#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hey s PRO 58 N 0.00 1.37 0.93 -0.67 0.02 -1.26 -5.01 135.00 130.38 2hey s PRO 58 Ca 0.00 1.14 -0.12 0.00 0.02 0.00 0.00 61.00 62.03 2hey s PRO 58 Cb 0.00 -1.80 0.15 0.00 0.02 0.00 0.00 34.50 32.87 2hey s PRO 58 CO 0.00 -2.25 1.12 -1.25 -0.33 0.00 0.00 177.00 174.29 2hey s PRO 59 N -4.81 0.98 0.22 5.54 0.04 -1.26 -4.95 135.00 130.76 2hey s PRO 59 Ca 0.64 0.38 -0.32 0.00 0.04 0.00 0.00 61.00 61.74 2hey s PRO 59 Cb -0.19 -1.81 -0.13 0.00 0.04 0.00 0.00 34.50 32.41 2hey s PRO 59 CO 0.58 -2.33 1.59 -0.89 0.04 0.00 0.00 177.00 175.99 2hey n ILE 60 N -3.87 0.44 -2.73 0.56 5.41 -1.26 -4.91 119.36 112.99 2hey n ILE 60 Ca 0.06 -0.11 -0.42 0.00 1.00 0.00 0.00 62.75 63.28 2hey n ILE 60 Cb 0.58 -1.75 -0.03 0.00 -0.71 0.00 0.00 39.64 37.73 2hey n ILE 60 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2hey s GLN 61 N 0.38 4.37 -0.05 0.38 -1.52 -1.26 -4.79 119.66 117.16 2hey s GLN 61 Ca 0.72 1.30 -0.20 0.00 -1.95 0.00 0.00 55.36 55.23 2hey s GLN 61 Cb -0.58 -3.57 0.04 0.00 -0.22 0.00 0.00 33.01 28.69 2hey s GLN 61 CO 0.41 -0.37 0.45 -0.98 -0.25 0.00 0.00 175.29 174.55 2hey s ARG 62 N 2.23 0.76 -0.10 2.91 1.70 -1.26 -0.85 118.95 124.35 2hey s ARG 62 Ca 0.45 0.09 -0.06 0.00 -0.47 0.00 0.00 55.73 55.73 2hey s ARG 62 Cb -0.17 0.35 0.04 0.00 -0.57 0.00 0.00 34.95 34.59 2hey s ARG 62 CO 0.15 -0.21 0.24 -1.17 -1.08 0.00 0.00 175.30 173.23 2hey s LEU 63 N -1.01 0.69 -0.07 -1.89 0.20 -0.26 -1.21 118.68 115.13 2hey s LEU 63 Ca -0.10 0.51 0.05 0.00 0.69 0.00 0.00 54.13 55.27 2hey s LEU 63 Cb -0.03 0.77 -0.00 0.00 -0.43 0.00 0.00 46.19 46.49 2hey s LEU 63 CO 0.05 -0.13 -0.22 -0.60 -0.29 0.00 0.00 176.35 175.16 2hey s ARG 64 N 0.79 2.47 0.03 1.98 3.52 -1.26 -1.45 118.95 125.03 2hey s ARG 64 Ca -0.05 -0.80 0.01 0.00 -0.13 0.00 0.00 55.73 54.76 2hey s ARG 64 Cb -0.07 -2.02 -0.02 0.00 -1.56 0.00 0.00 34.95 31.28 2hey s ARG 64 CO -0.05 0.27 -0.06 0.20 -0.81 0.00 0.00 175.30 174.85 2hey s GLY 65 N 0.09 0.38 0.37 8.12 0.00 -0.16 -2.87 107.32 113.24 2hey s GLY 65 Ca -0.09 -0.66 -0.16 0.00 0.00 0.00 0.00 44.72 43.81 2hey s GLY 65 CO 0.05 -0.71 0.81 0.00 0.00 0.00 0.00 173.10 173.24 2hey s ALA 66 N -1.33 3.24 -0.23 3.20 0.00 0.13 -0.74 121.76 126.02 2hey s ALA 66 Ca -0.12 0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.97 2hey s ALA 66 Cb -0.09 -2.88 0.06 0.00 0.00 0.00 0.00 23.12 20.21 2hey s ALA 66 CO -0.00 0.23 -0.03 0.08 0.00 0.00 0.00 175.76 176.04 2hey s VAL 67 N -2.09 1.34 0.00 0.00 1.01 -0.12 -1.33 120.40 119.21 2hey s VAL 67 Ca 0.56 -1.12 0.00 0.00 0.00 0.00 0.00 61.98 61.42 2hey s VAL 67 Cb -0.10 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.62 2hey s VAL 67 CO 0.18 -0.15 0.00 0.41 0.00 0.00 0.00 175.10 175.54 2hey n THR 68 N 4.74 0.00 -3.93 3.92 -1.04 -1.26 -3.68 114.28 113.03 2hey n THR 68 Ca -0.11 -0.02 -0.09 0.00 -2.04 0.00 0.00 64.05 61.79 2hey n THR 68 Cb 0.44 0.49 -0.02 0.00 -1.82 0.00 0.00 70.33 69.42 2hey n THR 68 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hey s ARG 69 N -1.83 1.85 0.06 -2.82 1.70 -1.26 -2.16 118.95 114.50 2hey s ARG 69 Ca 0.00 -1.32 0.06 0.00 -0.47 0.00 0.00 55.73 54.00 2hey s ARG 69 Cb 0.00 0.54 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 2hey s ARG 69 CO 0.00 -0.82 -0.12 