54.13 55.63 1xcx s LEU 168 Cb -0.15 -3.63 0.07 0.00 0.03 0.00 0.00 46.19 42.51 1xcx s LEU 168 CO 0.11 -0.31 1.80 0.00 0.23 0.00 0.00 176.35 178.18 1xcx n ALA 169 N 1.36 3.78 0.31 4.21 0.00 0.05 -4.65 120.51 125.57 1xcx n ALA 169 Ca 0.00 -3.85 0.03 0.00 0.00 0.00 0.00 53.44 49.62 1xcx n ALA 169 Cb 0.44 -3.60 0.16 0.00 0.00 0.00 0.00 19.45 16.45 1xcx n ALA 169 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xcx n LEU 170 N 8.14 0.00 0.16 0.00 4.77 -1.26 -2.11 117.00 126.70 1xcx n LEU 170 Ca 0.49 0.19 0.10 0.00 -0.03 0.00 0.00 56.01 56.76 1xcx n LEU 170 Cb 0.45 -0.19 0.07 0.00 -2.33 0.00 0.00 43.42 41.43 1xcx n LEU 170 CO 0.78 -0.15 0.41 1.05 -1.33 0.00 0.00 177.39 178.15 1xcx h GLU 171 N 0.00 0.00 -6.55 3.23 9.09 -1.96 -3.43 114.58 114.97 1xcx h GLU 171 Ca 0.00 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 58.88 1xcx h GLU 171 Cb 0.04 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.14 1xcx h GLU 171 CO 0.00 0.08 0.54 0.15 0.05 0.00 0.00 179.01 179.84 1xcx s LYS 172 N -3.21 4.47 0.35 1.06 1.02 -0.90 -4.93 119.74 117.60 1xcx s LYS 172 Ca 0.03 1.77 0.03 0.00 0.02 0.00 0.00 55.97 57.83 1xcx s LYS 172 Cb 0.07 -3.32 0.64 0.00 -0.52 0.00 0.00 37.83 34.70 1xcx s LYS 172 CO 0.73 -0.16 1.96 0.22 -0.92 0.00 0.00 175.35 177.18 1xcx h ASP 173 N 6.21 0.63 -0.02 2.83 3.58 -1.89 -1.33 116.42 126.42 1xcx h ASP 173 Ca -0.43 -0.05 0.02 0.00 0.42 0.00 0.00 57.03 56.98 1xcx h ASP 173 Cb 1.21 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 42.09 1xcx h ASP 173 CO 0.78 0.54 -0.06 0.22 -2.88 0.00 0.00 179.24 177.83 1xcx h TYR 174 N 0.70 -0.16 -0.37 0.28 3.20 -1.95 0.12 116.97 118.80 1xcx h TYR 174 Ca 0.18 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 1xcx h TYR 174 Cb 0.07 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 1xcx h TYR 174 CO 0.01 -0.10 0.17 0.28 -1.64 0.00 0.00 178.16 176.87 1xcx h VAL 175 N -0.10 1.17 -0.85 1.81 2.07 -1.76 -1.58 116.25 117.01 1xcx h VAL 175 Ca 0.03 -0.50 0.07 0.00 0.82 0.00 0.00 66.70 67.13 1xcx h VAL 175 Cb 0.15 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1xcx h VAL 175 CO -0.08 0.18 0.55 0.03 0.02 0.00 0.00 177.57 178.27 1xcx h ARG 176 N 0.45 0.88 -0.26 1.57 3.08 -0.98 -1.99 114.38 117.14 1xcx h ARG 176 Ca 0.12 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 59.98 1xcx h ARG 176 Cb 0.13 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1xcx h ARG 176 CO -0.01 0.59 -0.43 0.77 -1.07 0.00 0.00 179.97 179.81 1xcx h SER 177 N 0.91 0.70 0.05 7.04 0.02 -0.24 -1.23 113.55 120.81 1xcx h SER 177 Ca 0.37 -0.33 -0.13 0.00 -0.84 0.00 0.00 61.79 60.86 1xcx h SER 177 Cb 0.27 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1xcx h SER 177 CO -0.14 1.04 -0.43 0.11 -1.14 0.00 0.00 176.83 176.27 1xcx h LYS 178 N 0.53 0.47 -0.24 3.45 1.79 -0.68 0.74 116.57 122.63 1xcx h LYS 178 Ca 0.04 -0.25 -0.13 0.00 -2.18 0.00 0.00 60.65 58.13 1xcx h LYS 178 Cb 0.97 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.62 1xcx h LYS 178 CO 0.09 0.82 -0.37 0.82 -1.08 0.00 0.00 179.45 179.73 1xcx h ILE 179 N 0.38 1.31 -0.48 1.86 2.04 -1.30 -2.46 117.51 118.86 1xcx h ILE 179 Ca 0.03 -1.57 -0.08 0.00 1.00 0.00 0.00 64.86 64.24 1xcx h ILE 179 Cb 0.92 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 38.73 1xcx h ILE 179 CO 0.08 0.49 -0.04 0.00 0.00 0.00 0.00 178.15 178.69 1xcx h ALA 180 N 0.64 1.03 -0.89 1.87 0.00 -1.09 -0.64 119.26 120.18 1xcx h ALA 180 Ca 0.02 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.68 1xcx h ALA 180 Cb 0.96 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 1xcx h ALA 180 CO 0.08 0.60 0.57 1.49 0.00 0.00 0.00 179.25 181.99 1xcx h GLU 181 N 0.76 1.07 -0.08 0.00 4.81 -0.76 0.29 114.58 120.67 1xcx h GLU 181 Ca 0.14 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1xcx h GLU 181 Cb 0.51 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1xcx h GLU 181 CO 0.03 0.70 -0.00 -0.92 -0.73 0.00 0.00 179.01 178.09 1xcx h TYR 182 N 1.10 0.17 -0.32 0.92 3.20 -0.91 -2.35 116.97 118.78 1xcx h TYR 182 Ca 0.36 -0.03 -0.11 0.00 3.14 0.00 0.00 58.73 62.09 1xcx h TYR 182 Cb 0.03 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1xcx h TYR 182 CO -0.02 0.43 -0.25 0.52 -1.64 0.00 0.00 178.16 177.20 1xcx h MET 183 N -0.14 0.63 -0.02 1.82 2.86 -0.75 -2.81 114.93 116.52 1xcx h MET 183 Ca 0.02 -0.25 -0.10 0.00 -2.06 0.00 0.00 59.70 57.31 1xcx h MET 183 Cb 0.37 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1xcx h MET 183 CO 0.01 0.83 -0.47 -0.91 1.06 0.00 0.00 176.91 177.42 1xcx h ASN 184 N 0.55 0.05 -0.74 1.22 2.35 -0.43 -0.15 115.58 118.42 1xcx h ASN 184 Ca 0.08 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1xcx h ASN 184 Cb 0.73 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 39.05 1xcx h ASN 184 CO 0.06 0.51 0.37 -0.74 -1.65 0.00 0.00 177.43 175.97 1xcx h HIS 185 N 0.04 1.05 -0.23 1.19 2.76 -1.18 -0.34 115.15 118.44 1xcx h HIS 185 Ca -0.00 -0.04 -0.14 0.00 -2.20 0.00 0.00 60.37 57.99 1xcx h HIS 185 Cb 0.84 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 29.47 1xcx h HIS 185 CO 0.00 0.77 -0.39 -0.07 -1.30 0.00 0.00 177.93 176.94 1xcx h LEU 186 N 1.03 0.75 -0.48 0.26 3.38 -1.22 -2.45 115.31 116.59 1xcx h LEU 186 Ca 0.26 -0.53 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 1xcx h LEU 186 Cb 0.10 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1xcx h LEU 186 CO -0.03 1.13 0.29 0.40 0.09 0.00 0.00 178.44 180.32 1xcx h ILE 187 N 0.39 1.15 0.00 1.22 2.04 -0.82 -1.47 117.51 120.01 1xcx h ILE 187 Ca 0.02 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 1xcx h ILE 187 Cb 0.99 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1xcx h ILE 187 CO 0.09 0.15 -0.11 0.44 0.00 0.00 0.00 178.15 178.72 1xcx h ASP 188 N 0.64 0.00 0.44 1.72 3.32 -1.05 -0.82 116.42 120.67 1xcx h ASP 188 Ca 0.17 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.05 1xcx h ASP 188 Cb -0.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1xcx h ASP 188 CO -0.03 0.11 -0.75 0.40 -1.72 0.00 0.00 179.24 177.25 1xcx h ILE 189 N 0.00 1.43 0.00 0.35 2.04 -0.83 -3.47 117.51 117.03 1xcx h ILE 189 Ca -0.00 -2.29 0.00 0.00 1.00 0.00 0.00 64.86 63.57 1xcx h ILE 189 Cb 0.40 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 1xcx h ILE 189 CO 0.01 0.67 0.00 0.61 0.00 0.00 0.00 178.15 179.45 1xcx n GLY 190 N 0.58 -0.15 3.77 5.37 0.00 -0.31 -4.77 105.19 109.68 1xcx n GLY 190 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1xcx n GLY 190 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xcx s VAL 191 N -0.73 3.00 -1.12 1.61 -7.23 -0.96 -4.78 120.40 110.19 1xcx s VAL 191 Ca 0.00 0.63 0.22 0.00 -1.81 0.00 0.00 61.98 61.01 1xcx s VAL 191 Cb 0.00 -3.25 -0.17 0.00 0.56 0.00 0.00 36.38 33.51 1xcx s VAL 191 CO 0.00 -0.13 0.99 0.00 -0.31 0.00 0.00 175.10 175.64 1xcx n ALA 192 N -1.37 4.48 0.00 1.32 0.00 -0.23 -4.67 120.51 120.04 1xcx n ALA 192 Ca 0.12 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1xcx n ALA 192 Cb 0.50 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.14 1xcx n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcx n GLY 193 N 1.49 -1.48 3.04 0.00 0.00 -1.24 -1.12 105.19 105.88 1xcx n GLY 193 Ca 0.05 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 1xcx n GLY 193 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xcx s PHE 194 N -2.25 0.29 -0.33 1.61 0.40 0.44 -1.64 117.98 116.51 1xcx s PHE 194 Ca 0.00 -0.61 -0.11 0.00 -0.60 0.00 0.00 56.93 55.61 1xcx s PHE 194 Cb 0.00 -0.21 -0.01 0.00 0.51 0.00 0.00 43.02 43.30 1xcx s PHE 194 CO 0.00 -0.27 0.20 0.50 0.70 0.00 0.00 175.22 176.35 1xcx s ARG 195 N -2.19 3.44 -0.58 0.44 3.52 0.26 -1.88 118.95 121.96 1xcx s ARG 195 Ca -0.09 -0.67 -0.24 0.00 -0.13 0.00 0.00 55.73 54.60 1xcx s ARG 195 Cb -0.04 -3.70 0.05 0.00 -1.56 0.00 0.00 34.95 29.69 1xcx s ARG 195 CO -0.03 -0.42 0.96 -0.51 -0.81 0.00 0.00 175.30 174.48 1xcx s LEU 196 N 1.68 4.12 0.35 -0.88 1.43 -0.22 -0.74 118.68 124.42 1xcx s LEU 196 Ca 0.05 -0.50 -0.28 0.00 -1.03 0.00 0.00 54.13 52.37 1xcx s LEU 196 Cb -0.17 -2.73 -0.10 0.00 0.03 0.00 0.00 46.19 43.22 1xcx s LEU 196 CO 0.09 -1.30 1.38 -0.62 0.23 0.00 0.00 176.35 176.12 1xcx s ASP 197 N 3.07 6.59 -1.49 2.29 2.15 -0.63 -1.69 116.67 126.95 1xcx s ASP 197 Ca 0.29 2.83 -0.09 0.00 0.43 0.00 0.00 52.55 56.00 1xcx s ASP 197 Cb -0.13 -2.66 0.06 0.00 -0.30 0.00 0.00 42.92 39.90 1xcx s ASP 197 CO 0.17 -0.68 0.82 0.00 -0.17 0.00 0.00 175.17 175.31 1xcx n ALA 198 N 0.64 -1.55 0.22 3.66 0.00 -1.26 -4.56 120.51 117.66 1xcx n ALA 198 Ca 0.00 0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.52 1xcx n ALA 198 Cb 0.41 -3.37 0.51 0.00 0.00 0.00 0.00 19.45 16.99 1xcx n ALA 198 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1xcx h SER 199 N -1.93 0.01 -0.13 0.00 0.02 -1.38 -1.91 113.55 108.23 1xcx h SER 199 Ca -0.60 -0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.39 1xcx h SER 199 Cb 1.37 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.90 1xcx h SER 199 CO 0.65 0.18 0.11 0.50 -1.14 0.00 0.00 176.83 177.13 1xcx h LYS 200 N 0.01 0.00 -0.32 3.45 3.64 -1.89 -1.38 116.57 120.08 1xcx h LYS 200 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xcx h LYS 200 Cb 0.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1xcx h LYS 200 CO 0.02 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.92 1xcx n HIS 201 N -4.20 0.42 -4.51 1.91 8.25 -0.72 -4.66 115.22 111.72 1xcx n HIS 201 Ca 0.00 -0.21 -0.23 0.00 -0.26 0.00 0.00 57.72 57.03 1xcx n HIS 201 Cb 0.22 -0.01 -0.14 0.00 1.12 0.00 0.00 29.99 31.19 1xcx n HIS 201 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1xcx s MET 202 N -1.60 1.16 0.24 -0.41 -1.94 -0.52 -4.39 119.30 111.84 1xcx s MET 202 Ca 0.20 -0.82 -0.30 0.00 -1.71 0.00 0.00 55.69 53.07 1xcx s MET 202 Cb 0.11 -1.21 -0.09 0.00 2.01 0.00 0.00 34.83 35.65 1xcx s MET 202 CO 0.14 0.31 1.27 -1.58 -0.01 0.00 0.00 175.02 175.14 1xcx s TRP 203 N -0.78 3.27 0.36 -0.03 0.52 -1.26 -4.90 118.94 116.12 1xcx s TRP 203 Ca 0.05 1.35 0.12 0.00 0.02 0.00 0.00 56.10 57.63 1xcx s TRP 203 Cb -0.08 -3.56 0.91 0.00 -1.15 0.00 0.00 33.47 29.59 1xcx s TRP 203 CO 0.01 -1.63 1.82 -1.35 0.02 0.00 0.00 176.95 175.82 1xcx h PRO 204 N 4.74 0.58 -0.16 4.98 0.11 -1.89 -0.90 132.00 139.46 1xcx h PRO 204 Ca -0.46 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 1xcx h PRO 204 Cb 1.22 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1xcx h PRO 204 CO 0.73 0.38 -0.32 0.78 -0.21 0.00 0.00 178.00 179.36 1xcx h GLY 205 N 0.59 0.34 1.15 -0.55 0.00 -1.93 -1.95 103.07 100.71 1xcx h GLY 205 Ca 0.53 -0.29 -0.18 0.00 0.00 0.00 0.00 47.33 47.39 1xcx h GLY 205 CO -0.28 0.26 -0.51 -0.55 0.00 0.00 0.00 176.54 175.46 1xcx h ASP 206 N 0.27 0.99 -0.23 0.19 3.32 -1.51 -2.31 116.42 117.14 1xcx h ASP 206 Ca 0.04 -0.52 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1xcx h ASP 206 Cb 0.71 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1xcx h ASP 206 CO 0.05 1.32 0.15 0.40 -1.72 0.00 0.00 179.24 179.45 1xcx h ILE 207 N 0.70 1.07 -0.66 0.35 2.04 -1.26 -2.41 117.51 117.33 1xcx h ILE 207 Ca 0.03 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.80 1xcx h ILE 207 Cb 1.12 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 37.89 1xcx h ILE 207 CO 0.12 0.06 0.40 0.50 0.00 0.00 0.00 178.15 179.23 1xcx h LYS 208 N 0.31 0.74 -0.78 2.37 1.63 -1.31 -0.34 116.57 119.19 1xcx h LYS 208 Ca 0.09 -0.04 0.05 0.00 -0.85 0.00 0.00 60.65 59.89 1xcx h LYS 208 Cb -0.03 -0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 31.39 1xcx h LYS 208 CO -0.02 0.49 0.51 0.00 -3.45 0.00 0.00 179.45 176.98 1xcx h ALA 209 N 1.31 1.58 -0.13 5.00 0.00 -1.10 -0.31 119.26 125.60 1xcx h ALA 209 Ca 0.28 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1xcx h ALA 209 Cb 0.09 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1xcx h ALA 209 CO -0.14 0.32 -0.20 0.82 0.00 0.00 0.00 179.25 180.06 1xcx h ILE 210 N 0.91 1.36 -0.35 0.00 2.04 -0.87 -3.16 117.51 117.45 1xcx h ILE 210 Ca 0.32 -1.42 0.01 0.00 1.00 0.00 0.00 64.86 64.77 1xcx h ILE 210 Cb 0.13 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 1xcx h ILE 210 CO -0.10 0.42 0.23 -0.07 0.00 0.00 0.00 178.15 178.62 1xcx h LEU 211 N -0.02 0.37 -0.78 1.44 3.38 -0.37 -0.68 115.31 118.65 1xcx h LEU 211 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1xcx h LEU 211 Cb 0.76 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1xcx h LEU 211 CO 0.05 0.27 0.00 0.47 0.09 0.00 0.00 178.44 179.31 1xcx n ASP 212 N -4.49 0.57 -0.53 -0.43 8.00 -0.19 -1.84 116.55 117.65 1xcx n ASP 212 Ca 0.02 0.67 0.13 0.00 0.71 0.00 0.00 54.79 56.32 1xcx n ASP 212 Cb 0.09 -0.78 0.30 0.00 -0.02 0.00 0.00 41.12 40.71 1xcx n ASP 212 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1xcx n LYS 213 N -2.16 1.52 -2.93 -1.24 5.02 -0.26 -4.97 118.16 113.13 1xcx n LYS 213 Ca 0.01 -1.06 -0.36 0.00 -2.02 0.00 0.00 58.31 54.88 1xcx n LYS 213 Cb 0.18 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.65 1xcx n LYS 213 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1xcx s LEU 214 N -2.21 4.33 0.85 -0.35 1.02 -0.77 -4.98 118.68 116.58 1xcx s LEU 214 Ca 0.29 1.64 -0.12 0.00 0.02 0.00 0.00 54.13 55.95 1xcx s LEU 214 Cb 0.20 -3.82 0.10 0.00 0.02 0.00 0.00 46.19 42.69 1xcx s LEU 214 CO 0.42 -0.03 1.13 -1.00 0.02 0.00 0.00 176.35 176.90 1xcx s HIS 215 N -1.58 2.73 0.62 0.29 3.76 -1.26 -5.06 115.29 114.78 1xcx s HIS 215 Ca 0.47 0.91 -0.09 0.00 -0.15 0.00 0.00 55.06 56.20 1xcx s HIS 215 Cb -0.17 -3.33 -0.01 0.00 1.11 0.00 0.00 32.58 30.18 1xcx s HIS 215 CO 0.22 -2.04 0.98 -0.80 -0.85 0.00 0.00 174.74 172.25 1xcx s ASN 216 N -4.14 5.77 0.75 1.40 0.02 -1.26 -4.61 114.94 112.87 1xcx s ASN 216 Ca 0.62 1.04 -0.15 0.00 -1.02 0.00 0.00 52.86 53.35 1xcx s ASN 216 Cb -0.14 -2.02 0.05 0.00 0.02 0.00 0.00 41.25 39.16 1xcx s ASN 216 CO 0.53 -1.05 1.24 -0.76 0.02 0.00 0.00 177.10 177.07 1xcx s LEU 217 N -5.13 3.29 -0.23 0.60 1.43 0.09 -4.83 118.68 113.91 1xcx s LEU 217 Ca 0.55 2.45 -0.36 0.00 -1.03 0.00 0.00 54.13 55.74 1xcx s LEU 217 Cb -0.11 -4.60 -0.12 0.00 0.03 0.00 0.00 46.19 41.39 1xcx s LEU 217 CO 0.49 -2.44 1.96 -3.20 0.23 0.00 0.00 176.35 173.39 1xcx n ASN 218 N -2.82 2.77 0.00 2.29 5.15 -1.26 -4.80 115.26 116.60 1xcx n ASN 218 Ca 0.14 0.79 0.03 0.00 -0.60 0.00 0.00 54.58 54.95 1xcx n ASN 218 Cb 0.50 -1.29 0.18 0.00 -0.53 0.00 0.00 39.78 38.64 1xcx n ASN 218 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1xcx n SER 219 N 7.53 0.00 0.19 1.20 3.41 -1.26 -1.23 113.62 123.46 1xcx n SER 219 Ca 0.30 0.15 0.08 0.00 -0.26 0.00 0.00 58.87 59.14 1xcx n SER 219 Cb 0.24 -0.26 0.11 0.00 -0.26 0.00 0.00 64.21 64.04 1xcx n SER 219 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1xcx h ASN 220 N 0.00 0.00 0.00 4.04 2.35 -2.00 -3.37 115.58 116.60 1xcx h ASN 220 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1xcx h ASN 220 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1xcx h ASN 220 CO 0.00 0.20 -0.84 0.79 -1.65 0.00 0.00 177.43 175.93 1xcx n TRP 221 N -3.14 0.00 -4.46 1.19 8.01 -0.79 -5.08 117.44 113.17 1xcx n TRP 221 Ca 0.03 0.00 -0.29 0.00 -1.31 0.00 0.00 57.50 55.93 1xcx n TRP 221 Cb 0.61 0.00 -0.13 0.00 -2.01 0.00 0.00 31.31 29.78 1xcx n TRP 221 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.69 176.62 1xcx s PHE 222 N -1.73 2.36 0.56 -5.99 0.40 -0.36 -5.08 117.98 108.14 1xcx s PHE 222 Ca 0.00 -0.36 -0.21 0.00 -0.60 0.00 0.00 56.93 55.77 1xcx s PHE 222 Cb 0.00 -1.30 -0.04 0.00 0.51 0.00 0.00 43.02 42.19 1xcx s PHE 222 CO 0.00 0.31 1.29 -1.25 0.70 0.00 0.00 175.22 176.27 1xcx s PRO 223 N -1.93 3.07 0.37 0.24 0.04 -1.26 -4.28 135.00 131.25 1xcx s PRO 223 Ca 0.14 2.06 -0.26 0.00 0.04 0.00 0.00 61.00 62.98 1xcx s PRO 223 Cb -0.10 -2.13 -0.12 0.00 0.04 0.00 0.00 34.50 32.19 1xcx s PRO 223 CO 0.06 -1.19 1.06 0.00 0.04 0.00 0.00 177.00 176.97 1xcx n ALA 224 N -1.24 0.27 -0.79 8.56 0.00 -1.26 -2.35 120.51 123.70 1xcx n ALA 224 Ca 0.12 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1xcx n ALA 224 Cb 0.47 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1xcx n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcx n GLY 225 N 1.12 0.75 3.72 0.00 0.00 -1.26 -5.02 105.19 104.49 1xcx n GLY 225 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1xcx n GLY 225 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xcx s SER 226 N -2.49 7.04 -0.02 1.61 0.01 -0.99 -4.96 113.70 113.90 1xcx s SER 226 Ca 0.00 2.17 0.00 0.00 1.31 0.00 0.00 55.95 59.43 1xcx s SER 226 Cb 0.00 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 1xcx s SER 226 CO 0.00 -0.46 0.02 -0.54 0.41 0.00 0.00 173.24 172.67 1xcx s LYS 227 N 0.48 2.88 0.37 12.44 1.02 -1.26 -0.73 119.74 134.94 1xcx s LYS 227 Ca 0.57 -0.54 -0.28 0.00 0.02 0.00 0.00 55.97 55.74 1xcx s LYS 227 Cb -0.32 -2.73 -0.11 0.00 -0.52 0.00 0.00 37.83 34.14 1xcx s LYS 227 CO 0.33 0.65 1.43 -0.35 -0.92 0.00 0.00 175.35 176.49 1xcx n PRO 228 N 1.53 2.51 -2.29 -1.68 -0.04 -1.26 -4.88 135.00 128.89 1xcx n PRO 228 Ca -0.15 0.88 -0.42 0.00 -0.04 0.00 0.00 63.50 63.77 1xcx n PRO 228 Cb 0.53 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.38 1xcx n PRO 228 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1xcx s PHE 229 N -1.12 3.25 -0.16 0.54 5.36 -0.27 -4.74 117.98 120.83 1xcx s PHE 229 Ca 0.54 1.07 0.01 0.00 -0.96 0.00 0.00 56.93 57.59 1xcx s PHE 229 Cb -0.50 -3.57 0.02 0.00 -0.34 0.00 0.00 43.02 38.63 1xcx s PHE 229 CO 0.63 -1.94 -0.18 0.42 -1.46 0.00 0.00 175.22 172.70 1xcx s ILE 230 N 1.36 1.85 -0.10 3.12 -1.09 -1.26 -0.42 121.20 124.66 1xcx s ILE 230 Ca 0.62 -0.82 0.01 0.00 -2.23 0.00 0.00 60.65 58.24 1xcx s ILE 230 Cb -0.33 -1.69 0.02 0.00 -1.58 0.00 0.00 42.46 38.89 1xcx s ILE 230 CO 0.29 0.51 -0.13 -0.72 -1.23 0.00 0.00 174.94 173.66 1xcx s TYR 231 N 1.29 1.77 -0.17 3.97 1.13 -0.78 -0.77 117.35 123.79 1xcx s TYR 231 Ca 0.03 -0.83 -0.12 0.00 -1.41 0.00 0.00 57.07 54.74 1xcx s TYR 231 Cb -0.13 -1.32 -0.05 0.00 -1.10 0.00 0.00 41.96 39.36 1xcx s TYR 231 CO -0.10 -0.46 0.23 -0.65 -2.51 0.00 0.00 175.55 172.06 1xcx s GLN 232 N 1.13 4.20 -0.56 -3.49 -0.21 0.04 -1.05 119.66 119.71 1xcx s GLN 232 Ca -0.05 -0.02 -0.28 0.00 0.02 0.00 0.00 55.36 55.04 1xcx s GLN 232 Cb -0.14 -3.41 0.03 0.00 1.00 0.00 0.00 33.01 30.49 1xcx s GLN 232 CO -0.03 0.29 1.14 -2.00 -2.12 0.00 0.00 175.29 172.57 1xcx s GLU 233 N 0.35 3.50 -0.14 2.91 2.12 -0.68 -1.64 118.70 125.12 1xcx s GLU 233 Ca 0.13 0.19 -0.01 0.00 0.36 0.00 0.00 54.97 55.64 1xcx s GLU 233 Cb -0.12 -4.01 0.04 0.00 0.26 0.00 0.00 34.13 30.30 1xcx s GLU 233 CO 0.02 -1.61 -0.01 0.08 -0.54 0.00 0.00 175.26 173.20 1xcx s VAL 234 N 4.71 0.70 -0.46 3.70 1.01 -1.26 -1.78 120.40 127.02 1xcx s VAL 234 Ca 0.41 -0.32 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 1xcx s VAL 234 Cb -0.08 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.38 1xcx s VAL 234 CO 0.25 0.11 0.83 -0.63 0.00 0.00 0.00 175.10 175.66 1xcx s ILE 235 N 1.81 4.59 -0.36 2.22 1.01 -1.26 -4.58 121.20 124.63 1xcx s ILE 235 Ca 0.02 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.20 1xcx s ILE 235 Cb -0.14 -4.36 0.12 0.00 0.01 0.00 0.00 42.46 38.08 1xcx s ILE 235 CO -0.07 -0.76 0.16 -0.62 0.00 0.00 0.00 174.94 173.64 1xcx s ASP 236 N 2.19 3.77 -0.09 3.58 2.15 -1.26 -4.93 116.67 122.09 1xcx s ASP 236 Ca 0.32 -2.04 0.17 0.00 0.43 0.00 0.00 52.55 51.44 1xcx s ASP 236 Cb -0.11 -0.86 0.62 0.00 -0.30 0.00 0.00 42.92 42.26 1xcx s ASP 236 CO 0.24 -0.35 1.53 0.18 -0.17 0.00 0.00 175.17 176.60 1xcx n LEU 237 N 4.31 4.26 0.00 -1.34 4.77 -1.26 -4.59 117.00 123.16 1xcx n LEU 237 Ca 0.03 -2.40 0.00 0.00 -0.03 0.00 0.00 56.01 53.61 1xcx n LEU 237 Cb 0.39 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1xcx n LEU 237 CO 0.16 0.80 0.00 0.61 -1.33 0.00 0.00 177.39 177.63 1xcx n GLY 238 N 0.85 -0.92 2.61 -0.72 0.00 -1.26 -4.96 105.19 100.79 1xcx n GLY 238 Ca 0.23 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1xcx n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xcx n GLY 239 N -1.02 2.22 3.53 -0.02 0.00 -1.26 -5.02 105.19 103.62 1xcx n GLY 239 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1xcx n GLY 239 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xcx s GLU 240 N -0.13 1.92 0.55 1.61 2.02 -1.26 -5.02 118.70 118.39 1xcx s GLU 240 Ca 0.00 -1.24 0.31 0.00 0.02 0.00 0.00 54.97 54.06 1xcx s GLU 240 Cb 0.00 -2.13 1.60 0.00 0.10 0.00 0.00 34.13 33.71 1xcx s GLU 240 CO 0.00 0.45 2.11 -1.00 0.02 0.00 0.00 175.26 176.85 1xcx h PRO 241 N 3.29 0.00 -5.83 0.39 0.13 -1.87 -3.42 132.00 124.70 1xcx h PRO 241 Ca -0.48 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.08 1xcx h PRO 241 Cb 1.19 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 1xcx h PRO 241 CO 0.51 0.08 -0.07 0.42 -0.23 0.00 0.00 178.00 178.71 1xcx s ILE 242 N -4.11 5.15 0.04 -3.56 1.01 -1.26 -5.03 121.20 113.43 1xcx s ILE 242 Ca -0.03 1.11 0.07 0.00 0.00 0.00 0.00 60.65 61.80 1xcx s ILE 242 Cb 0.12 -3.89 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 1xcx s ILE 242 CO 0.55 0.30 -0.19 -0.54 0.00 0.00 0.00 174.94 175.06 1xcx s LYS 243 N 0.68 2.05 0.56 2.79 1.02 -1.26 -4.94 119.74 120.64 1xcx s LYS 243 Ca 0.30 -0.99 0.34 0.00 0.02 0.00 0.00 55.97 55.64 1xcx s LYS 243 Cb -0.16 -2.17 1.64 0.00 -0.52 0.00 0.00 37.83 36.63 1xcx s LYS 243 CO 0.13 0.54 2.11 0.66 -0.92 0.00 0.00 175.35 177.86 1xcx h SER 244 N 4.60 0.00 0.38 2.83 4.64 -1.93 -2.12 113.55 121.94 1xcx h SER 244 Ca -0.47 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.84 1xcx h SER 244 Cb 1.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1xcx h SER 244 CO 0.47 0.06 -0.05 0.77 -0.87 0.00 0.00 176.83 177.21 1xcx h SER 245 N 0.00 0.00 0.53 4.97 4.64 -2.01 -1.66 113.55 120.02 1xcx h SER 245 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xcx h SER 245 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1xcx h SER 245 CO 0.01 0.05 0.00 0.44 -0.87 0.00 0.00 176.83 176.45 1xcx h ASP 246 N 0.00 0.00 -0.40 4.97 5.19 -1.81 -2.78 116.42 121.59 1xcx h ASP 246 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1xcx h ASP 246 Cb 0.