0.00 -1.08 0.00 0.00 175.30 173.28 2hey s GLU 71 N -1.79 0.14 -1.38 0.00 2.12 0.89 -4.65 118.70 114.03 2hey s GLU 71 Ca 0.18 0.68 -0.03 0.00 0.36 0.00 0.00 54.97 56.16 2hey s GLU 71 Cb -0.11 -0.08 0.02 0.00 0.26 0.00 0.00 34.13 34.22 2hey s GLU 71 CO 0.09 -0.26 0.72 -0.25 -0.54 0.00 0.00 175.26 175.02 2hey n ASP 72 N 5.10 -1.84 -0.11 -1.70 8.00 -1.26 -2.00 116.55 122.74 2hey n ASP 72 Ca -0.10 -0.84 -0.01 0.00 0.71 0.00 0.00 54.79 54.54 2hey n ASP 72 Cb 0.50 -3.86 -0.01 0.00 -0.02 0.00 0.00 41.12 37.74 2hey n ASP 72 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2hey n GLY 73 N -1.66 0.47 3.10 0.44 0.00 -1.26 -5.00 105.19 101.28 2hey n GLY 73 Ca -0.22 -0.19 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 2hey n GLY 73 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2hey s GLN 74 N -1.06 0.81 0.25 1.61 -0.21 -0.85 -0.92 119.66 119.30 2hey s GLN 74 Ca 0.00 -0.66 -0.31 0.00 0.02 0.00 0.00 55.36 54.42 2hey s GLN 74 Cb 0.00 -0.77 -0.11 0.00 1.00 0.00 0.00 33.01 33.13 2hey s GLN 74 CO 0.00 0.19 1.59 -0.51 -2.12 0.00 0.00 175.29 174.44 2hey s LEU 75 N -1.01 4.36 -0.19 2.90 1.43 -0.41 -0.08 118.68 125.68 2hey s LEU 75 Ca 0.00 2.85 -0.19 0.00 -1.03 0.00 0.00 54.13 55.75 2hey s LEU 75 Cb -0.07 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 2hey s LEU 75 CO 0.01 -0.88 0.57 0.12 0.23 0.00 0.00 176.35 176.40 2hey s PHE 76 N 0.34 3.38 -0.39 0.29 5.36 -0.40 -4.68 117.98 121.89 2hey s PHE 76 Ca 0.65 0.85 -0.16 0.00 -0.96 0.00 0.00 56.93 57.32 2hey s PHE 76 Cb -0.47 -2.72 0.01 0.00 -0.34 0.00 0.00 43.02 39.50 2hey s PHE 76 CO 0.42 -0.11 0.37 0.42 -1.46 0.00 0.00 175.22 174.86 2hey s ILE 77 N 1.68 5.17 -0.42 3.12 1.01 -1.26 -4.24 121.20 126.25 2hey s ILE 77 Ca 0.26 -0.30 -0.14 0.00 0.00 0.00 0.00 60.65 60.47 2hey s ILE 77 Cb -0.16 -3.93 0.04 0.00 0.01 0.00 0.00 42.46 38.42 2hey s ILE 77 CO 0.10 -0.27 0.31 -0.94 0.00 0.00 0.00 174.94 174.14 2hey s SER 78 N 1.75 6.06 0.13 3.58 1.04 -0.44 -4.92 113.70 120.90 2hey s SER 78 Ca 0.10 -1.05 -0.30 0.00 0.48 0.00 0.00 55.95 55.17 2hey s SER 78 Cb -0.17 -2.14 -0.07 0.00 0.10 0.00 0.00 66.02 63.73 2hey s SER 78 CO 0.12 -0.50 1.16 -0.55 0.98 0.00 0.00 173.24 174.45 2hey s SER 79 N 1.93 7.15 0.46 7.02 0.15 -1.26 -0.69 113.70 128.47 2hey s SER 79 Ca 0.04 2.08 -0.23 0.00 0.70 0.00 0.00 55.95 58.54 2hey s SER 79 Cb -0.21 -2.59 -0.07 0.00 -1.71 0.00 0.00 66.02 61.44 2hey s SER 79 CO 0.08 -0.36 1.17 -0.31 1.20 0.00 0.00 173.24 175.03 2hey s TYR 80 N 0.38 2.85 -0.45 3.44 2.02 -1.14 -4.96 117.35 119.49 2hey s TYR 80 Ca 0.54 1.53 -0.18 0.00 -0.37 0.00 0.00 57.07 58.59 2hey s TYR 80 Cb -0.30 -3.40 0.04 0.00 -0.40 0.00 0.00 41.96 37.90 2hey s TYR 80 CO 0.33 -1.57 0.50 0.15 -1.57 0.00 0.00 175.55 173.38 2hey s LYS 81 N -2.72 3.10 -0.10 -0.62 -0.14 -1.26 -4.91 119.74 113.09 2hey s LYS 81 Ca 0.64 -0.85 -0.30 0.00 -1.36 0.00 0.00 55.97 54.10 2hey s LYS 81 Cb -0.29 -4.03 0.08 0.00 -1.68 0.00 0.00 37.83 31.92 2hey s LYS 81 CO 0.35 -0.99 0.77 1.21 -0.76 0.00 0.00 175.35 175.93 2hey s ASN 82 N 2.18 -0.59 0.59 2.83 3.84 -1.26 -5.04 114.94 117.49 2hey s ASN 82 Ca 0.13 0.72 0.29 0.00 0.21 0.00 0.00 52.86 54.20 2hey s ASN 82 Cb -0.18 0.58 1.59 0.00 -0.55 0.00 0.00 41.25 42.69 2hey s ASN 82 CO 0.13 -0.50 2.02 1.05 -2.79 0.00 0.00 177.10 177.00 2hey h GLU 83 N 3.13 0.00 0.00 0.43 4.11 -2.05 -2.24 114.58 117.95 2hey h GLU 83 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.18 2hey h GLU 83 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2hey h GLU 83 CO 0.33 0.00 -0.20 0.66 0.07 0.00 0.00 179.01 179.88 2hey n TYR 84 N -3.75 0.28 -2.39 2.06 4.01 -1.26 -4.79 117.16 111.32 2hey n TYR 84 Ca 0.04 0.08 -0.42 0.00 -0.16 0.00 0.00 57.90 57.44 2hey n TYR 84 Cb 0.45 -0.56 -0.03 0.00 -0.31 0.00 0.00 39.34 38.90 2hey n TYR 84 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2hey s GLN 85 N -3.04 4.32 0.00 -0.72 -1.52 -0.85 -4.78 119.66 113.07 2hey s GLN 85 Ca 0.12 1.75 0.00 0.00 -1.95 0.00 0.00 55.36 55.28 2hey s GLN 85 Cb 0.16 -3.58 0.00 0.00 -0.22 0.00 0.00 33.01 29.38 2hey s GLN 85 CO 0.61 -0.50 0.84 0.25 -0.25 0.00 0.00 175.29 176.23 2hey n THR 86 N 4.69 0.70 -4.32 -0.19 -2.24 -0.35 -4.98 114.28 107.59 2hey n THR 86 Ca 0.12 -0.74 -0.18 0.00 -2.27 0.00 0.00 64.05 60.98 2hey n THR 86 Cb 0.45 0.68 -0.10 0.00 -2.10 0.00 0.00 70.33 69.26 2hey n THR 86 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2hey s MET 87 N -0.70 1.25 0.06 -0.78 -1.94 -1.12 -4.63 119.30 111.45 2hey s MET 87 Ca 0.00 -1.53 0.01 0.00 -1.71 0.00 0.00 55.69 52.46 2hey s MET 87 Cb 0.00 -1.01 -0.04 0.00 2.01 0.00 0.00 34.83 35.79 2hey s MET 87 CO 0.00 0.17 0.13 -1.21 -0.01 0.00 0.00 175.02 174.09 2hey s GLU 88 N -3.57 3.11 -0.20 2.03 0.41 -1.26 -4.89 118.70 114.33 2hey s GLU 88 Ca 0.20 -0.57 -0.08 0.00 -0.41 0.00 0.00 54.97 54.12 2hey s GLU 88 Cb -0.01 -2.86 -0.04 0.00 -1.78 0.00 0.00 34.13 29.44 2hey s GLU 88 CO 0.05 0.60 0.08 0.08 -0.49 0.00 0.00 175.26 175.58 2hey s VAL 89 N -1.40 4.78 -0.03 2.63 1.01 -1.26 -0.91 120.40 125.22 2hey s VAL 89 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2hey s VAL 89 Cb -0.12 -3.18 0.03 0.00 0.00 0.00 0.00 36.38 33.10 2hey s VAL 89 CO 0.23 0.42 0.00 -1.10 0.00 0.00 0.00 175.10 174.65 2hey s GLN 90 N 0.73 0.29 -1.49 2.72 -0.21 0.04 -4.83 119.66 116.91 2hey s GLN 90 Ca 0.04 0.08 -0.12 0.00 0.02 0.00 0.00 55.36 55.38 2hey s GLN 90 Cb -0.13 -0.47 0.07 0.00 1.00 0.00 0.00 33.01 33.47 2hey s GLN 90 CO 0.02 -0.13 0.97 0.09 -2.12 0.00 0.00 175.29 174.11 2hey n ASN 91 N 4.13 -4.48 -2.32 5.90 3.02 -1.26 -2.14 115.26 118.11 2hey n ASN 91 Ca -0.27 -0.77 -0.19 0.00 -0.03 0.00 0.00 54.58 53.33 2hey n ASN 91 Cb 0.50 -3.99 0.01 0.00 -0.61 0.00 0.00 39.78 35.69 2hey n ASN 91 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2hey n ASN 92 N -2.88 -5.40 -3.98 6.41 5.15 -1.26 -5.01 115.26 108.30 2hey n ASN 92 Ca -0.00 -0.12 -0.11 0.00 -0.60 0.00 0.00 54.58 53.75 2hey n ASN 92 Cb 0.55 -4.37 -0.12 0.00 -0.53 0.00 0.00 39.78 35.31 2hey n ASN 92 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2hey s SER 93 N -2.42 0.39 -0.19 1.20 1.04 -0.91 -4.71 113.70 108.11 2hey s SER 93 Ca 0.11 -0.36 -0.26 0.00 0.48 0.00 0.00 55.95 55.92 2hey s SER 93 Cb -0.05 0.04 -0.01 0.00 0.10 0.00 0.00 66.02 66.11 2hey s SER 93 CO 0.14 -0.17 0.88 -0.69 0.98 0.00 0.00 173.24 174.37 2hey s VAL 94 N -0.99 4.83 -0.21 5.02 1.01 0.18 -0.78 120.40 129.47 2hey s VAL 94 Ca -0.09 1.71 -0.25 0.00 0.00 0.00 0.00 61.98 63.35 2hey s VAL 94 Cb -0.07 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.13 2hey s VAL 94 CO -0.00 -0.03 0.82 -0.69 0.00 0.00 