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.76 1xcx h ASP 246 CO 0.01 0.00 0.00 -1.22 -3.12 0.00 0.00 179.24 174.91 1xcx n TYR 247 N -2.64 0.52 0.27 4.55 4.02 -0.62 -4.58 117.16 118.68 1xcx n TYR 247 Ca 0.00 -0.34 0.11 0.00 -0.01 0.00 0.00 57.90 57.66 1xcx n TYR 247 Cb 0.18 -0.01 0.74 0.00 -0.02 0.00 0.00 39.34 40.23 1xcx n TYR 247 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 1xcx h PHE 248 N 3.40 0.00 0.00 -0.72 0.04 -1.59 -2.30 116.94 115.77 1xcx h PHE 248 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1xcx h PHE 248 Cb 0.84 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.99 1xcx h PHE 248 CO 0.26 0.07 0.00 0.41 -0.60 0.00 0.00 178.31 178.45 1xcx n GLY 249 N -1.14 -1.18 0.04 -1.45 0.00 -1.26 -3.29 105.19 96.90 1xcx n GLY 249 Ca -0.03 -0.03 0.03 0.00 0.00 0.00 0.00 46.02 45.99 1xcx n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xcx n ASN 250 N -1.67 0.66 0.00 1.61 3.02 -0.87 -5.06 115.26 112.95 1xcx n ASN 250 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 1xcx n ASN 250 Cb 0.23 1.55 0.00 0.00 -0.61 0.00 0.00 39.78 40.94 1xcx n ASN 250 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xcx n GLY 251 N 1.59 -0.12 3.79 7.41 0.00 -1.21 -4.82 105.19 111.85 1xcx n GLY 251 Ca -0.12 -1.33 -0.29 0.00 0.00 0.00 0.00 46.02 44.28 1xcx n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xcx s ARG 252 N -2.00 1.30 0.06 1.61 0.52 0.05 -4.40 118.95 116.10 1xcx s ARG 252 Ca 0.00 0.33 0.03 0.00 -0.52 0.00 0.00 55.73 55.57 1xcx s ARG 252 Cb 0.00 -1.85 -0.03 0.00 0.52 0.00 0.00 34.95 33.59 1xcx s ARG 252 CO 0.00 -2.09 -0.09 0.14 0.02 0.00 0.00 175.30 173.28 1xcx s VAL 253 N -3.28 0.71 0.06 3.52 -7.23 0.78 -0.78 120.40 114.17 1xcx s VAL 253 Ca 0.63 -1.26 -0.31 0.00 -1.81 0.00 0.00 61.98 59.24 1xcx s VAL 253 Cb -0.15 -0.87 -0.06 0.00 0.56 0.00 0.00 36.38 35.86 1xcx s VAL 253 CO 0.53 -0.41 1.25 0.42 -0.31 0.00 0.00 175.10 176.58 1xcx s THR 254 N -1.67 3.90 -0.75 5.32 -4.23 -0.65 -1.57 115.64 115.98 1xcx s THR 254 Ca -0.05 1.35 -0.14 0.00 -1.18 0.00 0.00 61.69 61.67 1xcx s THR 254 Cb -0.08 -3.86 0.20 0.00 1.34 0.00 0.00 72.50 70.09 1xcx s THR 254 CO 0.00 0.09 0.69 -0.70 -0.54 0.00 0.00 174.62 174.16 1xcx s GLU 255 N 1.25 3.40 0.39 3.99 2.56 -0.79 -4.55 118.70 124.95 1xcx s GLU 255 Ca 0.60 -2.29 0.28 0.00 0.00 0.00 0.00 54.97 53.55 1xcx s GLU 255 Cb -0.31 -4.36 1.00 0.00 2.00 0.00 0.00 34.13 32.47 1xcx s GLU 255 CO 0.29 -1.29 1.81 0.74 -0.56 0.00 0.00 175.26 176.24 1xcx h PHE 256 N 7.99 0.00 0.00 5.30 -1.00 -1.86 -2.81 116.94 124.57 1xcx h PHE 256 Ca 0.01 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.74 1xcx h PHE 256 Cb 1.05 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.60 1xcx h PHE 256 CO 0.95 0.00 -0.25 0.87 -1.61 0.00 0.00 178.31 178.26 1xcx h LYS 257 N 0.00 0.00 0.65 1.51 1.57 -1.90 -3.09 116.57 115.31 1xcx h LYS 257 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1xcx h LYS 257 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 1xcx h LYS 257 CO 0.00 0.25 -0.47 -0.92 -0.57 0.00 0.00 179.45 177.74 1xcx h TYR 258 N 0.00 -1.28 -0.42 -1.35 5.03 -1.84 -1.48 116.97 115.63 1xcx h TYR 258 Ca -0.00 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.22 1xcx h TYR 258 Cb 0.63 0.47 -0.02 0.00 1.55 0.00 0.00 36.73 39.37 1xcx h TYR 258 CO 0.00 -0.67 -0.07 0.78 -1.32 0.00 0.00 178.16 176.88 1xcx h GLY 259 N -1.07 0.78 0.96 1.82 0.00 -1.60 -1.75 103.07 102.20 1xcx h GLY 259 Ca -0.09 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.70 1xcx h GLY 259 CO 0.04 0.51 0.02 0.00 0.00 0.00 0.00 176.54 177.11 1xcx h ALA 260 N 1.26 0.05 -0.18 3.60 0.00 -1.47 -1.16 119.26 121.36 1xcx h ALA 260 Ca 0.12 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 1xcx h ALA 260 Cb 0.52 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1xcx h ALA 260 CO 0.03 -0.43 -0.65 0.87 0.00 0.00 0.00 179.25 179.07 1xcx h LYS 261 N 0.01 0.68 -0.50 0.00 1.79 -1.23 -2.64 116.57 114.68 1xcx h LYS 261 Ca 0.01 -0.49 -0.04 0.00 -2.18 0.00 0.00 60.65 57.96 1xcx h LYS 261 Cb 0.04 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 1xcx h LYS 261 CO -0.00 1.11 0.15 1.25 -1.08 0.00 0.00 179.45 180.88 1xcx h LEU 262 N 0.50 0.68 -0.27 2.94 5.85 -1.28 -1.03 115.31 122.70 1xcx h LEU 262 Ca -0.02 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 1xcx h LEU 262 Cb 1.24 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1xcx h LEU 262 CO 0.13 0.65 0.06 1.23 -0.34 0.00 0.00 178.44 180.17 1xcx h GLY 263 N 0.90 0.47 1.48 3.75 0.00 -1.09 -1.27 103.07 107.32 1xcx h GLY 263 Ca 0.17 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 47.08 1xcx h GLY 263 CO -0.01 0.28 -0.29 -0.91 0.00 0.00 0.00 176.54 175.61 1xcx h THR 264 N 0.27 1.28 -0.05 4.70 1.35 -1.14 -1.48 112.91 117.83 1xcx h THR 264 Ca 0.08 -1.39 -0.01 0.00 -0.55 0.00 0.00 66.41 64.55 1xcx h THR 264 Cb 0.30 1.37 -0.00 0.00 -1.73 0.00 0.00 68.15 68.10 1xcx h THR 264 CO 0.00 0.45 -0.00 0.58 -0.25 0.00 0.00 175.52 176.30 1xcx h VAL 265 N 0.51 1.25 -0.01 6.82 2.07 -1.10 0.74 116.25 126.53 1xcx h VAL 265 Ca 0.06 -0.76 -0.09 0.00 0.82 0.00 0.00 66.70 66.73 1xcx h VAL 265 Cb 0.76 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1xcx h VAL 265 CO 0.06 0.21 -0.40 0.40 0.02 0.00 0.00 177.57 177.86 1xcx h ILE 266 N -0.21 1.29 -0.00 4.57 2.04 -1.20 -1.07 117.51 122.93 1xcx h ILE 266 Ca 0.01 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.48 1xcx h ILE 266 Cb 0.33 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.15 1xcx h ILE 266 CO 0.00 0.40 -0.07 0.54 0.00 0.00 0.00 178.15 179.03 1xcx n ARG 267 N -4.06 0.03 -3.38 2.37 1.74 -0.56 -4.92 116.66 107.88 1xcx n ARG 267 Ca -0.02 -0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.85 1xcx n ARG 267 Cb 0.44 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.44 1xcx n ARG 267 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1xcx n LYS 268 N -1.48 -6.64 -2.67 5.56 5.02 -0.40 -4.96 118.16 112.58 1xcx n LYS 268 Ca 0.07 0.75 -0.41 0.00 -2.02 0.00 0.00 58.31 56.71 1xcx n LYS 268 Cb 0.33 -5.50 -0.05 0.00 -0.02 0.00 0.00 35.03 29.79 1xcx n LYS 268 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1xcx s TRP 269 N -3.25 3.80 -1.14 2.13 0.52 0.12 -4.31 118.94 116.81 1xcx s TRP 269 Ca 0.48 1.78 -0.28 0.00 0.02 0.00 0.00 56.10 58.11 1xcx s TRP 269 Cb -0.21 -3.10 0.03 0.00 -1.15 0.00 0.00 33.47 29.04 1xcx s TRP 269 CO 0.59 0.05 0.68 0.27 0.02 0.00 0.00 176.95 178.57 1xcx n ASN 270 N 2.21 -4.44 0.00 2.95 0.23 -1.26 -2.18 115.26 112.78 1xcx n ASN 270 Ca 0.01 -1.21 0.00 0.00 -0.53 0.00 0.00 54.58 52.85 1xcx n ASN 270 Cb 0.48 -1.89 0.00 0.00 -2.08 0.00 0.00 39.78 36.28 1xcx n ASN 270 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xcx n GLY 271 N -1.98 2.81 3.76 4.83 0.00 -1.26 -5.00 105.19 108.34 1xcx n GLY 271 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 1xcx n GLY 271 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xcx s GLU 272 N 0.00 3.39 0.01 1.61 0.41 -0.92 -5.04 118.70 118.15 1xcx s GLU 272 Ca 0.00 2.10 -0.16 0.00 -0.41 0.00 0.00 54.97 56.51 1xcx s GLU 272 Cb 0.00 -2.34 0.03 0.00 -1.78 0.00 0.00 34.13 30.03 1xcx s GLU 272 CO 0.00 -0.95 0.33 -1.59 -0.49 0.00 0.00 175.26 172.56 1xcx s LYS 273 N -2.79 0.75 0.59 1.61 -2.85 -1.26 -4.51 119.74 111.27 1xcx s LYS 273 Ca 0.68 -0.28 0.28 0.00 -1.00 0.00 0.00 55.97 55.65 1xcx s LYS 273 Cb -0.37 0.33 1.67 0.00 -2.06 0.00 0.00 37.83 37.40 1xcx s LYS 273 CO 0.44 -0.23 2.12 0.52 0.10 0.00 0.00 175.35 178.31 1xcx h MET 274 N 3.55 0.00 0.00 1.78 2.86 -1.78 -1.32 114.93 120.01 1xcx h MET 274 Ca -0.30 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.33 1xcx h MET 274 Cb 1.18 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.84 1xcx h MET 274 CO 0.42 0.00 -0.05 0.66 1.06 0.00 0.00 176.91 179.00 1xcx h SER 275 N 0.00 0.00 0.89 1.22 4.64 -1.78 -1.14 113.55 117.38 1xcx h SER 275 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1xcx h SER 275 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1xcx h SER 275 CO -0.00 0.05 0.00 -1.22 -0.87 0.00 0.00 176.83 174.79 1xcx n TYR 276 N -3.48 0.71 1.56 4.77 4.01 -0.50 -3.11 117.16 121.13 1xcx n TYR 276 Ca -0.02 0.26 0.07 0.00 -0.16 0.00 0.00 57.90 58.05 1xcx n TYR 276 Cb 0.17 -0.92 0.43 0.00 -0.31 0.00 0.00 39.34 38.71 1xcx n TYR 276 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1xcx n LEU 277 N -2.13 0.00 -0.25 7.72 4.77 -0.43 -3.89 117.00 122.78 1xcx n LEU 277 Ca 0.03 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.06 1xcx n LEU 277 Cb 0.27 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.54 1xcx n LEU 277 CO 0.22 0.00 1.02 0.50 -1.33 0.00 0.00 177.39 177.80 1xcx h LYS 278 N 0.00 0.44 -0.73 3.23 3.64 -1.75 -1.65 116.57 119.76 1xcx h LYS 278 Ca 0.00 -0.03 -0.45 0.00 -1.27 0.00 0.00 60.65 58.91 1xcx h LYS 278 Cb 0.00 -0.10 -0.25 0.00 -0.41 0.00 0.00 32.23 31.47 1xcx h LYS 278 CO 0.00 0.29 0.22 0.27 -2.27 0.00 0.00 179.45 177.96 1xcx n ASN 279 N -4.99 4.46 -4.70 4.20 6.94 -1.25 -5.03 115.26 114.89 1xcx n ASN 279 Ca 0.14 -3.75 -0.44 0.00 -0.02 0.00 0.00 54.58 50.52 1xcx n ASN 279 Cb 0.40 -0.73 -0.02 0.00 -2.36 0.00 0.00 39.78 37.07 1xcx n ASN 279 CO 0.00 0.00 0.00 1.87 -1.03 0.00 0.00 177.26 178.10 1xcx n TRP 280 N -1.02 2.38 0.00 -2.53 -0.00 -0.62 -3.81 117.44 111.85 1xcx n TRP 280 Ca 0.49 0.39 0.00 0.00 -0.00 0.00 0.00 57.50 58.38 1xcx n TRP 280 Cb 1.09 -2.50 0.00 0.00 -0.00 0.00 0.00 31.31 29.90 1xcx n TRP 280 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1xcx n GLY 281 N 2.00 0.29 0.33 5.87 0.00 -1.26 -4.70 105.19 107.73 1xcx n GLY 281 Ca 0.10 -1.65 0.17 0.00 0.00 0.00 0.00 46.02 44.63 1xcx n GLY 281 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1xcx h GLU 282 N 0.00 0.00 -0.04 1.61 3.07 -1.82 0.56 114.58 117.96 1xcx h GLU 282 Ca 0.00 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1xcx h GLU 282 Cb 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1xcx h GLU 282 CO 0.00 0.00 0.12 0.78 -1.40 0.00 0.00 179.01 178.51 1xcx h GLY 283 N 0.00 0.00 -2.82 -3.84 0.00 -1.84 0.18 103.07 94.75 1xcx h GLY 283 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1xcx h GLY 283 CO -0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.54 177.33 1xcx n TRP 284 N -3.26 1.20 -0.72 5.60 7.02 0.19 -4.92 117.44 122.55 1xcx n TRP 284 Ca -0.02 -0.53 0.00 0.00 -1.02 0.00 0.00 57.50 55.94 1xcx n TRP 284 Cb 0.20 -0.11 0.00 0.00 -2.42 0.00 0.00 31.31 28.98 1xcx n TRP 284 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1xcx n GLY 285 N 1.40 0.59 3.89 6.99 0.00 0.62 -5.03 105.19 113.65 1xcx n GLY 285 Ca 0.25 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 1xcx n GLY 285 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xcx s PHE 286 N -2.00 3.31 0.90 1.61 0.08 -1.24 -5.03 117.98 115.62 1xcx s PHE 286 Ca 0.00 0.98 -0.11 0.00 0.12 0.00 0.00 56.93 57.92 1xcx s PHE 286 Cb 0.00 -3.02 0.13 0.00 -0.57 0.00 0.00 43.02 39.56 1xcx s PHE 286 CO 0.00 -1.13 1.09 0.14 -0.10 0.00 0.00 175.22 175.22 1xcx s VAL 287 N -3.30 2.64 0.32 -0.44 -7.23 -1.26 -4.51 120.40 106.61 1xcx s VAL 287 Ca 0.57 0.21 -0.28 0.00 -1.81 0.00 0.00 61.98 60.67 1xcx s VAL 287 Cb -0.11 -2.61 -0.13 0.00 0.56 0.00 0.00 36.38 34.10 1xcx s VAL 287 CO 0.51 -0.27 1.29 -2.65 -0.31 0.00 0.00 175.10 173.67 1xcx n PRO 288 N -3.96 2.07 -0.34 4.82 -0.02 -1.26 -4.65 135.00 131.67 1xcx n PRO 288 Ca 0.07 0.73 0.14 0.00 -2.02 0.00 0.00 63.50 62.43 1xcx n PRO 288 Cb 0.54 -2.31 0.36 0.00 -0.02 0.00 0.00 33.50 32.07 1xcx n PRO 288 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1xcx h SER 289 N 2.74 0.72 0.00 2.55 0.87 -1.95 -0.51 113.55 117.97 1xcx h SER 289 Ca -0.45 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1xcx h SER 289 Cb 1.29 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1xcx h SER 289 CO 0.64 0.24 0.00 -0.90 -0.53 0.00 0.00 176.83 176.29 1xcx n ASP 290 N -4.74 0.00 0.00 6.23 5.68 -1.26 -2.25 116.55 120.21 1xcx n ASP 290 Ca 0.23 -1.06 0.00 0.00 -0.50 0.00 0.00 54.79 53.46 1xcx n ASP 290 Cb 0.61 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 1xcx n ASP 290 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1xcx n ARG 291 N -0.75 1.04 -4.06 0.11 5.12 -0.21 -4.89 116.66 113.02 1xcx n ARG 291 Ca 0.09 -0.87 -0.36 0.00 -1.93 0.00 0.00 57.85 54.77 1xcx n ARG 291 Cb 0.04 -0.85 -0.08 0.00 -1.16 0.00 0.00 32.46 30.42 1xcx n ARG 291 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1xcx s ALA 292 N -0.43 3.60 -0.25 7.54 0.00 -0.95 -0.16 121.76 131.10 1xcx s ALA 292 Ca 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1xcx s ALA 292 Cb 0.00 -1.80 0.04 0.00 0.00 0.00 0.00 23.12 21.36 1xcx s ALA 292 CO 0.00 0.52 -0.09 -1.17 0.00 0.00 0.00 175.76 175.03 1xcx s LEU 293 N -0.71 3.30 0.27 0.00 1.98 -0.61 -1.79 118.68 121.11 1xcx s LEU 293 Ca 0.12 -1.13 0.08 0.00 -2.89 0.00 0.00 54.13 50.31 1xcx s LEU 293 Cb -0.12 -1.60 -0.04 0.00 0.66 0.00 0.00 46.19 45.09 1xcx s LEU 293 CO 0.03 -0.16 0.12 0.68 -1.89 0.00 0.00 176.35 175.13 1xcx s VAL 294 N 1.22 3.90 -0.08 1.68 -7.23 -0.04 -1.88 120.40 117.96 1xcx s VAL 294 Ca -0.04 -1.62 -0.31 0.00 -1.81 0.00 0.00 61.98 58.21 1xcx s VAL 294 Cb -0.18 -3.15 0.12 0.00 0.56 0.00 0.00 36.38 33.73 1xcx s VAL 294 CO -0.05 -0.33 1.00 0.72 -0.31 0.00 0.00 175.10 176.13 1xcx s PHE 295 N -2.24 -0.27 -0.13 2.82 -0.71 -1.26 -1.15 117.98 115.03 1xcx s PHE 295 Ca 0.33 0.19 -0.24 0.00 -1.04 0.00 0.00 56.93 56.17 1xcx s PHE 295 Cb -0.07 0.53 -0.26 0.00 -1.21 0.00 0.00 43.02 42.01 1xcx s PHE 295 CO 0.23 -0.42 0.64 0.28 -1.34 0.00 0.00 175.22 174.62 1xcx h VAL 296 N 2.03 1.44 -4.29 -2.49 2.07 -1.94 -3.26 116.25 109.80 1xcx h VAL 296 Ca -0.17 -2.36 -0.14 0.00 0.82 0.00 0.00 66.70 64.85 1xcx h VAL 296 Cb 1.21 3.01 -0.15 0.00 -1.52 0.00 0.00 31.29 33.84 1xcx h VAL 296 CO 0.28 0.58 -0.66 1.51 0.02 0.00 0.00 177.57 179.31 1xcx s ASP 297 N -6.63 0.41 0.32 0.57 -4.77 -1.26 -4.51 116.67 100.80 1xcx s ASP 297 Ca -0.20 -1.06 0.03 0.00 -3.30 0.00 0.00 52.55 48.01 1xcx s ASP 297 Cb 0.01 0.24 -0.05 0.00 -1.09 0.00 0.00 42.92 42.03 1xcx s ASP 297 CO 0.71 -0.65 0.11 0.54 0.70 0.00 0.00 175.17 176.57 1xcx s ASN 298 N -2.97 1.94 0.67 2.11 4.22 -1.26 -4.70 114.94 114.95 1xcx s ASN 298 Ca 0.13 -1.48 0.36 0.00 -2.14 0.00 0.00 52.86 49.73 1xcx s ASN 298 Cb 0.08 0.22 1.97 0.00 1.28 0.00 0.00 41.25 44.80 1xcx s ASN 298 CO -0.06 -0.78 2.12 1.12 -2.04 0.00 0.00 177.10 177.46 1xcx h HIS 299 N 2.14 0.00 0.00 1.54 2.07 -1.99 -2.32 115.15 116.59 1xcx h HIS 299 Ca -0.37 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.15 1xcx h HIS 299 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1xcx h HIS 299 CO 0.85 0.00 0.00 -0.25 -3.07 0.00 0.00 177.93 175.46 1xcx n ASP 300 N -3.00 0.00 0.07 3.10 8.00 -1.26 -4.30 116.55 119.16 1xcx n ASP 300 Ca -0.02 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.49 1xcx n ASP 300 Cb 0.25 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.44 1xcx n ASP 300 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1xcx n ASN 301 N -0.56 0.09 0.10 -2.24 0.23 -1.23 -0.56 115.26 111.09 1xcx n ASN 301 Ca 0.00 0.29 0.12 0.00 -0.53 0.00 0.00 54.58 54.47 1xcx n ASN 301 Cb 0.00 -0.24 0.45 0.00 -2.08 0.00 0.00 39.78 37.91 1xcx n ASN 301 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xcx n GLN 302 N -1.50 0.19 -0.44 -3.83 10.64 -0.87 -2.55 117.38 119.02 1xcx n GLN 302 Ca -0.00 0.28 0.07 0.00 -1.83 0.00 0.00 57.00 55.52 1xcx n GLN 302 Cb 0.38 -1.79 0.15 0.00 -0.86 0.00 0.00 30.24 28.12 1xcx n GLN 302 CO 0.00 0.00 0.00 2.89 -1.83 0.00 0.00 177.06 178.12 1xcx n ARG 303 N -2.14 1.22 -3.54 2.61 1.85 0.28 -4.99 116.66 111.95 1xcx n ARG 303 Ca 0.04 -2.73 -0.24 0.00 -1.00 0.00 0.00 57.85 53.92 1xcx n ARG 303 Cb 0.32 -1.36 0.07 0.00 -1.05 0.00 0.00 32.46 30.44 1xcx n ARG 303 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1xcx n GLY 304 N -1.05 -0.54 0.01 2.89 0.00 -1.06 -4.91 105.19 100.54 1xcx n GLY 304 Ca 0.15 0.24 0.05 0.00 0.00 0.00 0.00 46.02 46.45 1xcx n GLY 304 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xcx n HIS 305 N -4.91 0.00 0.00 1.61 -0.00 -1.20 -4.94 115.22 105.78 1xcx n HIS 305 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.71 1xcx n HIS 305 Cb 0.57 -0.34 0.00 0.00 -0.00 0.00 0.00 29.99 30.22 1xcx n HIS 305 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1xcx n GLY 306 N 1.85 0.38 3.02 -1.41 0.00 -1.26 -4.83 105.19 102.93 1xcx n GLY 306 Ca -0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 1xcx n GLY 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcx s ALA 307 N -3.02 0.07 0.00 4.61 0.00 -1.26 -4.89 121.76 117.27 1xcx s ALA 307 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1xcx s ALA 307 Cb 0.00 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.28 1xcx s ALA 307 CO 0.00 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 175.97 1xcx n GLY 308 N 1.38 4.03 7.00 0.00 0.00 -1.26 -4.63 105.19 111.71 1xcx n GLY 308 Ca -0.23 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1xcx n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xcx n GLY 309 N 0.00 0.28 0.29 -0.02 0.00 -1.26 -3.81 105.19 100.67 1xcx n GLY 309 Ca 0.00 -0.87 0.18 0.00 0.00 0.00 0.00 46.02 45.33 1xcx n GLY 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcx h ALA 310 N -0.50 1.03 0.00 4.61 0.00 -1.99 -3.06 119.26 119.36 1xcx h ALA 310 Ca 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1xcx h ALA 310 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1xcx h ALA 310 CO 0.00 0.03 -0.36 0.66 0.00 0.00 0.00 179.25 179.58 1xcx h SER 311 N 0.00 0.00 -2.44 0.00 4.64 -1.91 -3.46 113.55 110.38 1xcx h SER 311 Ca -0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 1xcx h SER 311 Cb 0.35 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.52 1xcx h SER 311 CO 0.00 0.36 0.59 -0.38 -0.87 0.00 0.00 176.83 176.53 1xcx n ILE 312 N -3.41 0.70 -3.82 0.95 2.08 -1.16 -4.37 119.36 110.34 1xcx n ILE 312 Ca 0.00 -0.18 -0.36 0.00 0.56 0.00 0.00 62.75 62.78 1xcx n ILE 312 Cb 0.54 -1.36 -0.06 0.00 -0.75 0.00 0.00 39.64 38.01 1xcx n ILE 312 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1xcx s LEU 313 N 0.35 4.39 0.34 1.39 1.43 -1.26 -5.06 118.68 120.27 1xcx s LEU 313 Ca 0.72 0.52 0.08 0.00 -1.03 0.00 0.00 54.13 54.42 1xcx s LEU 313 Cb -0.70 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.21 1xcx s LEU 313 CO 0.48 0.36 0.28 0.42 0.23 0.00 0.00 176.35 178.12 1xcx s THR 314 N -1.11 0.03 0.60 5.49 -4.23 -1.26 -4.38 115.64 110.78 1xcx s THR 314 Ca 0.19 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 59.00 1xcx s THR 314 Cb -0.13 -2.49 0.36 0.00 1.34 0.00 0.00 72.50 71.59 1xcx s THR 314 CO 0.08 0.00 2.15 2.19 -0.54 0.00 0.00 174.62 178.50 1xcx h PHE 315 N 2.08 0.00 -0.18 3.99 -0.00 -1.96 0.43 116.94 121.29 1xcx h PHE 315 Ca -0.25 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 57.72 1xcx h PHE 315 Cb 1.23 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 37.17 1xcx h PHE 315 CO 1.81 0.00 0.11 -1.49 -0.00 0.00 0.00 178.31 178.74 1xcx h TRP 316 N 0.00 0.23 -2.00 6.09 4.06 -1.98 -2.07 115.95 120.29 1xcx h TRP 316 Ca 0.06 0.00 -0.76 0.00 2.06 0.00 0.00 58.89 60.26 1xcx h TRP 316 Cb 0.36 -0.08 -0.29 0.00 -1.00 0.00 0.00 29.16 28.15 1xcx h TRP 316 CO 0.00 0.16 0.86 -0.25 -3.56 0.00 0.00 178.44 175.65 1xcx n ASP 317 N -4.50 7.18 -0.26 -3.49 8.00 0.14 -4.92 116.55 118.71 1xcx n ASP 317 Ca -0.00 -3.80 -0.07 0.00 0.71 0.00 0.00 54.79 51.63 1xcx n ASP 317 Cb 0.08 -1.02 -0.06 0.00 -0.02 0.00 0.00 41.12 40.11 1xcx n ASP 317 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xcx n ALA 318 N -0.46 -0.40 0.01 2.24 0.00 -0.78 -0.72 120.51 120.40 1xcx n ALA 318 Ca 0.51 0.53 -0.10 0.00 0.00 0.00 0.00 53.44 54.37 1xcx n ALA 318 Cb 0.28 -0.08 -0.05 0.00 0.00 0.00 0.00 19.45 19.60 1xcx n ALA 318 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1xcx h ARG 319 N 0.00 -0.05 0.00 0.00 2.43 -1.90 -1.89 114.38 112.96 1xcx h ARG 319 Ca 0.10 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.15 1xcx h ARG 319 Cb 0.25 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1xcx h ARG 319 CO -0.58 -0.04 -0.57 -0.07 -1.51 0.00 0.00 179.97 177.21 1xcx h LEU 320 N -0.06 0.00 -0.26 3.80 3.38 -1.81 -3.18 115.31 117.19 1xcx h LEU 320 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1xcx h LEU 320 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1xcx h LEU 320 CO -0.12 0.57 0.08 0.22 0.09 0.00 0.00 178.44 179.27 1xcx h TYR 321 N 0.00 0.42 -0.49 1.13 3.20 -0.59 -1.85 116.97 118.78 1xcx h TYR 321 Ca -0.01 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 1xcx h TYR 321 Cb 1.08 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.21 1xcx h TYR 321 CO 0.00 0.46 0.29 0.87 -1.64 0.00 0.00 178.16 178.14 1xcx h LYS 322 N 0.25 0.66 -0.33 1.82 1.57 -1.36 -0.67 116.57 118.51 1xcx h LYS 322 Ca 0.08 -0.05 -0.16 0.00 -1.87 0.00 0.00 60.65 58.65 1xcx h LYS 322 Cb 0.24 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 1xcx h LYS 322 CO -0.00 0.47 -0.44 1.98 -0.57 0.00 0.00 179.45 180.89 1xcx h MET 323 N 0.68 0.88 -0.37 3.15 4.05 -1.48 -0.22 114.93 121.61 1xcx h MET 323 Ca 0.18 -0.50 -0.07 0.00 -0.28 0.00 0.00 59.70 59.02 1xcx h MET 323 Cb -0.02 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 1xcx h MET 323 CO -0.03 1.15 -0.04 0.00 0.23 0.00 0.00 176.91 178.21 1xcx h ALA 324 N 0.72 0.50 -0.28 0.39 0.00 -0.83 -0.34 119.26 119.42 1xcx h ALA 324 Ca 0.04 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 1xcx h ALA 324 Cb 1.04 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1xcx h ALA 324 CO 0.10 0.32 -0.24 0.28 0.00 0.00 0.00 179.25 179.71 1xcx h VAL 325 N 0.49 1.26 -0.29 0.00 2.07 -1.15 -1.63 116.25 117.00 1xcx h VAL 325 Ca 0.10 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 1xcx h VAL 325 Cb 0.53 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1xcx h VAL 325 CO 0.03 0.41 0.10 1.23 0.02 0.00 0.00 177.57 179.35 1xcx h GLY 326 N 1.01 0.48 0.95 2.17 0.00 -0.67 -1.08 103.07 105.93 1xcx h GLY 326 Ca 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1xcx h GLY 326 CO 0.05 0.26 0.17 -2.75 0.00 0.00 0.00 176.54 174.27 1xcx h PHE 327 N 0.31 0.46 -0.21 5.60 3.57 -0.89 -2.09 116.94 123.69 1xcx h PHE 327 Ca 0.09 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.62 1xcx h PHE 327 Cb 0.23 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 1xcx h PHE 327 CO 0.00 0.38 -0.03 1.98 -2.23 0.00 0.00 178.31 178.41 1xcx h MET 328 N 0.41 0.03 0.00 1.11 4.05 -1.14 -0.85 114.93 118.54 1xcx h MET 328 Ca 0.12 -0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.50 1xcx h MET 328 Cb 0.08 -0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 30.86 1xcx h MET 328 CO -0.02 0.02 -0.14 -0.07 0.23 0.00 0.00 176.91 176.93 1xcx h LEU 329 N 0.03 0.00 0.00 3.39 3.38 -1.09 -3.00 115.31 118.02 1xcx h LEU 329 Ca 0.10 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.81 1xcx h LEU 329 Cb 0.14 