0.00 175.10 175.19 2hey s VAL 95 N 2.45 4.87 -0.41 2.92 1.01 -0.09 -1.17 120.40 129.99 2hey s VAL 95 Ca 0.39 1.57 -0.21 0.00 0.00 0.00 0.00 61.98 63.73 2hey s VAL 95 Cb -0.16 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.12 2hey s VAL 95 CO 0.11 -0.02 0.65 -0.63 0.00 0.00 0.00 175.10 175.20 2hey s ILE 96 N 2.48 4.84 -0.10 2.22 -1.09 -0.74 -4.48 121.20 124.33 2hey s ILE 96 Ca 0.36 0.29 0.10 0.00 -2.23 0.00 0.00 60.65 59.17 2hey s ILE 96 Cb -0.16 -4.17 -0.24 0.00 -1.58 0.00 0.00 42.46 36.32 2hey s ILE 96 CO 0.10 -0.51 0.43 1.17 -1.23 0.00 0.00 174.94 174.90 2hey n LYS 97 N 6.21 0.67 -5.28 2.79 4.81 -1.26 -2.88 118.16 123.21 2hey n LYS 97 Ca -0.01 0.22 -0.31 0.00 -0.87 0.00 0.00 58.31 57.33 2hey n LYS 97 Cb 0.48 -1.70 -0.16 0.00 0.02 0.00 0.00 35.03 33.67 2hey n LYS 97 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2hey s ASP 99 N -0.41 5.06 0.00 0.00 1.01 0.11 -4.43 116.67 118.01 2hey s ASP 99 Ca 0.04 2.42 0.00 0.00 0.71 0.00 0.00 52.55 55.72 2hey s ASP 99 Cb -0.12 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.21 2hey s ASP 99 CO 0.01 -1.68 0.00 0.61 0.21 0.00 0.00 175.17 174.32 2hey n GLY 100 N 0.55 1.45 3.73 0.21 0.00 -0.80 -2.82 105.19 107.50 2hey n GLY 100 Ca 0.14 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 2hey n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hey s LEU 101 N 0.00 4.46 0.08 0.99 1.43 -1.26 -1.09 118.68 123.28 2hey s LEU 101 Ca 0.00 1.70 0.07 0.00 -1.03 0.00 0.00 54.13 54.87 2hey s LEU 101 Cb 0.00 -3.52 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 2hey s LEU 101 CO 0.00 -0.10 -0.19 -0.31 0.23 0.00 0.00 176.35 175.98 2hey s TYR 102 N 0.26 1.63 -0.06 0.29 1.51 -0.12 0.52 117.35 121.38 2hey s TYR 102 Ca 0.47 -0.41 -0.17 0.00 -1.01 0.00 0.00 57.07 55.94 2hey s TYR 102 Cb -0.22 -0.92 -0.05 0.00 -0.11 0.00 0.00 41.96 40.66 2hey s TYR 102 CO 0.28 0.14 0.47 0.42 -1.11 0.00 0.00 175.55 175.75 2hey s ILE 103 N -1.08 5.09 -0.18 2.71 1.01 0.01 -1.19 121.20 127.57 2hey s ILE 103 Ca 0.05 0.96 -0.01 0.00 0.00 0.00 0.00 60.65 61.64 2hey s ILE 103 Cb -0.10 -3.80 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 2hey s ILE 103 CO 0.03 0.42 -0.13 -0.63 0.00 0.00 0.00 174.94 174.64 2hey s ILE 104 N -0.06 2.80 -0.08 2.92 1.01 0.30 -1.29 121.20 126.79 2hey s ILE 104 Ca 0.26 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 60.23 2hey s ILE 104 Cb -0.16 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.10 2hey s ILE 104 CO 0.12 0.49 -0.21 -0.47 0.00 0.00 0.00 174.94 174.88 2hey s TYR 105 N 1.05 2.23 -0.04 3.97 5.04 0.44 -0.95 117.35 129.09 2hey s TYR 105 Ca -0.01 -0.86 0.02 0.00 -2.44 0.00 0.00 57.07 53.78 2hey s TYR 105 Cb -0.15 -1.51 0.01 0.00 0.35 0.00 0.00 41.96 40.66 2hey s TYR 105 CO -0.03 -0.35 -0.09 -1.17 -1.34 0.00 0.00 175.55 172.57 2hey s LEU 106 N 0.35 1.63 0.06 6.97 2.96 -0.32 -0.64 118.68 129.70 2hey s LEU 106 Ca -0.16 -0.20 0.03 0.00 -0.22 0.00 0.00 54.13 53.58 2hey s LEU 106 Cb -0.17 -0.