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1xcx h LEU 329 CO -0.19 0.14 -1.51 0.00 0.09 0.00 0.00 178.44 176.97 1xcx h ALA 330 N 1.86 0.68 -2.61 1.53 0.00 -0.96 -3.38 119.26 116.38 1xcx h ALA 330 Ca -0.00 -1.28 -0.51 0.00 0.00 0.00 0.00 54.91 53.12 1xcx h ALA 330 Cb 0.53 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1xcx h ALA 330 CO 0.02 1.44 0.38 -1.58 0.00 0.00 0.00 179.25 179.50 1xcx s HIS 331 N -2.66 3.81 0.45 0.00 5.65 -0.36 -4.95 115.29 117.22 1xcx s HIS 331 Ca -0.03 1.79 0.40 0.00 0.25 0.00 0.00 55.06 57.47 1xcx s HIS 331 Cb 0.08 -3.08 2.09 0.00 -1.18 0.00 0.00 32.58 30.50 1xcx s HIS 331 CO 0.82 0.12 2.22 -1.00 -0.65 0.00 0.00 174.74 176.25 1xcx h PRO 332 N 5.25 0.00 -6.69 2.88 0.13 -1.90 -3.46 132.00 128.21 1xcx h PRO 332 Ca -0.43 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.17 1xcx h PRO 332 Cb 1.21 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.38 1xcx h PRO 332 CO 0.71 0.00 0.73 -0.47 -0.23 0.00 0.00 178.00 178.74 1xcx s TYR 333 N -3.98 3.13 0.24 1.56 6.14 -1.26 -4.90 117.35 118.27 1xcx s TYR 333 Ca -0.03 1.05 0.00 0.00 0.64 0.00 0.00 57.07 58.73 1xcx s TYR 333 Cb 0.11 -3.74 0.00 0.00 0.42 0.00 0.00 41.96 38.76 1xcx s TYR 333 CO 0.41 -2.43 0.00 0.41 0.64 0.00 0.00 175.55 174.58 1xcx n GLY 334 N 2.52 -1.74 3.54 8.97 0.00 -1.26 -4.82 105.19 112.40 1xcx n GLY 334 Ca 0.08 -1.15 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 1xcx n GLY 334 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xcx s PHE 335 N -1.64 3.14 0.06 1.61 5.36 -0.74 -4.94 117.98 120.82 1xcx s PHE 335 Ca 0.00 -0.19 -0.20 0.00 -0.96 0.00 0.00 56.93 55.59 1xcx s PHE 335 Cb 0.00 -2.11 -0.06 0.00 -0.34 0.00 0.00 43.02 40.51 1xcx s PHE 335 CO 0.00 -0.07 0.58 0.95 -1.46 0.00 0.00 175.22 175.21 1xcx s THR 336 N 0.81 4.76 -0.12 0.12 -4.23 -1.26 -0.86 115.64 114.87 1xcx s THR 336 Ca 0.02 1.23 0.02 0.00 -1.18 0.00 0.00 61.69 61.79 1xcx s THR 336 Cb -0.14 -3.91 0.01 0.00 1.34 0.00 0.00 72.50 69.81 1xcx s THR 336 CO 0.02 0.53 -0.19 -0.60 -0.54 0.00 0.00 174.62 173.84 1xcx s ARG 337 N -0.94 2.63 -0.10 3.99 3.52 -0.30 -2.25 118.95 125.49 1xcx s ARG 337 Ca 0.29 -0.71 -0.11 0.00 -0.13 0.00 0.00 55.73 55.07 1xcx s ARG 337 Cb -0.19 -2.15 -0.05 0.00 -1.56 0.00 0.00 34.95 31.00 1xcx s ARG 337 CO 0.19 -0.02 0.26 0.08 -0.81 0.00 0.00 175.30 175.00 1xcx s VAL 338 N 0.84 5.30 0.10 7.11 1.01 0.20 -4.50 120.40 130.47 1xcx s VAL 338 Ca -0.08 0.50 -0.15 0.00 0.00 0.00 0.00 61.98 62.25 1xcx s VAL 338 Cb -0.15 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 1xcx s VAL 338 CO -0.01 0.53 0.51 -0.32 0.00 0.00 0.00 175.10 175.82 1xcx s MET 339 N -0.52 3.99 -0.12 2.72 1.75 -1.26 -0.27 119.30 125.58 1xcx s MET 339 Ca 0.18 0.49 -0.03 0.00 -1.25 0.00 0.00 55.69 55.08 1xcx s MET 339 Cb -0.14 -3.05 0.04 0.00 2.84 0.00 0.00 34.83 34.53 1xcx s MET 339 CO 0.06 0.55 0.04 0.45 -0.65 0.00 0.00 175.02 175.48 1xcx s SER 340 N -1.50 1.98 0.39 1.11 0.15 -0.88 -4.33 113.70 110.63 1xcx s SER 340 Ca 0.33 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.64 1xcx s SER 340 Cb -0.16 -0.36 0.00 0.00 -1.71 0.00 0.00 66.02 63.79 1xcx s SER 340 CO 0.18 -0.27 0.02 -1.20 1.20 0.00 0.00 173.24 173.17 1xcx n SER 341 N 5.19 3.02 -4.35 5.45 7.64 -1.26 -3.09 113.62 126.22 1xcx n SER 341 Ca -0.07 -2.67 -0.23 0.00 1.01 0.00 0.00 58.87 56.91 1xcx n SER 341 Cb 0.49 0.25 -0.11 0.00 -1.01 0.00 0.00 64.21 63.83 1xcx n SER 341 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1xcx s TYR 342 N -2.37 1.92 0.29 1.43 -0.85 -1.26 0.01 117.35 116.51 1xcx s TYR 342 Ca 0.02 -0.44 -0.17 0.00 -0.52 0.00 0.00 57.07 55.96 1xcx s TYR 342 Cb -0.00 -0.96 -0.09 0.00 0.38 0.00 0.00 41.96 41.30 1xcx s TYR 342 CO 0.01 0.36 0.73 1.03 -1.52 0.00 0.00 175.55 176.17 1xcx s ARG 343 N -2.74 4.10 0.04 -3.49 0.52 0.17 -4.83 118.95 112.72 1xcx s ARG 343 Ca 0.16 0.75 -0.02 0.00 -0.52 0.00 0.00 55.73 56.11 1xcx s ARG 343 Cb -0.06 -2.60 -0.03 0.00 0.52 0.00 0.00 34.95 32.78 1xcx s ARG 343 CO 0.07 0.24 -0.00 1.67 0.02 0.00 0.00 175.30 177.30 1xcx s TRP 344 N -1.81 0.37 -1.07 -0.53 -2.14 -1.26 -4.83 118.94 107.67 1xcx s TRP 344 Ca 0.50 -0.77 -0.22 0.00 2.66 0.00 0.00 56.10 58.26 1xcx s TRP 344 Cb -0.13 -0.27 0.01 0.00 -3.10 0.00 0.00 33.47 29.99 1xcx s TRP 344 CO 0.19 -0.32 1.70 -1.25 -2.66 0.00 0.00 176.95 174.61 1xcx s PRO 345 N -2.85 3.26 0.23 3.25 0.04 -1.26 -4.96 135.00 132.71 1xcx s PRO 345 Ca -0.03 -1.09 -0.31 0.00 0.04 0.00 0.00 61.00 59.61 1xcx s PRO 345 Cb 0.00 -5.30 -0.11 0.00 0.04 0.00 0.00 34.50 29.12 1xcx s PRO 345 CO -0.06 -2.75 1.64 1.03 0.04 0.00 0.00 177.00 176.90 1xcx s ARG 346 N 5.54 4.15 -0.32 4.56 0.52 -1.26 -4.65 118.95 127.50 1xcx s ARG 346 Ca 0.57 2.54 -0.02 0.00 -0.52 0.00 0.00 55.73 58.30 1xcx s ARG 346 Cb -0.01 -3.08 0.11 0.00 0.52 0.00 0.00 34.95 32.49 1xcx s ARG 346 CO -0.01 -0.68 0.14 -1.14 0.02 0.00 0.00 175.30 173.64 1xcx s GLN 347 N 0.62 0.47 0.19 3.54 0.74 -1.26 -5.02 119.66 118.94 1xcx s GLN 347 Ca 0.70 -0.91 -0.30 0.00 0.05 0.00 0.00 55.36 54.90 1xcx s GLN 347 Cb -0.48 -1.49 -0.08 0.00 1.10 0.00 0.00 33.01 32.06 1xcx s GLN 347 CO 0.37 -1.05 1.01 -0.06 -0.55 0.00 0.00 175.29 175.01 1xcx s PHE 348 N 1.68 3.78 -0.12 1.67 0.08 -1.26 -1.35 117.98 122.47 1xcx s PHE 348 Ca 0.11 1.77 -0.04 0.00 0.12 0.00 0.00 56.93 58.90 1xcx s PHE 348 Cb -0.18 -3.12 0.06 0.00 -0.57 0.00 0.00 43.02 39.21 1xcx s PHE 348 CO -0.25 -0.02 0.16 -0.65 -0.10 0.00 0.00 175.22 174.36 1xcx s GLN 349 N -0.68 0.07 -1.47 0.44 -0.21 0.23 -4.82 119.66 113.22 1xcx s GLN 349 Ca 0.45 0.40 -0.08 0.00 0.02 0.00 0.00 55.36 56.15 1xcx s GLN 349 Cb -0.27 -0.69 0.02 0.00 1.00 0.00 0.00 33.01 33.08 1xcx s GLN 349 CO 0.33 -0.43 0.82 0.09 -2.12 0.00 0.00 175.29 173.98 1xcx n ASN 350 N 5.32 -5.83 0.00 5.90 3.02 -1.26 -1.54 115.26 120.87 1xcx n ASN 350 Ca -0.05 -0.43 0.00 0.00 -0.03 0.00 0.00 54.58 54.07 1xcx n ASN 350 Cb 0.50 -4.67 0.00 0.00 -0.61 0.00 0.00 39.78 35.00 1xcx n ASN 350 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xcx n GLY 351 N -1.66 0.57 3.14 7.41 0.00 -1.26 -5.04 105.19 108.35 1xcx n GLY 351 Ca -0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1xcx n GLY 351 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xcx s ASN 352 N -2.09 1.90 -0.57 1.61 -0.87 -0.59 -5.07 114.94 109.27 1xcx s ASN 352 Ca 0.00 -0.29 -0.26 0.00 -1.57 0.00 0.00 52.86 50.73 1xcx s ASN 352 Cb 0.00 -0.25 0.04 0.00 -0.02 0.00 0.00 41.25 41.02 1xcx s ASN 352 CO 0.00 0.19 1.08 -0.62 -2.57 0.00 0.00 177.10 175.18 1xcx s ASP 353 N -0.33 6.39 0.14 -1.22 2.15 -1.26 0.78 116.67 123.32 1xcx s ASP 353 Ca 0.05 -0.11 0.20 0.00 0.43 0.00 0.00 52.55 53.12 1xcx s ASP 353 Cb -0.07 -2.50 0.83 0.00 -0.30 0.00 0.00 42.92 40.88 1xcx s ASP 353 CO -0.00 -1.37 1.61 1.33 -0.17 0.00 0.00 175.17 176.57 1xcx n VAL 354 N 6.45 0.88 -1.29 1.11 0.24 -0.46 -2.68 118.33 122.58 1xcx n VAL 354 Ca 0.05 0.22 -0.10 0.00 -2.04 0.00 0.00 64.34 62.47 1xcx n VAL 354 Cb 0.48 -1.06 0.21 0.00 -1.47 0.00 0.00 33.84 32.01 1xcx n VAL 354 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1xcx n ASN 355 N -1.90 3.32 0.00 -1.34 3.02 -1.26 -4.61 115.26 112.49 1xcx n ASN 355 Ca 0.03 -3.59 0.09 0.00 -0.03 0.00 0.00 54.58 51.08 1xcx n ASN 355 Cb 0.21 -0.71 0.47 0.00 -0.61 0.00 0.00 39.78 39.14 1xcx n ASN 355 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1xcx n ASP 356 N -0.96 0.00 0.05 6.41 5.75 -1.09 -2.59 116.55 124.12 1xcx n ASP 356 Ca 0.42 -0.09 0.07 0.00 -0.01 0.00 0.00 54.79 55.18 1xcx n ASP 356 Cb 1.29 -0.23 -0.07 0.00 -1.03 0.00 0.00 41.12 41.08 1xcx n ASP 356 CO 0.00 0.00 0.00 -2.67 -0.11 0.00 0.00 177.20 174.42 1xcx n TRP 357 N -1.23 0.72 -1.64 2.11 4.27 -1.26 -4.96 117.44 115.45 1xcx n TRP 357 Ca 0.10 0.22 -0.58 0.00 -3.89 0.00 0.00 57.50 53.35 1xcx n TRP 357 Cb 0.13 -0.90 -0.07 0.00 -1.36 0.00 0.00 31.31 29.10 1xcx n TRP 357 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68 1xcx n VAL 358 N -2.65 0.09 -1.29 -1.67 0.31 -1.07 -2.38 118.33 109.67 1xcx n VAL 358 Ca -0.05 -0.02 -0.12 0.00 -0.01 0.00 0.00 64.34 64.14 1xcx n VAL 358 Cb 0.66 -0.73 0.09 0.00 -0.91 0.00 0.00 33.84 32.95 1xcx n VAL 358 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xcx n GLY 359 N 3.09 -1.46 3.72 2.92 0.00 -1.24 -4.33 105.19 107.89 1xcx n GLY 359 Ca 0.23 -1.66 -0.32 0.00 0.00 0.00 0.00 46.02 44.27 1xcx n GLY 359 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xcx s PRO 360 N -4.16 1.81 0.11 1.61 0.04 -1.26 -4.89 135.00 128.25 1xcx s PRO 360 Ca 0.31 1.55 -0.36 0.00 0.04 0.00 0.00 61.00 62.54 1xcx s PRO 360 Cb -0.01 -1.82 -0.17 0.00 0.04 0.00 0.00 34.50 32.55 1xcx s PRO 360 CO 0.22 -2.04 1.28 -2.30 0.04 0.00 0.00 177.00 174.20 1xcx n PRO 361 N -3.39 1.11 -3.90 0.56 -0.02 -1.26 -4.85 135.00 123.25 1xcx n PRO 361 Ca 0.12 0.40 -0.09 0.00 -2.02 0.00 0.00 63.50 61.91 1xcx n PRO 361 Cb 0.52 -2.00 -0.04 0.00 -0.02 0.00 0.00 33.50 31.95 1xcx n PRO 361 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1xcx s ASN 362 N 0.34 -0.16 -0.29 2.55 2.20 -1.26 -0.20 114.94 118.12 1xcx s ASN 362 Ca 0.82 -0.75 0.01 0.00 -0.94 0.00 0.00 52.86 52.00 1xcx s ASN 362 Cb -0.94 0.60 0.09 0.00 -2.00 0.00 0.00 41.25 39.00 1xcx s ASN 362 CO 0.48 -1.14 0.04 0.20 -2.94 0.00 0.00 177.10 173.74 1xcx s ASN 363 N -2.96 4.14 -1.63 3.54 0.02 0.03 -4.74 114.94 113.33 1xcx s ASN 363 Ca 0.17 -1.61 -0.03 0.00 -1.02 0.00 0.00 52.86 50.36 1xcx s ASN 363 Cb -0.01 -1.16 0.01 0.00 0.02 0.00 0.00 41.25 40.10 1xcx s ASN 363 CO 0.05 -0.35 0.38 0.59 0.02 0.00 0.00 177.10 177.80 1xcx n ASN 364 N 4.63 -5.99 0.00 -1.22 3.02 -1.26 -1.56 115.26 112.88 1xcx n ASN 364 Ca -0.04 -0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.33 1xcx n ASN 364 Cb 0.43 -4.90 0.00 0.00 -0.61 0.00 0.00 39.78 34.70 1xcx n ASN 364 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xcx n GLY 365 N -1.33 1.20 3.57 7.41 0.00 -1.26 -5.03 105.19 109.76 1xcx n GLY 365 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1xcx n GLY 365 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xcx s VAL 366 N -2.32 4.90 0.17 1.61 1.01 -0.60 -5.01 120.40 120.16 1xcx s VAL 366 Ca 0.00 0.61 -0.34 0.00 0.00 0.00 0.00 61.98 62.26 1xcx s VAL 366 Cb 0.00 -4.06 -0.14 0.00 0.00 0.00 0.00 36.38 32.18 1xcx s VAL 366 CO 0.00 -0.28 1.44 -0.38 0.00 0.00 0.00 175.10 175.88 1xcx n ILE 367 N 5.55 0.35 -2.38 2.22 5.41 -1.26 -0.79 119.36 128.47 1xcx n ILE 367 Ca -0.01 -0.09 -0.35 0.00 1.00 0.00 0.00 62.75 63.30 1xcx n ILE 367 Cb 0.49 -1.30 -0.01 0.00 -0.71 0.00 0.00 39.64 38.10 1xcx n ILE 367 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1xcx s LYS 368 N 0.33 3.58 0.51 0.38 1.02 0.72 -4.86 119.74 121.41 1xcx s LYS 368 Ca 0.76 1.53 -0.18 0.00 0.02 0.00 0.00 55.97 58.11 1xcx s LYS 368 Cb -0.74 -2.08 -0.08 0.00 -0.52 0.00 0.00 37.83 34.40 1xcx s LYS 368 CO 0.44 -0.65 0.99 -1.83 -0.92 0.00 0.00 175.35 173.39 1xcx s GLU 369 N -3.20 3.91 -0.32 1.68 1.03 -1.26 -4.91 118.70 115.63 1xcx s GLU 369 Ca 0.70 1.04 -0.29 0.00 0.03 0.00 0.00 54.97 56.45 1xcx s GLU 369 Cb -0.21 -2.13 0.02 0.00 -0.80 0.00 0.00 34.13 31.01 1xcx s GLU 369 CO 0.25 -0.30 1.06 0.08 -1.33 0.00 0.00 175.26 175.01 1xcx s VAL 370 N -2.48 4.52 -0.03 1.83 1.01 -1.26 -4.79 120.40 119.20 1xcx s VAL 370 Ca 0.61 1.70 -0.03 0.00 0.00 0.00 0.00 61.98 64.25 1xcx s