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.90 2hey s LEU 106 CO 0.07 0.03 -0.09 -1.59 -1.32 0.00 0.00 176.35 173.45 2hey s LYS 107 N 0.50 0.66 -0.23 1.98 -2.85 -0.49 -0.86 119.74 118.46 2hey s LYS 107 Ca -0.08 -0.93 -0.32 0.00 -1.00 0.00 0.00 55.97 53.63 2hey s LYS 107 Cb -0.12 -0.38 0.16 0.00 -2.06 0.00 0.00 37.83 35.43 2hey s LYS 107 CO 0.01 0.06 1.24 0.20 0.10 0.00 0.00 175.35 176.96 2hey s GLY 108 N -1.96 -0.13 -0.06 0.59 0.00 -0.88 -1.13 107.32 103.76 2hey s GLY 108 Ca -0.03 2.21 0.06 0.00 0.00 0.00 0.00 44.72 46.95 2hey s GLY 108 CO -0.00 0.87 -0.25 -0.56 0.00 0.00 0.00 173.10 173.16 2hey s SER 109 N -1.49 3.04 0.29 1.64 0.01 0.52 -0.87 113.70 116.83 2hey s SER 109 Ca 0.07 -0.51 0.07 0.00 1.31 0.00 0.00 55.95 56.90 2hey s SER 109 Cb -0.01 -0.85 -0.06 0.00 0.21 0.00 0.00 66.02 65.31 2hey s SER 109 CO -0.05 0.24 -0.07 -0.36 0.41 0.00 0.00 173.24 173.41 2hey s PHE 110 N -0.14 2.04 -2.02 2.43 0.40 0.92 -1.21 117.98 120.40 2hey s PHE 110 Ca -0.04 -0.65 0.19 0.00 -0.60 0.00 0.00 56.93 55.83 2hey s PHE 110 Cb -0.14 -1.15 0.36 0.00 0.51 0.00 0.00 43.02 42.60 2hey s PHE 110 CO 0.04 0.35 1.29 1.19 0.70 0.00 0.00 175.22 178.79 2hey n PHE 111 N -0.62 0.43 -3.73 0.36 3.72 -1.26 -4.76 117.46 111.61 2hey n PHE 111 Ca -0.05 -0.26 -0.09 0.00 -0.05 0.00 0.00 57.45 56.99 2hey n PHE 111 Cb 0.63 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.13 2hey n PHE 111 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 2hey s GLN 112 N -1.30 1.43 0.25 -1.08 -2.07 -1.26 -5.10 119.66 110.53 2hey s GLN 112 Ca 0.32 -0.85 -0.30 0.00 -1.82 0.00 0.00 55.36 52.72 2hey s GLN 112 Cb 0.19 0.54 -0.10 0.00 -1.09 0.00 0.00 33.01 32.55 2hey s GLN 112 CO 0.26 -0.62 1.40 -1.21 -1.32 0.00 0.00 175.29 173.81 2hey s GLU 113 N -3.87 4.30 0.07 9.60 0.41 -1.26 -4.83 118.70 123.11 2hey s GLU 113 Ca 0.09 2.25 0.03 0.00 -0.41 0.00 0.00 54.97 56.93 2hey s GLU 113 Cb -0.02 -3.12 -0.03 0.00 -1.78 0.00 0.00 34.13 29.18 2hey s GLU 113 CO -0.02 -0.37 -0.10 0.14 -0.49 0.00 0.00 175.26 174.42 2hey s VAL 114 N -0.11 0.80 -0.26 2.63 -7.23 -1.26 -5.13 120.40 109.84 2hey s VAL 114 Ca 0.58 -1.34 -0.03 0.00 -1.81 0.00 0.00 61.98 59.38 2hey s VAL 114 Cb -0.41 -0.99 0.02 0.00 0.56 0.00 0.00 36.38 35.56 2hey s VAL 114 CO 0.43 -0.42 -0.03 -0.54 -0.31 0.00 0.00 175.10 174.23 2hey s LYS 115 N -2.09 2.85 -0.06 4.82 1.02 -1.26 -4.89 119.74 120.12 2hey s LYS 115 Ca -0.02 -0.98 0.03 0.00 0.02 0.00 0.00 55.97 55.01 2hey s LYS 115 Cb -0.07 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.13 2hey s LYS 115 CO 0.00 -0.43 -0.12 0.42 -0.92 0.00 0.00 175.35 174.31 2hey s ILE 116 N 1.35 3.25 -0.03 2.17 1.01 -1.26 -0.70 121.20 126.99 2hey s ILE 116 Ca 0.00 -0.65 0.07 0.00 0.00 0.00 0.00 60.65 60.07 2hey s ILE 116 Cb -0.17 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 39.99 2hey s ILE 116 CO -0.03 0.59 -0.25 -1.81 0.00 0.00 0.00 174.94 173.44 2hey s ASP 117 N -0.68 2.97 -0.20 3.58 1.01 -0.53 -0.79 116.67 122.03 2hey s ASP 117 Ca 0.10 -0.47 -0.07 0.00 0.71 0.00 0.00 52.55 52.81 2hey s ASP 117 Cb -0.11 -0.54 -0.04 0.00 1.01 0.00 0.00 42.92 43.24 2hey s ASP 117 CO 0.01 0.28 0.07 -0.22 0.21 0.00 0.00 175.17 175.52 2hey s LEU 118 N -0.40 3.70 -0.02 1.23 2.96 0.30 -1.14 118.68 125.31 2hey s LEU 118 Ca 0.04 -0.01 0.07 0.00 -0.22 0.00 0.00 54.13 54.01 2hey s LEU 118 Cb -0.11 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.60 2hey s LEU 118 CO 0.01 0.10 -0.22 -1.00 -1.32 0.00 0.00 176.35 173.93 2hey s HIS 119 N 0.79 2.47 -0.60 5.38 3.76 -0.15 -0.80 115.29 126.12 2hey s HIS 119 Ca 0.04 -0.33 0.17 0.00 -0.15 0.00 0.00 55.06 54.78 2hey s HIS 119 Cb -0.13 -1.54 -0.20 0.00 1.11 0.00 0.00 32.58 31.82 2hey s HIS 119 CO 0.02 0.06 0.63 1.19 -0.85 0.00 0.00 174.74 175.79 2hey n PHE 120 N 2.32 0.00 -3.69 1.40 3.72 -1.26 -1.72 117.46 118.23 2hey n PHE 120 Ca -0.16 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.21 2hey n PHE 120 Cb 0.51 -0.10 -0.01 0.00 -0.94 0.00 0.00 39.48 38.95 2hey n PHE 120 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2hey s ARG 121 N -2.73 0.89 0.42 -1.08 3.52 -1.17 -0.31 118.95 118.49 2hey s ARG 121 Ca 0.03 -0.48 0.12 0.00 -0.13 0.00 0.00 55.73 55.27 2hey s ARG 121 Cb 0.12 0.31 0.89 0.00 -1.56 0.00 0.00 34.95 34.72 2hey s ARG 121 CO 0.70 -0.41 1.96 0.93 -0.81 0.00 0.00 175.30 177.67 2hey h GLU 122 N 2.00 0.14 -0.09 5.12 3.07 -1.93 -2.55 114.58 120.34 2hey h GLU 122 Ca -0.25 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 2hey h GLU 122 Cb 1.22 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.11 2hey h GLU 122 CO 0.27 0.28 0.00 -0.40 -1.40 0.00 0.00 179.01 177.76 2hey n ASP 123 N -4.31 2.67 -4.74 1.42 5.68 -1.26 -4.97 116.55 111.05 2hey n ASP 123 Ca -0.01 -1.87 -0.41 0.00 -0.50 0.00 0.00 54.79 51.99 2hey n ASP 123 Cb 0.25 -0.04 -0.04 0.00 -1.14 0.00 0.00 41.12 40.14 2hey n ASP 123 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 2hey s HIS 124 N -1.91 3.59 -0.25 2.11 2.46 -0.96 -5.00 115.29 115.32 2hey s HIS 124 Ca 0.32 1.59 -0.29 0.00 0.47 0.00 0.00 55.06 57.16 2hey s HIS 124 Cb 0.20 -3.27 -0.02 0.00 -0.13 0.00 0.00 32.58 29.36 2hey s HIS 124 CO 0.31 -0.61 1.53 1.21 -2.47 0.00 0.00 174.74 174.71 2hey s ASN 125 N -0.07 6.44 0.69 9.88 2.47 -1.26 -4.85 114.94 128.24 2hey s ASN 125 Ca 0.50 1.46 -0.11 0.00 0.42 0.00 0.00 52.86 55.12 2hey s ASN 125 Cb -0.29 -2.53 0.01 0.00 -1.45 0.00 0.00 41.25 36.98 2hey s ASN 125 CO 0.35 -1.23 1.06 -2.16 -3.72 0.00 0.00 177.10 171.40 2hey s PRO 126 N 4.58 2.89 -0.21 0.43 0.04 -1.26 -4.95 135.00 136.52 2hey s PRO 126 Ca 0.67 1.02 -0.20 0.00 0.04 0.00 0.00 61.00 62.53 2hey s PRO 126 Cb -0.22 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 2hey s PRO 126 CO 0.28 -1.14 0.61 0.42 0.04 0.00 0.00 177.00 177.21 2hey s ILE 127 N -2.95 5.03 -0.17 0.56 1.01 0.02 -4.87 121.20 119.84 2hey s ILE 127 Ca 0.59 1.14 -0.29 0.00 0.00 0.00 0.00 60.65 62.09 2hey s ILE 127 Cb -0.15 -3.93 -0.01 0.00 0.01 0.00 0.00 42.46 38.38 2hey s ILE 127 CO 0.53 0.11 1.25 -0.55 0.00 0.00 0.00 174.94 176.27 2hey s SER 128 N 1.24 6.95 -0.19 3.58 0.15 -1.26 -0.53 113.70 123.64 2hey s SER 128 Ca 0.28 1.67 -0.24 0.00 0.70 0.00 0.00 55.95 58.35 2hey s SER 128 Cb -0.16 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.60 2hey s SER 128 CO 0.10 -0.76 0.80 -0.63 1.20 0.00 0.00 173.24 173.96 2hey s ILE 129 N 3.48 4.89 0.28 6.45 1.01 0.03 -4.99 121.20 132.36 2hey s ILE 129 Ca 0.54 1.56 -0.29 0.00 0.00 0.00 0.00 60.65 62.45 2hey s ILE 129 Cb -0.21 -4.11 -0.10 0.00 0.01 0.00 0.00 42.46 38.06 2hey s ILE 129 CO 0.14 0.02 1.13 -2.16 0.00 0.00 0.00 174.94 174.07 2hey s PRO 130 N 2.24 4.59 0.23 2.79 0.04 -1.26 -4.51 135.00 139.12 2hey s PRO 130 Ca 0.36 1.86 -0.15 0.00 0.04 0.00 0.00 61.00 63.11 2hey s PRO 130 Cb -0.16 -3.18 -0.08 0.00 0.04 0.00 0.00 34.50 31.12 2hey s PRO 130 CO 0.11 0.14 0.66 -1.64 0.04 0.00 0.00 177.00 176.31 2hey s MET 131 N -1.42 4.04 0.82 4.56 -1.94 -1.26 -4.68 119.30 119.42 2hey s MET 131 Ca 0.45 0.63 -0.11 0.00 -1.71 0.00 0.00 55.69 54.95 2hey s MET 131 Cb -0.33 -2.73 0.09 0.00 2.01 0.00 0.00 34.83 33.87 2hey s MET 131 CO 0.42 0.34 1.12 -0.51 -0.01 0.00 0.00 175.02 176.38 2hey s LEU 132 N -2.38 2.99 0.62 -0.03 1.43 0.06 -4.85 118.68 116.52 2hey s LEU 132 Ca 0.45 2.02 0.32 0.00 -1.03 0.00 0.00 54.13 55.89 2hey s LEU 132 Cb -0.14 -4.55 1.85 0.00 0.03 0.00 0.00 46.19 43.39 2hey s LEU 132 CO 0.20 -2.47 2.16 0.78 0.23 0.00 0.00 176.35 177.25 2hey h ASN 133 N -1.33 0.00 -0.93 2.29 2.35 -1.98 0.25 115.58 116.24 2hey h ASN 133 Ca -0.44 0.00 0.33 0.00 -0.55 0.00 0.00 56.30 55.64 2hey h ASN 133 Cb 1.25 0.00 -0.17 0.00 0.05 0.00 0.00 38.32 39.45 2hey h ASN 133 CO 0.47 0.00 0.27 -0.67 -1.65 0.00 0.00 177.43 175.86 2hey n ASP 134 N -3.54 0.12 0.00 5.81 2.03 -1.26 -4.86 116.55 114.85 2hey n ASP 134 Ca -0.01 1.56 0.00 0.00 0.52 0.00 0.00 54.79 56.86 2hey n ASP 134 Cb 0.24 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 39.97 2hey n ASP 134 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2hey n GLY 135 N -1.35 2.81 0.09 0.27 0.00 0.90 -4.81 105.19 103.09 2hey n GLY 135 Ca 0.29 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.34 2hey n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hey n ARG 136 N -2.00 3.26 -4.25 1.61 5.12 -1.26 -4.26 116.66 114.87 2hey n ARG 136 Ca 0.00 -0.31 -0.19 0.00 -1.93 0.00 0.00 57.85 55.42 2hey n ARG 136 Cb 0.00 -0.89 -0.13 0.00 -1.16 0.00 0.00 32.46 30.28 2hey n ARG 136 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 2hey s ARG 137 N -1.17 0.86 -0.09 5.56 3.52 -1.26 -0.05 118.95 126.31 2hey s ARG 137 Ca 0.04 -0.85 0.04 0.00 -0.13 0.00 0.00 55.73 54.84 2hey s ARG 137 Cb 0.05 -0.86 -0.00 0.00 -1.56 0.00 0.00 34.95 32.57 2hey s ARG 137 CO 0.18 0.20 -0.24 0.42 -0.81 0.00 0.00 175.30 175.05 2hey s ILE 138 N -1.06 2.05 -0.31 4.11 1.01 -0.05 -0.76 121.20 126.19 2hey s ILE 138 Ca -0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 60.65 59.60 2hey s ILE 138 Cb -0.09 -1.76 0.11 0.00 0.01 0.00 0.00 42.46 40.73 2hey s ILE 138 CO 0.02 0.56 0.14 -0.69 0.00 0.00 0.00 174.94 174.97 2hey s VAL 139 N 0.24 0.16 -0.06 2.92 1.01 -1.26 -2.07 120.40 121.35 2hey s VAL 139 Ca -0.16 -1.08 0.01 0.00 0.00 0.00 0.00 61.98 60.76 2hey s VAL 139 Cb -0.17 -1.14 0.02 0.00 0.00 0.00 0.00 36.38 35.09 2hey s VAL 139 CO 0.08 -0.77 -0.07 0.12 0.00 0.00 0.00 175.10 174.45 2hey s PHE 140 N 1.80 1.04 -0.08 5.22 5.36 -0.04 -5.00 117.98 126.29 2hey s PHE 140 Ca 0.11 -0.35 0.04 0.00 -0.96 0.00 0.00 56.93 55.76 2hey s PHE 140 Cb -0.18 -0.84 0.00 0.00 -0.34 0.00 0.00 43.02 41.67 2hey s PHE 140 CO -0.27 -0.24 -0.19 0.99 -1.46 0.00 0.00 175.22 174.05 2hey s THR 141 N 0.86 1.64 0.03 0.12 2.01 -1.26 -1.17 115.64 117.86 2hey s THR 141 Ca -0.12 -0.79 0.04 0.00 0.31 0.00 0.00 61.69 61.14 2hey s THR 141 Cb -0.15 -1.