VAL 370 Cb -0.11 -4.41 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 1xcx s VAL 370 CO 0.28 -0.48 0.14 0.42 0.00 0.00 0.00 175.10 175.46 1xcx s THR 371 N 3.63 5.19 -0.19 3.92 -4.23 -1.26 -4.98 115.64 117.72 1xcx s THR 371 Ca 0.45 -0.17 -0.06 0.00 -1.18 0.00 0.00 61.69 60.73 1xcx s THR 371 Cb -0.12 -3.37 -0.03 0.00 1.34 0.00 0.00 72.50 70.32 1xcx s THR 371 CO 0.15 0.40 0.02 -0.63 -0.54 0.00 0.00 174.62 174.02 1xcx s ILE 372 N -1.21 4.23 0.53 2.99 -1.09 -1.26 -0.65 121.20 124.73 1xcx s ILE 372 Ca 0.23 -0.23 -0.11 0.00 -2.23 0.00 0.00 60.65 58.32 1xcx s ILE 372 Cb -0.12 -2.90 -0.05 0.00 -1.58 0.00 0.00 42.46 37.80 1xcx s ILE 372 CO 0.14 0.45 0.92 0.20 -1.23 0.00 0.00 174.94 175.41 1xcx s ASN 373 N 0.68 6.38 0.58 3.58 0.01 0.11 -4.93 114.94 121.35 1xcx s ASN 373 Ca 0.01 1.28 0.29 0.00 -0.71 0.00 0.00 52.86 53.73 1xcx s ASN 373 Cb -0.14 -2.40 1.44 0.00 0.41 0.00 0.00 41.25 40.56 1xcx s ASN 373 CO 0.02 -0.65 1.85 1.55 -1.51 0.00 0.00 177.10 178.35 1xcx h PRO 374 N 0.36 0.00 -0.52 -0.60 0.13 -1.99 0.29 132.00 129.67 1xcx h PRO 374 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1xcx h PRO 374 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1xcx h PRO 374 CO 0.62 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.99 1xcx n ASP 375 N -3.74 2.79 0.00 1.44 5.75 -1.26 -4.92 116.55 116.62 1xcx n ASP 375 Ca 0.11 -2.07 0.00 0.00 -0.01 0.00 0.00 54.79 52.82 1xcx n ASP 375 Cb 0.78 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 1xcx n ASP 375 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1xcx n THR 376 N 0.88 0.00 -2.12 2.12 -2.24 0.10 -5.05 114.28 107.97 1xcx n THR 376 Ca 0.17 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.67 1xcx n THR 376 Cb 0.46 -0.02 0.13 0.00 -2.10 0.00 0.00 70.33 68.81 1xcx n THR 376 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1xcx s THR 377 N -3.28 2.08 0.22 4.28 -4.23 -1.25 -4.73 115.64 108.72 1xcx s THR 377 Ca 0.00 -0.18 0.07 0.00 -1.18 0.00 0.00 61.69 60.39 1xcx s THR 377 Cb 0.00 -2.90 -0.04 0.00 1.34 0.00 0.00 72.50 70.90 1xcx s THR 377 CO 0.00 0.00 0.15 0.00 -0.54 0.00 0.00 174.62 174.23 1xcx n GLY 379 N -0.85 4.06 2.43 0.00 0.00 0.17 -4.70 105.19 106.29 1xcx n GLY 379 Ca -0.08 -2.17 -0.19 0.00 0.00 0.00 0.00 46.02 43.58 1xcx n GLY 379 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xcx n ASN 380 N -1.26 -5.45 -0.45 1.61 3.02 -1.26 -2.54 115.26 108.92 1xcx n ASN 380 Ca 0.00 0.13 -0.06 0.00 -0.03 0.00 0.00 54.58 54.62 1xcx n ASN 380 Cb 0.00 -4.62 -0.03 0.00 -0.61 0.00 0.00 39.78 34.53 1xcx n ASN 380 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xcx n ASP 381 N -1.79 -4.07 -4.69 6.41 8.00 -1.26 -4.74 116.55 114.40 1xcx n ASP 381 Ca -0.22 0.15 -0.39 0.00 0.71 0.00 0.00 54.79 55.03 1xcx n ASP 381 Cb 0.67 -2.09 -0.05 0.00 -0.02 0.00 0.00 41.12 39.62 1xcx n ASP 381 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1xcx s TRP 382 N -2.10 3.48 0.12 1.24 0.52 -1.05 -0.66 118.94 120.49 1xcx s TRP 382 Ca 0.00 1.03 -0.11 0.00 0.02 0.00 0.00 56.10 57.04 1xcx s TRP 382 Cb 0.00 -2.74 -0.10 0.00 -1.15 0.00 0.00 33.47 29.48 1xcx s TRP 382 CO 0.00 0.00 1.36 0.28 0.02 0.00 0.00 176.95 178.61 1xcx h VAL 383 N 4.92 1.28 -6.20 4.03 2.07 -0.74 -3.41 116.25 118.22 1xcx h VAL 383 Ca -0.37 -1.87 -0.43 0.00 0.82 0.00 0.00 66.70 64.85 1xcx h VAL 383 Cb 1.17 1.83 0.09 0.00 -1.52 0.00 0.00 31.29 32.86 1xcx h VAL 383 CO 0.76 0.60 -0.93 0.00 0.02 0.00 0.00 177.57 178.02 1xcx h GLU 385 N -1.86 0.27 0.00 0.00 3.07 -1.87 -1.30 114.58 112.89 1xcx h GLU 385 Ca -0.66 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.17 1xcx h GLU 385 Cb 1.36 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.21 1xcx h GLU 385 CO 0.49 0.23 0.00 -2.39 -1.40 0.00 0.00 179.01 175.94 1xcx n HIS 386 N -4.45 0.43 1.01 4.33 1.44 -1.26 -1.32 115.22 115.39 1xcx n HIS 386 Ca -0.00 0.20 0.11 0.00 -2.01 0.00 0.00 57.72 56.01 1xcx n HIS 386 Cb 0.12 -0.82 -0.04 0.00 0.12 0.00 0.00 29.99 29.37 1xcx n HIS 386 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1xcx n ARG 387 N -1.92 0.55 -1.99 -1.40 1.74 -0.49 -4.13 116.66 109.02 1xcx n ARG 387 Ca 0.01 -0.45 -0.42 0.00 -0.77 0.00 0.00 57.85 56.22 1xcx n ARG 387 Cb 0.09 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 1xcx n ARG 387 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1xcx s TRP 388 N -2.76 3.06 0.23 -1.55 0.52 -0.44 -4.81 118.94 113.19 1xcx s TRP 388 Ca 0.13 0.68 -0.09 0.00 0.02 0.00 0.00 56.10 56.84 1xcx s TRP 388 Cb 0.17 -3.87 0.36 0.00 -1.15 0.00 0.00 33.47 28.98 1xcx s TRP 388 CO 0.72 -3.21 1.63 -0.09 0.02 0.00 0.00 176.95 176.02 1xcx h ARG 389 N 6.92 0.07 -0.67 4.98 2.43 -1.91 0.20 114.38 126.39 1xcx h ARG 389 Ca -0.42 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 58.77 1xcx h ARG 389 Cb 1.20 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.70 1xcx h ARG 389 CO 0.90 0.05 0.44 1.96 -1.51 0.00 0.00 179.97 181.81 1xcx h GLN 390 N 0.07 0.79 0.12 0.20 7.50 -1.83 0.39 115.11 122.36 1xcx h GLN 390 Ca 0.37 -0.05 -0.24 0.00 0.50 0.00 0.00 58.65 59.23 1xcx h GLN 390 Cb 0.62 -0.18 0.00 0.00 0.05 0.00 0.00 27.48 27.97 1xcx h GLN 390 CO -0.65 0.53 -1.19 0.82 -1.50 0.00 0.00 178.83 176.83 1xcx h ILE 391 N 0.82 1.19 -0.68 2.54 2.04 -1.39 -3.16 117.51 118.87 1xcx h ILE 391 Ca 0.26 -2.44 0.01 0.00 1.00 0.00 0.00 64.86 63.69 1xcx h ILE 391 Cb 0.04 2.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.95 1xcx h ILE 391 CO -0.07 0.69 0.45 -0.09 0.00 0.00 0.00 178.15 179.13 1xcx h ARG 392 N -0.36 0.89 0.00 2.37 1.12 -0.59 -1.46 114.38 116.35 1xcx h ARG 392 Ca -0.25 -0.05 -0.05 0.00 -1.11 0.00 0.00 59.98 58.52 1xcx h ARG 392 Cb 1.70 -0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 31.45 1xcx h ARG 392 CO 0.08 0.59 -0.23 -0.91 -3.11 0.00 0.00 179.97 176.39 1xcx h ASN 393 N 0.92 0.00 1.50 -3.80 2.35 -1.05 -2.24 115.58 113.25 1xcx h ASN 393 Ca 0.25 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.91 1xcx h ASN 393 Cb -0.09 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 1xcx h ASN 393 CO -0.06 0.23 -0.51 0.24 -1.65 0.00 0.00 177.43 175.68 1xcx h MET 394 N 0.00 0.00 -0.56 0.81 2.86 -1.35 -1.25 114.93 115.44 1xcx h MET 394 Ca -0.00 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.54 1xcx h MET 394 Cb 0.53 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 1xcx h MET 394 CO 0.03 0.39 -0.06 0.28 1.06 0.00 0.00 176.91 178.61 1xcx h VAL 395 N 0.00 1.26 -0.35 -2.22 2.07 -0.70 -1.81 116.25 114.50 1xcx h VAL 395 Ca -0.02 -1.20 -0.17 0.00 0.82 0.00 0.00 66.70 66.14 1xcx h VAL 395 Cb 1.33 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1xcx h VAL 395 CO 0.05 0.43 -0.44 0.40 0.02 0.00 0.00 177.57 178.03 1xcx h ILE 396 N 0.91 1.27 -0.63 4.57 2.04 -1.36 -2.90 117.51 121.41 1xcx h ILE 396 Ca 0.15 -1.62 0.09 0.00 1.00 0.00 0.00 64.86 64.49 1xcx h ILE 396 Cb 0.60 1.46 -0.07 0.00 -0.74 0.00 0.00 36.82 38.08 1xcx h ILE 396 CO 0.04 0.54 0.26 0.15 0.00 0.00 0.00 178.15 179.13 1xcx h PHE 397 N 0.73 0.45 -0.66 1.37 3.04 -0.93 0.07 116.94 121.02 1xcx h PHE 397 Ca 0.05 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.99 1xcx h PHE 397 Cb 1.04 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 39.41 1xcx h PHE 397 CO 0.07 0.13 0.28 -0.09 -2.02 0.00 0.00 178.31 176.68 1xcx h ARG 398 N 0.45 0.96 -0.11 1.11 2.43 -1.22 -1.18 114.38 116.83 1xcx h ARG 398 Ca 0.32 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1xcx h ARG 398 Cb 0.37 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1xcx h ARG 398 CO -0.29 0.77 0.03 -0.91 -1.51 0.00 0.00 179.97 178.06 1xcx h ASN 399 N 0.95 0.16 -0.94 -3.80 2.35 -1.00 -1.80 115.58 111.50 1xcx h ASN 399 Ca 0.23 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1xcx h ASN 399 Cb 0.15 -0.04 -0.05 0.00 0.05 0.00 0.00 38.32 38.44 1xcx h ASN 399 CO -0.02 0.33 0.61 0.58 -1.65 0.00 0.00 177.43 177.27 1xcx h VAL 400 N -0.01 1.25 -0.39 2.81 2.07 -0.64 -2.87 116.25 118.46 1xcx h VAL 400 Ca 0.04 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1xcx h VAL 400 Cb 0.23 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 1xcx h VAL 400 CO -0.00 0.24 0.00 1.33 0.02 0.00 0.00 177.57 179.16 1xcx n VAL 401 N -4.41 0.52 -1.65 2.57 0.24 -0.48 -4.98 118.33 110.14 1xcx n VAL 401 Ca 0.11 -0.62 -0.49 0.00 -2.04 0.00 0.00 64.34 61.29 1xcx n VAL 401 Cb 0.02 0.54 -0.05 0.00 -1.47 0.00 0.00 33.84 32.89 1xcx n VAL 401 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1xcx n ASP 402 N 0.99 2.59 0.00 -1.34 2.03 -0.68 -1.18 116.55 118.96 1xcx n ASP 402 Ca 0.18 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.57 1xcx n ASP 402 Cb 0.46 -1.32 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 1xcx n ASP 402 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xcx n GLY 403 N 3.26 3.26 3.77 0.27 0.00 -1.26 -5.04 105.19 109.44 1xcx n GLY 403 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1xcx n GLY 403 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xcx s GLN 404 N -0.56 4.10 0.62 1.61 -1.52 -0.32 -5.02 119.66 118.56 1xcx s GLN 404 Ca 0.00 1.82 -0.14 0.00 -1.95 0.00 0.00 55.36 55.09 1xcx s GLN 404 Cb 0.00 -2.70 -0.03 0.00 -0.22 0.00 0.00 33.01 30.06 1xcx s GLN 404 CO 0.00 -0.27 1.04 -1.25 -0.25 0.00 0.00 175.29 174.56 1xcx s PRO 405 N -2.26 3.33 -0.24 2.91 0.04 -1.26 -4.62 135.00 132.90 1xcx s PRO 405 Ca 0.56 1.02 -0.29 0.00 0.04 0.00 0.00 61.00 62.34 1xcx s PRO 405 Cb -0.30 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1xcx s PRO 405 CO 0.38 -0.79 1.13 0.12 0.04 0.00 0.00 177.00 177.88 1xcx s PHE 406 N -2.77 3.11 0.33 0.56 5.36 -1.26 -0.48 117.98 122.82 1xcx s PHE 406 Ca 0.60 1.23 -0.01 0.00 -0.96 0.00 0.00 56.93 57.79 1xcx s PHE 406 Cb -0.14 -3.49 0.01 0.00 -0.34 0.00 0.00 43.02 39.06 1xcx s PHE 406 CO 0.44 -0.97 0.44 0.25 -1.46 0.00 0.00 175.22 173.92 1xcx n THR 407 N 5.55 0.00 -4.16 0.12 -2.24 -0.29 -4.93 114.28 108.32 1xcx n THR 407 Ca 0.13 -1.70 -0.32 0.00 -2.27 0.00 0.00 64.05 59.89 1xcx n THR 407 Cb 0.46 1.03 -0.04 0.00 -2.10 0.00 0.00 70.33 69.68 1xcx n THR 407 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1xcx n ASN 408 N -1.67 -1.52 -4.77 3.42 3.02 -1.26 -0.28 115.26 112.20 1xcx n ASN 408 Ca 0.01 -1.06 -0.38 0.00 -0.03 0.00 0.00 54.58 53.11 1xcx n ASN 408 Cb 0.55 -2.63 -0.02 0.00 -0.61 0.00 0.00 39.78 37.07 1xcx n ASN 408 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1xcx s TRP 409 N -3.69 3.03 -0.06 3.10 -0.11 -1.26 -4.12 118.94 115.84 1xcx s TRP 409 Ca 0.37 1.53 -0.09 0.00 1.22 0.00 0.00 56.10 59.13 1xcx s TRP 409 Cb -0.21 -3.44 0.02 0.00 -1.50 0.00 0.00 33.47 28.34 1xcx s TRP 409 CO 0.93 -1.44 0.23 -0.47 -4.62 0.00 0.00 176.95 171.58 1xcx s TYR 410 N -1.38 -0.19 0.02 5.86 5.04 0.68 -4.96 117.35 122.42 1xcx s TYR 410 Ca 0.57 0.43 -0.22 0.00 -2.44 0.00 0.00 57.07 55.41 1xcx s TYR 410 Cb -0.32 0.06 0.05 0.00 0.35 0.00 0.00 41.96 42.10 1xcx s TYR 410 CO 0.40 -0.20 0.50 0.16 -1.34 0.00 0.00 175.55 175.07 1xcx s ASP 411 N -0.39 -0.41 -0.22 4.32 1.47 -1.26 -0.34 116.67 119.84 1xcx s ASP 411 Ca -0.05 0.23 0.14 0.00 1.18 0.00 0.00 52.55 54.05 1xcx s ASP 411 Cb -0.03 0.46 0.79 0.00 -0.34 0.00 0.00 42.92 43.79 1xcx s ASP 411 CO 0.01 -0.64 1.70 -0.46 0.68 0.00 0.00 175.17 176.46 1xcx n ASN 412 N 0.66 5.51 0.00 2.11 6.94 -0.47 -4.87 115.26 125.13 1xcx n ASN 412 Ca -0.19 -2.86 0.00 0.00 -0.02 0.00 0.00 54.58 51.51 1xcx n ASN 412 Cb 0.59 -0.67 0.00 0.00 -2.36 0.00 0.00 39.78 37.34 1xcx n ASN 412 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1xcx n GLY 413 N 0.65 0.69 0.00 4.83 0.00 -1.26 -4.85 105.19 105.25 1xcx n GLY 413 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1xcx n GLY 413 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1xcx n SER 414 N -0.05 0.00 -0.28 1.61 2.88 -1.26 -4.89 113.62 111.63 1xcx n SER 414 Ca 0.00 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.61 1xcx n SER 414 Cb 0.02 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 63.60 1xcx n SER 414 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1xcx n ASN 415 N 0.00 1.73 -4.14 -3.46 4.13 -1.26 -2.16 115.26 110.09 1xcx n ASN 415 Ca 0.00 -2.91 -0.34 0.00 1.68 0.00 0.00 54.58 53.01 1xcx n ASN 415 Cb 0.00 -0.39 -0.14 0.00 -1.54 0.00 0.00 39.78 37.71 1xcx n ASN 415 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1xcx s GLN 416 N -2.20 2.35 0.19 3.52 -0.21 -1.26 -0.74 119.66 121.31 1xcx s GLN 416 Ca 0.26 -1.31 0.03 0.00 0.02 0.00 0.00 55.36 54.36 1xcx s GLN 416 Cb 0.24 -3.10 -0.05 0.00 1.00 0.00 0.00 33.01 31.10 1xcx s GLN 416 CO 0.00 -0.62 -0.03 0.14 -2.12 0.00 0.00 175.29 172.67 1xcx s VAL 417 N 1.20 0.93 0.10 1.09 -7.23 -0.82 -1.37 120.40 114.30 1xcx s VAL 417 Ca -0.06 -2.02 -0.24 0.00 -1.81 0.00 0.00 61.98 57.85 1xcx s VAL 417 Cb -0.20 -2.13 0.07 0.00 0.56 0.00 0.00 36.38 34.68 1xcx s VAL 417 CO -0.02 -0.49 0.60 0.00 -0.31 0.00 0.00 175.10 174.87 1xcx s ALA 418 N -3.49 -1.57 -0.02 1.32 0.00 0.54 -0.14 121.76 118.40 1xcx s ALA 418 Ca 0.24 0.64 -0.29 0.00 0.00 0.00 0.00 51.96 52.54 1xcx s ALA 418 Cb 0.05 0.65 0.10 0.00 0.00 0.00 0.00 23.12 23.93 1xcx s ALA 418 CO 0.05 -0.66 0.94 -0.59 0.00 0.00 0.00 175.76 175.50 1xcx s PHE 419 N -3.11 -0.30 0.37 0.00 -0.12 -0.83 -0.23 117.98 113.77 1xcx s PHE 419 Ca -0.02 0.16 0.06 0.00 -0.05 0.00 0.00 56.93 57.08 1xcx s PHE 419 Cb -0.01 0.54 -0.07 0.00 -0.63 0.00 0.00 43.02 42.85 1xcx s PHE 419 CO -0.07 -0.52 0.02 0.20 -0.05 0.00 0.00 175.22 174.80 1xcx s GLY 420 N -2.49 2.32 -0.38 1.99 0.00 0.61 -1.42 107.32 107.95 1xcx s GLY 420 Ca 0.06 -2.20 0.04 0.00 0.00 0.00 0.00 44.72 42.62 1xcx s GLY 420 CO -0.08 -1.99 0.10 0.50 0.00 0.00 0.00 173.10 171.64 1xcx s ARG 421 N -3.77 1.57 4.71 2.90 1.81 -0.12 -1.14 118.95 124.91 1xcx s ARG 421 Ca 0.35 -2.03 0.00 0.00 -1.72 0.00 0.00 55.73 52.34 1xcx s ARG 421 Cb 0.09 -3.20 0.00 0.00 -0.45 0.00 0.00 34.95 31.39 1xcx s ARG 421 CO 0.17 -0.98 0.00 0.41 -0.68 0.00 0.00 175.30 174.22 1xcx n GLY 422 N 4.01 2.76 1.01 -3.53 0.00 0.37 -1.87 105.19 107.94 1xcx n GLY 422 Ca 0.04 -0.25 -0.00 0.00 0.00 0.00 0.00 46.02 45.81 1xcx n GLY 422 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xcx n ASN 423 N 1.34 2.74 -0.00 1.61 6.94 -1.26 -4.55 115.26 122.07 1xcx n ASN 423 Ca 0.00 -3.58 0.04 0.00 -0.02 0.00 0.00 54.58 51.03 1xcx n ASN 423 Cb 0.00 -0.60 -0.06 0.00 -2.36 0.00 0.00 39.78 36.76 1xcx n ASN 423 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1xcx n ARG 424 N -1.01 1.83 -3.48 -3.83 5.12 -0.78 -4.61 116.66 109.89 1xcx n ARG 424 Ca 0.29 -0.05 -0.10 0.00 -1.93 0.00 0.00 57.85 56.06 1xcx n ARG 424 Cb 0.97 -1.09 -0.02 0.00 -1.16 0.00 0.00 32.46 31.16 1xcx n ARG 424 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1xcx s GLY 425 N -2.53 -0.50 -0.13 -0.13 0.00 -1.13 -0.18 107.32 102.72 1xcx s GLY 425 Ca -0.01 0.95 -0.14 0.00 0.00 0.00 0.00 44.72 45.52 1xcx s GLY 425 CO 0.36 0.37 0.39 -0.12 0.00 0.00 0.00 173.10 174.10 1xcx s PHE 426 N -3.05 -0.41 0.00 1.90 5.36 -0.16 -0.95 117.98 120.67 1xcx s PHE 426 Ca 0.02 0.97 0.01 0.00 -0.96 0.00 0.00 56.93 56.97 1xcx s PHE 426 Cb -0.01 0.15 -0.01 0.00 -0.34 0.00 0.00 43.02 42.81 1xcx s PHE 426 CO -0.08 -0.23 -0.03 -1.50 -1.46 0.00 0.00 175.22 171.91 1xcx s ILE 427 N 0.01 0.25 -0.04 3.12 2.07 -0.51 -1.51 121.20 124.60 1xcx s ILE 427 Ca -0.02 -0.28 0.04 0.00 -1.41 0.00 0.00 60.65 58.98 1xcx s ILE 427 Cb -0.03 -0.25 -0.00 0.00 0.13 0.00 0.00 42.46 42.31 1xcx s ILE 427 CO 0.01 -0.02 -0.15 -0.69 -1.91 0.00 0.00 174.94 172.18 1xcx s VAL 428 N -0.30 1.26 -0.02 4.00 1.01 0.22 -1.96 120.40 124.60 1xcx s VAL 428 Ca -0.01 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.40 1xcx s VAL 428 Cb -0.03 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 1xcx s VAL 428 CO -0.00 0.37 -0.20 -0.36 0.00 0.00 0.00 175.10 174.91 1xcx s PHE 429 N 0.03 1.81 -0.31 5.22 0.40 0.80 -1.35 117.98 124.57 1xcx s PHE 429 Ca -0.02 -0.37 0.00 0.00 -0.60 0.00 0.00 56.93 55.94 1xcx s PHE 429 Cb -0.10 -1.17 0.10 0.00 0.51 0.00 0.00 43.02 42.35 1xcx s PHE 429 CO 0.01 -0.05 0.08 1.21 0.70 0.00 0.00 175.22 177.17 1xcx s ASN 430 N -0.40 4.17 -0.18 1.36 2.47 -0.36 -1.94 114.94 120.06 1xcx s ASN 430 Ca 0.06 -1.72 0.16 0.00 0.42 0.00 0.00 52.86 51.78 1xcx s ASN 430 Cb -0.08 -1.06 0.41 0.00 -1.45 0.00 0.00 41.25 39.07 1xcx s ASN 430 CO -0.00 -0.39 1.29 -3.20 -3.72 0.00 0.00 177.10 171.07 1xcx n ASN 431 N 4.70 2.79 -4.97 -4.21 5.15 0.09 -4.77 115.26 114.03 1xcx n ASN 431 Ca -0.01 -3.25 -0.21 0.00 -0.60 0.00 0.00 54.58 50.50 1xcx n ASN 431 Cb 0.42 -0.51 0.01 0.00 -0.53 0.00 0.00 39.78 39.17 1xcx n ASN 431 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1xcx s ASP 432 N -2.58 5.85 -0.09 1.20 1.01 -1.25 -4.82 116.67 115.99 1xcx s ASP 432 Ca 0.38 0.11 0.02 0.00 0.71 0.00 0.00 52.55 53.76 1xcx s ASP 432 Cb 0.33 -1.40 0.19 0.00 1.01 0.00 0.00 42.92 43.05 1xcx s ASP 432 CO 0.03 -0.63 1.04 0.47 0.21 0.00 0.00 175.17 176.29 1xcx n ASP 433 N -1.94 2.73 -4.00 0.27 8.00 -1.26 -4.76 116.55 115.60 1xcx n ASP 433 Ca 0.01 -2.33 -0.10 0.00 0.71 0.00 0.00 54.79 53.09 1xcx n ASP 433 Cb 0.58 -0.57 -0.08 0.00 -0.02 0.00 0.00 41.12 41.04 1xcx n ASP 433 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1xcx s TRP 434 N -1.11 0.49 0.64 1.24 -2.14 -1.26 -4.97 118.94 111.82 1xcx s TRP 434 Ca 0.14 -0.85 -0.16 0.00 2.66 0.00 0.00 56.10 57.89 1xcx s TRP 434 Cb 0.11 -0.14 -0.01 0.00 -3.10 0.00 0.00 33.47 30.33 1xcx s TRP 434 CO 0.03 -0.68 1.11 -1.12 -2.66 0.00 0.00 176.95 173.64 1xcx s SER 435 N -2.98 5.25 -0.18 -2.66 0.01 -1.26 -4.24 113.70 107.63 1xcx s SER 435 Ca 0.18 2.01 -0.00 0.00 1.31 0.00 0.00 55.95 59.45 1xcx s SER 435 Cb 0.04 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.72 1xcx s SER 435 CO 0.00 -1.53 -0.15 0.12 0.41 0.00 0.00 173.24 172.09 1xcx s PHE 436 N -2.27 2.82 -0.29 2.43 5.36 0.36 -4.97 117.98 121.43 1xcx s PHE 436 Ca 0.68 -1.31 -0.01 0.00 -0.96 0.00 0.00 56.93 55.33 1xcx s PHE 436 Cb -0.21 -1.95 0.13 0.00 -0.34 0.00 0.00 43.02 40.66 1xcx s PHE 436 CO 0.39 -0.65 0.28 0.45 -1.46 0.00 0.00 175.22 174.23 1xcx s SER 437 N 1.19 1.78 0.05 6.13 0.15 -1.25 0.59 113.70 122.34 1xcx s SER 437 Ca 0.02 -0.78 -0.19 0.00 0.70 0.00 0.00 55.95 55.70 1xcx s SER 437 Cb -0.14 0.46 0.04 0.00 -1.71 0.00 0.00 66.02 64.67 1xcx s SER 437 CO -0.07 -0.39 0.45 -0.22 1.20 0.00 0.00 173.24 174.21 1xcx s LEU 438 N 2.35 0.25 -0.20 3.45 2.96 -0.60 -5.00 118.68 121.89 1xcx s LEU 438 Ca 0.09 0.05 -0.13 0.00 -0.22 0.00 0.00 54.13 53.92 1xcx s LEU 438 Cb -0.14 1.86 -0.05 0.00 0.50 0.00 0.00 46.19 48.37 1xcx s LEU 438 CO -0.33 -0.69 0.25 -0.89 -1.32 0.00 0.00 176.35 173.37 1xcx s THR 439 N -2.50 5.31 0.19 3.68 2.01 -1.26 -0.92 115.64 122.16 1xcx s THR 439 Ca -0.05 0.41 0.08 0.00 0.31 0.00 0.00 61.69 62.44 1xcx s THR 439 Cb -0.01 -3.59 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 1xcx s THR 439 CO -0.02 0.35 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.33 1xcx s LEU 440 N 0.87 2.51 -0.14 4.42 1.02 -0.27 -4.92 118.68 122.18 1xcx s LEU 440 Ca 0.13 -0.96 -0.26 0.00 0.02 0.00 0.00 54.13 53.06 1xcx s LEU 440 Cb -0.13 -0.74 -0.02 0.00 0.02 0.00 0.00 46.19 45.32 1xcx s LEU 440 CO 0.04 -0.11 0.86 -1.58 0.02 0.00 0.00 176.35 175.58 1xcx s GLN 441 N -3.32 4.34 -0.08 1.70 2.00 -1.26 -1.48 119.66 121.56 1xcx s GLN 441 Ca 0.20 1.09 0.18 0.00 -2.00 0.00 0.00 55.36 54.84 1xcx s GLN 441 Cb -0.03 -3.55 -0.28 0.00 0.80 0.00 0.00 33.01 29.95 1xcx s GLN 441 CO 0.07 -0.29 0.30 0.25 -0.50 0.00 0.00 175.29 175.13 1xcx n THR 442 N 4.60 0.42 -1.00 -0.34 -2.24 -0.17 -4.93 114.28 110.63 1xcx n THR 442 Ca 0.05 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1xcx n THR 442 Cb 0.49 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 1xcx n THR 442 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xcx n GLY 443 N 1.56 0.66 3.92 3.38 0.00 -1.25 -4.77 105.19 108.69 1xcx n GLY 443 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 1xcx n GLY 443 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xcx s LEU 444 N 0.00 4.30 0.45 0.99 1.02 -1.26 -4.25 118.68 119.93 1xcx s LEU 444 Ca 0.00 0.39 -0.23 0.00 0.02 0.00 0.00 54.13 54.31 1xcx s LEU 444 Cb 0.00 -3.11 -0.08 0.00 0.02 0.00 0.00 46.19 43.02 1xcx s LEU 444 CO 0.00 0.07 1.17 -2.16 0.02 0.00 0.00 176.35 175.44 1xcx s PRO 445 N -2.84 3.81 0.51 1.29 0.04 -1.26 -4.35 135.00 132.19 1xcx s PRO 445 Ca 0.38 1.78 -0.20 0.00 0.04 0.00 0.00 61.00 63.00 1xcx s PRO 445 Cb -0.12 -2.45 -0.11 0.00 0.04 0.00 0.00 34.50 31.87 1xcx s PRO 445 CO 0.27 -0.51 0.51 0.00 0.04 0.00 0.00 177.00 177.31 1xcx n ALA 446 N -0.40 -1.32 0.00 8.56 0.00 -1.26 -4.87 120.51 121.22 1xcx n ALA 446 Ca 0.07 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1xcx n ALA 446 Cb 0.48 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 18.13 1xcx n ALA 446 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcx n GLY 447 N 1.80 -1.00 3.42 0.00 0.00 -0.51 -4.96 105.19 103.94 1xcx n GLY 447 Ca 0.11 -1.62 -0.36 0.00 0.00 0.00 0.00 46.02 44.15 1xcx n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xcx s THR 448 N -1.57 4.12 -0.01 2.61 2.01 -1.26 -0.69 115.64 120.85 1xcx s THR 448 Ca 0.00 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.80 1xcx s THR 448 Cb 0.00 -2.92 -0.03 0.00 0.01 0.00 0.00 72.50 69.56 1xcx s THR 448 CO 0.00 0.36 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.88 1xcx s TYR 449 N 1.58 2.82 0.04 4.92 1.51 0.55 -0.26 117.35 128.50 1xcx s TYR 449 Ca 0.06 -0.08 -0.24 0.00 -1.01 0.00 0.00 57.07 55.80 1xcx s TYR 449 Cb -0.15 -1.61 -0.05 0.00 -0.11 0.00 0.00 41.96 40.04 1xcx s TYR 449 CO 0.02 0.32 0.73 0.00 -1.11 0.00 0.00 175.55 175.51 1xcx s ASP 451 N -0.11 7.02 0.00 0.00 2.15 0.48 -4.60 116.67 121.61 1xcx s ASP 451 Ca 0.37 1.57 0.31 0.00 0.43 0.00 0.00 52.55 55.23 1xcx s ASP 451 Cb -0.20 -2.54 1.64 0.00 -0.30 0.00 0.00 42.92 41.52 1xcx s ASP 451 CO 0.22 -0.71 2.08 1.33 -0.17 0.00 0.00 175.17 177.92 1xcx n VAL 452 N 5.30 0.00 -0.07 1.11 0.24 -0.24 -2.48 118.33 122.19 1xcx n VAL 452 Ca 0.13 -0.06 -0.22 0.00 -2.04 0.00 0.00 64.34 62.15 1xcx n VAL 452 Cb 0.45 -0.25 -0.12 0.00 -1.47 0.00 0.00 33.84 32.45 1xcx n VAL 452 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1xcx n ILE 453 N -0.76 1.61 0.13 1.34 2.08 -1.26 -4.36 119.36 118.14 1xcx n ILE 453 Ca 0.22 -0.23 0.01 0.00 0.56 0.00 0.00 62.75 63.31 1xcx n ILE 453 Cb 0.18 -1.94 0.00 0.00 -0.75 0.00 0.00 39.64 37.14 1xcx n ILE 453 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 1xcx h SER 454 N -0.67 0.00 0.00 4.38 4.64 -1.87 -3.40 113.55 116.63 1xcx h SER 454 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1xcx h SER 454 Cb 1.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.63 1xcx h SER 454 CO -0.13 0.56 0.00 0.61 -0.87 0.00 0.00 176.83 177.00 1xcx n GLY 455 N 1.25 3.91 3.19 -0.77 0.00 -1.03 -4.51 105.19 107.23 1xcx n GLY 455 Ca 0.01 -0.85 -0.12 0.00 0.00 0.00 0.00 46.02 45.07 1xcx n GLY 455 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xcx s ASP 456 N 1.66 0.82 -0.52 1.61 1.01 -1.26 -4.33 116.67 115.66 1xcx s ASP 456 Ca 0.00 -1.17 -0.17 0.00 0.71 0.00 0.00 52.55 51.92 1xcx s ASP 456 Cb 0.00 0.19 0.08 0.00 1.01 0.00 0.00 42.92 44.20 1xcx s ASP 456 CO 0.00 -0.63 0.54 -0.75 0.21 0.00 0.00 175.17 174.54 1xcx s LYS 457 N -3.96 3.04 -1.01 8.23 2.36 -1.26 -1.39 119.74 125.74 1xcx s LYS 457 Ca 0.22 -1.25 -0.05 0.00 -2.55 0.00 0.00 55.97 52.34 1xcx s LYS 457 Cb 0.07 -4.17 0.26 0.00 -1.05 0.00 0.00 37.83 32.93 1xcx s LYS 457 CO 0.02 -1.23 1.00 -0.89 1.55 0.00 0.00 175.35 175.80 1xcx n ILE 458 N 5.41 3.93 -1.62 5.43 5.41 0.88 -4.93 119.36 133.86 1xcx n ILE 458 Ca -0.10 -5.32 0.00 0.00 1.00 0.00 0.00 62.75 58.33 1xcx n ILE 458 Cb 0.43 -2.44 0.00 0.00 -0.71 0.00 0.00 39.64 36.92 1xcx n ILE 458 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1xcx n ASN 459 N 2.33 -3.78 0.00 4.38 6.94 -1.26 -2.88 115.26 120.99 1xcx n ASN 459 Ca 0.23 0.43 0.00 0.00 -0.02 0.00 0.00 54.58 55.23 1xcx n ASN 459 Cb 0.38 -0.78 0.00 0.00 -2.36 0.00 0.00 39.78 37.01 1xcx n ASN 459 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1xcx n GLY 460 N 1.61 3.07 3.09 4.83 0.00 -1.26 -5.00 105.19 111.52 1xcx n GLY 460 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1xcx n GLY 460 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xcx s ASN 461 N -0.36 0.53 -0.04 1.61 0.01 -1.14 -5.05 114.94 110.50 1xcx s ASN 461 Ca 0.00 -0.96 0.00 0.00 -0.71 0.00 0.00 52.86 51.19 1xcx s ASN 461 Cb 0.00 0.18 -0.03 0.00 0.41 0.00 0.00 41.25 41.81 1xcx s ASN 461 CO 0.00 -0.57 -0.01 0.00 -1.51 0.00 0.00 177.10 175.02 1xcx n THR 463 N 1.80 0.14 -0.82 0.00 -2.24 -0.49 -4.95 114.28 107.73 1xcx n THR 463 Ca -0.17 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1xcx n THR 463 Cb 0.53 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1xcx n THR 463 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xcx n GLY 464 N 1.42 5.27 3.77 3.38 0.00 -1.26 -4.81 105.19 112.96 1xcx n GLY 464 Ca 0.04 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.15 1xcx n GLY 464 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xcx s ILE 465 N 2.75 2.37 -0.06 -0.61 1.01 -1.26 -4.86 121.20 120.55 1xcx s ILE 465 Ca 0.00 0.37 0.03 0.00 0.00 0.00 0.00 60.65 61.05 1xcx s ILE 465 Cb 0.00 -3.23 -0.02 0.00 0.01 0.00 0.00 42.46 39.22 1xcx s ILE 465 CO 0.00 0.08 -0.15 -0.54 0.00 0.00 0.00 174.94 174.33 1xcx s LYS 466 N -2.04 2.61 -0.04 2.79 1.02 -1.26 -0.39 119.74 122.43 1xcx s LYS 466 Ca 0.53 -0.72 0.06 0.00 0.02 0.00 0.00 55.97 55.85 1xcx s LYS 466 Cb -0.43 -2.38 -0.02 0.00 -0.52 0.00 0.00 37.83 34.48 1xcx s LYS 466 CO 0.57 0.55 -0.20 0.42 -0.92 0.00 0.00 175.35 175.77 1xcx s ILE 467 N -0.54 2.55 -0.25 2.17 -1.09 0.39 -4.96 121.20 119.48 1xcx s ILE 467 Ca 0.07 -0.91 -0.03 0.00 -2.23 0.00 0.00 60.65 57.55 1xcx s ILE 467 Cb -0.11 -1.95 0.02 0.00 -1.58 0.00 0.00 42.46 38.83 1xcx s ILE 467 CO 0.01 0.58 -0.04 -0.31 -1.23 0.00 0.00 174.94 173.95 1xcx s TYR 468 N -0.60 3.05 -0.21 3.97 2.02 -1.26 -0.33 117.35 123.98 1xcx s TYR 468 Ca 0.09 -1.34 -0.11 0.00 -0.37 0.00 0.00 57.07 55.34 1xcx s TYR 468 Cb -0.11 -2.09 -0.05 0.00 -0.40 0.00 0.00 41.96 39.31 1xcx s TYR 468 CO 0.00 -0.67 0.18 0.08 -1.57 0.00 0.00 175.55 173.57 1xcx s VAL 469 N 1.38 5.37 0.85 0.71 1.01 0.13 -4.31 120.40 125.54 1xcx s VAL 469 Ca 0.02 0.27 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 1xcx s VAL 469 Cb -0.16 -3.52 0.15 0.00 0.00 0.00 0.00 36.38 32.85 1xcx s VAL 469 CO -0.03 0.39 1.18 -0.94 0.00 0.00 0.00 175.10 175.70 1xcx s SER 470 N 0.66 3.77 0.55 3.32 1.04 -0.03 -1.43 113.70 121.57 1xcx s SER 470 Ca 0.10 0.16 0.24 0.00 0.48 0.00 0.00 55.95 56.92 1xcx s SER 470 Cb -0.12 -0.40 1.46 0.00 0.10 0.00 0.00 66.02 67.06 1xcx s SER 470 CO 0.02 -2.29 2.09 0.44 0.98 0.00 0.00 173.24 174.47 1xcx h ASP 471 N -1.16 0.00 -0.46 7.02 3.32 -1.95 -1.07 116.42 122.11 1xcx h ASP 471 Ca -0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1xcx h ASP 471 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1xcx h ASP 471 CO 0.43 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.05 1xcx n ASP 472 N -4.21 3.05 0.00 6.45 5.75 -1.26 -4.77 116.55 121.56 1xcx n ASP 472 Ca 0.03 -2.18 0.00 0.00 -0.01 0.00 0.00 54.79 52.63 1xcx n ASP 472 Cb 0.34 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 1xcx n ASP 472 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xcx n GLY 473 N 1.03 1.29 3.83 6.12 0.00 -0.41 -4.88 105.19 112.17 1xcx n GLY 473 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1xcx n GLY 473 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xcx s LYS 474 N -0.15 4.10 -0.14 1.61 1.02 -1.26 -1.00 119.74 123.91 1xcx s LYS 474 Ca 0.00 1.02 -0.20 0.00 0.02 0.00 0.00 55.97 56.81 1xcx s LYS 474 Cb 0.00 -2.17 0.05 0.00 -0.52 0.00 0.00 37.83 35.19 1xcx s LYS 474 CO 0.00 -0.12 0.53 0.00 -0.92 0.00 0.00 175.35 174.83 1xcx s ALA 475 N -2.36 -1.33 -0.01 5.17 0.00 -0.55 -0.85 121.76 121.82 1xcx s ALA 475 Ca 0.60 1.28 -0.17 0.00 0.00 0.00 0.00 51.96 53.67 1xcx s ALA 475 Cb -0.09 -0.54 -0.06 0.00 0.00 0.00 0.00 23.12 22.43 1xcx s ALA 475 CO 0.21 -0.28 0.48 -1.58 0.00 0.00 0.00 175.76 174.59 1xcx s HIS 476 N -0.29 3.69 -0.04 0.00 2.46 -1.26 -1.11 115.29 118.74 1xcx s HIS 476 Ca -0.05 1.06 0.05 0.00 0.47 0.00 0.00 55.06 56.59 1xcx s HIS 476 Cb -0.03 -2.43 -0.00 0.00 -0.13 0.00 0.00 32.58 29.98 1xcx s HIS 476 CO 0.03 0.49 -0.18 -0.06 -2.47 0.00 0.00 174.74 172.55 1xcx s PHE 477 N -0.58 1.79 -0.18 3.88 0.40 -0.09 -4.78 117.98 118.41 1xcx s PHE 477 Ca 0.26 -0.50 -0.01 0.00 -0.60 0.00 0.00 56.93 56.07 1xcx s PHE 477 Cb -0.17 -1.20 0.05 0.00 0.51 0.00 0.00 43.02 42.21 1xcx s PHE 477 CO 0.14 -0.16 -0.01 0.45 0.70 0.00 0.00 175.22 176.34 1xcx s SER 478 N -0.02 2.92 -0.16 1.36 0.15 -1.26 -1.55 113.70 115.14 1xcx s SER 478 Ca -0.03 -0.76 -0.01 0.00 0.70 0.00 0.00 55.95 55.85 1xcx s SER 478 Cb -0.11 -0.78 0.04 0.00 -1.71 0.00 0.00 66.02 63.46 1xcx s SER 478 CO 0.02 -0.24 -0.04 -0.63 1.20 0.00 0.00 173.24 173.54 1xcx s ILE 479 N 1.72 1.03 0.34 6.45 1.01 0.20 -4.99 121.20 126.96 1xcx s ILE 479 Ca -0.01 -0.58 -0.26 0.00 0.00 0.00 0.00 60.65 59.81 1xcx s ILE 479 Cb -0.16 -1.22 -0.10 0.00 0.01 0.00 0.00 42.46 40.99 1xcx s ILE 479 CO -0.07 0.11 0.97 -0.55 0.00 0.00 0.00 174.94 175.41 1xcx s SER 480 N 1.67 7.19 0.00 3.58 0.15 -1.26 -0.49 113.70 124.54 1xcx s SER 480 Ca 0.01 1.89 0.16 0.00 0.70 0.00 0.00 55.95 58.71 1xcx s SER 480 Cb -0.15 -2.58 0.96 0.00 -1.71 0.00 0.00 66.02 62.54 1xcx s SER 480 CO -0.08 -0.18 1.38 -0.46 1.20 0.00 0.00 173.24 175.11 1xcx n ASN 481 N 0.39 0.00 -0.77 5.45 6.94 -1.26 -1.63 115.26 124.38 1xcx n ASN 481 Ca 0.03 -0.48 0.09 0.00 -0.02 0.00 0.00 54.58 54.20 1xcx n ASN 481 Cb 0.50 -0.01 0.10 0.00 -2.36 0.00 0.00 39.78 38.00 1xcx n ASN 481 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1xcx n SER 482 N -1.01 2.64 -4.75 0.53 7.64 -1.26 -5.00 113.62 112.40 1xcx n SER 482 Ca 0.12 -1.79 -0.37 0.00 1.01 0.00 0.00 58.87 57.84 1xcx n SER 482 Cb 0.06 -0.04 0.03 0.00 -1.01 0.00 0.00 64.21 63.25 1xcx n SER 482 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xcx s ALA 483 N -1.47 2.72 0.16 -0.43 0.00 -0.65 -4.92 121.76 117.17 1xcx s ALA 483 Ca 0.23 1.15 -0.16 0.00 0.00 0.00 0.00 51.96 53.19 1xcx s ALA 483 Cb 0.16 -3.50 0.06 0.00 0.00 0.00 0.00 23.12 19.84 1xcx s ALA 483 CO 0.23 -1.20 1.78 1.49 0.00 0.00 0.00 175.76 178.06 1xcx h GLU 484 N 1.31 0.40 -4.52 0.00 4.57 -1.94 -3.34 114.58 111.06 1xcx h GLU 484 Ca -0.50 -0.02 -0.65 0.00 -1.18 0.00 0.00 59.36 57.00 1xcx h GLU 484 Cb 1.29 -0.09 -0.40 0.00 -0.16 0.00 0.00 28.75 29.40 1xcx h GLU 484 CO 0.57 0.26 -0.74 -0.51 -1.18 0.00 0.00 179.01 177.42 1xcx s ASP 485 N -5.45 4.58 0.00 1.04 1.01 -1.26 -4.90 116.67 111.68 1xcx s ASP 485 Ca -0.13 -1.96 0.00 0.00 0.71 0.00 0.00 52.55 51.17 1xcx s ASP 485 Cb 0.12 -1.48 0.00 0.00 1.01 0.00 0.00 42.92 42.57 1xcx s ASP 485 CO 0.72 -0.36 0.66 -0.81 0.21 0.00 0.00 175.17 175.59 1xcx n PRO 486 N 4.38 0.41 -3.63 8.23 -0.04 -1.26 -4.75 135.00 138.35 1xcx n PRO 486 Ca 0.01 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.32 1xcx n PRO 486 Cb 0.42 -1.29 -0.06 0.00 -0.04 0.00 0.00 33.50 32.52 1xcx n PRO 486 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1xcx s PHE 487 N 0.95 -0.37 -0.01 0.54 -0.71 -1.26 -1.22 117.98 115.90 1xcx s PHE 487 Ca 0.00 0.48 0.05 0.00 -1.04 0.00 0.00 56.93 56.43 1xcx s PHE 487 Cb 0.00 0.26 -0.01 0.00 -1.21 0.00 0.00 43.02 42.06 1xcx s PHE 487 CO 0.00 -0.56 -0.17 0.42 -1.34 0.00 0.00 175.22 173.57 1xcx s ILE 488 N -1.96 1.34 -0.02 -4.49 1.01 -0.46 -4.80 121.20 111.82 1xcx s ILE 488 Ca -0.08 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.85 1xcx s ILE 488 Cb -0.02 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.36 1xcx s ILE 488 CO 0.02 0.38 -0.01 0.00 0.00 0.00 0.00 174.94 175.33 1xcx s ALA 489 N -0.39 0.33 0.05 9.38 0.00 -1.26 -0.61 121.76 129.26 1xcx s ALA 489 Ca 0.06 0.08 0.04 0.00 0.00 0.00 0.00 51.96 52.14 1xcx s ALA 489 Cb -0.07 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 1xcx s ALA 489 CO -0.01 -0.03 -0.11 0.96 0.00 0.00 0.00 175.76 176.58 1xcx s ILE 490 N 0.73 0.81 0.27 0.00 -4.36 -0.57 -1.08 121.20 117.01 1xcx s ILE 490 Ca -0.08 -1.15 -0.07 0.00 -0.26 0.00 0.00 60.65 59.09 1xcx s ILE 490 Cb -0.11 -0.82 -0.01 0.00 1.25 0.00 0.00 42.46 42.77 1xcx s ILE 490 CO -0.01 -0.28 0.41 -1.38 0.24 0.00 0.00 174.94 173.92 1xcx s HIS 491 N -1.28 0.74 0.38 1.37 -3.43 -1.26 -0.99 115.29 110.81 1xcx s HIS 491 Ca -0.06 -1.03 0.17 0.00 -0.80 0.00 0.00 55.06 53.34 1xcx s HIS 491 Cb -0.10 -0.03 1.07 0.00 -1.43 0.00 0.00 32.58 32.09 1xcx s HIS 491 CO 0.01 -0.98 1.75 0.00 -2.00 0.00 0.00 174.74 173.52 1xcx h ALA 492 N 2.27 2.15 -0.01 -1.38 0.00 -0.88 -0.18 119.26 121.23 1xcx h ALA 492 Ca -0.29 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1xcx h ALA 492 Cb 1.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1xcx h ALA 492 CO 0.40 -0.59 -0.12 0.39 0.00 0.00 0.00 179.25 179.33 1xcx n GLU 493 N -4.71 1.01 -0.19 0.00 -0.58 -1.26 -3.43 120.64 111.48 1xcx n GLU 493 Ca 0.27 -0.48 0.10 0.00 -0.42 0.00 0.00 57.16 56.63 1xcx n GLU 493 Cb 0.88 -1.49 0.20 0.00 -0.57 0.00 0.00 31.44 30.47 1xcx n GLU 493 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1xcx n SER 494 N -0.58 3.32 -4.77 1.62 3.41 -0.09 -4.96 113.62 111.57 1xcx n SER 494 Ca 0.16 -1.94 -0.38 0.00 -0.26 0.00 0.00 58.87 56.44 1xcx n SER 494 Cb 0.30 -0.26 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 1xcx n SER 494 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1xcx s LYS 495 N -1.29 4.19 0.00 4.33 2.20 -1.19 -1.03 119.74 126.96 1xcx s LYS 495 Ca 0.35 1.70 0.30 0.00 -0.36 0.00 0.00 55.97 57.96 1xcx s LYS 495 Cb 0.20 -2.71 1.40 0.00 -1.51 0.00 0.00 37.83 35.22 1xcx s LYS 495 CO 0.28 -0.16 1.94 1.28 -0.36 0.00 0.00 175.35 178.33