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 2hey s THR 141 CO 0.01 0.47 -0.13 0.54 -0.69 0.00 0.00 174.62 174.81 2hey s VAL 142 N 0.37 1.05 -0.13 3.82 0.11 -0.12 -5.01 120.40 120.49 2hey s VAL 142 Ca -0.14 -0.87 -0.01 0.00 -2.93 0.00 0.00 61.98 58.02 2hey s VAL 142 Cb -0.16 -0.94 -0.02 0.00 -1.53 0.00 0.00 36.38 33.73 2hey s VAL 142 CO 0.06 0.06 -0.09 -0.69 -3.33 0.00 0.00 175.10 171.11 2hey s VAL 143 N -0.72 3.47 -0.01 2.04 1.01 -1.26 -0.54 120.40 124.39 2hey s VAL 143 Ca 0.02 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 2hey s VAL 143 Cb -0.07 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.84 2hey s VAL 143 CO 0.01 0.52 0.15 0.00 0.00 0.00 0.00 175.10 175.78 2hey s ALA 144 N 0.21 -0.36 -0.37 5.51 0.00 -0.33 -4.98 121.76 121.45 2hey s ALA 144 Ca -0.05 -0.00 -0.26 0.00 0.00 0.00 0.00 51.96 51.64 2hey s ALA 144 Cb -0.15 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.03 2hey s ALA 144 CO 0.04 -0.19 0.95 0.45 0.00 0.00 0.00 175.76 177.02 2hey s SER 145 N -1.10 6.71 0.25 0.00 0.15 -1.26 -0.94 113.70 117.50 2hey s SER 145 Ca -0.12 0.64 0.09 0.00 0.70 0.00 0.00 55.95 57.27 2hey s SER 145 Cb -0.06 -2.48 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 2hey s SER 145 CO 0.01 -0.87 0.00 -0.76 1.20 0.00 0.00 173.24 172.82 2hey s LEU 146 N 3.53 3.23 0.04 3.45 1.43 -0.25 -5.01 118.68 125.11 2hey s LEU 146 Ca 0.39 -0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 52.90 2hey s LEU 146 Cb -0.12 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2hey s LEU 146 CO 0.19 0.02 -0.04 0.00 0.23 0.00 0.00 176.35 176.75 2hey s ALA 147 N -2.21 0.43 0.15 4.21 0.00 -1.26 -1.91 121.76 121.17 2hey s ALA 147 Ca 0.31 -0.99 -0.32 0.00 0.00 0.00 0.00 51.96 50.96 2hey s ALA 147 Cb -0.07 0.21 -0.17 0.00 0.00 0.00 0.00 23.12 23.08 2hey s ALA 147 CO 0.20 -0.27 0.83 0.34 0.00 0.00 0.00 175.76 176.86 2hey n PHE 148 N 0.68 0.30 0.00 0.00 7.35 -1.26 -1.23 117.46 123.30 2hey n PHE 148 Ca -0.18 0.91 0.00 0.00 -0.76 0.00 0.00 57.45 57.43 2hey n PHE 148 Cb 0.59 -2.08 0.00 0.00 0.35 0.00 0.00 39.48 38.34 2hey n PHE 148 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2hey n LYS 149 N 1.25 0.00 -2.18 -4.13 5.02 -1.14 -5.05 118.16 111.94 2hey n LYS 149 Ca 0.17 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 56.12 2hey n LYS 149 Cb 0.21 -0.54 0.01 0.00 -0.02 0.00 0.00 35.03 34.69 2hey n LYS 149 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2hey s ASP 150 N -2.23 5.68 -0.09 4.39 1.01 -0.36 -4.92 116.67 120.14 2hey s ASP 150 Ca 0.00 2.08 -0.03 0.00 0.71 0.00 0.00 52.55 55.31 2hey s ASP 150 Cb 0.00 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.40 2hey s ASP 150 CO 0.00 -1.24 0.09 -0.54 0.21 0.00 0.00 175.17 173.68 2hey s LYS 151 N -3.50 -0.02 -0.23 8.23 1.02 0.58 -1.79 119.74 124.03 2hey s LYS 151 Ca 0.70 0.27 -0.18 0.00 0.02 0.00 0.00 55.97 56.78 2hey s LYS 151 Cb -0.22 -0.88 -0.03 0.00 -0.52 0.00 0.00 37.83 36.18 2hey s LYS 151 CO 0.30 -0.44 0.52 0.08 -0.92 0.00 0.00 175.35 174.89 2hey s VAL 152 N 2.18 5.08 0.22 3.17 1.01 -0.31 -3.01 120.40 128.74 2hey s VAL 152 Ca 0.04 0.92 -0.11 0.00 0.00 0.00 0.00 61.98 62.83 2hey s VAL 152 Cb -0.13 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 2hey s VAL 152 CO -0.05 0.13 0.39 -0.72 0.00 0.00 0.00 175.10 174.84 2hey s TYR 153 N 1.99 0.44 -0.08 5.22 1.13 -0.70 -0.64 117.35 124.72 2hey s TYR 153 Ca 0.23 -0.79 0.01 0.00 -1.41 0.00 0.00 57.07 55.11 2hey s TYR 153 Cb -0.15 0.04 0.02 0.00 -1.10 0.00 0.00 41.96 40.77 2hey s TYR 153 CO 0.09 -0.87 -0.10 -0.51 -2.51 0.00 0.00 175.55 171.65 2hey s LEU 154 N -3.01 1.49 0.18 -3.49 1.43 -1.26 -0.98 118.68 113.03 2hey s LEU 154 Ca 0.22 -0.29 0.06 0.00 -1.03 0.00 0.00 54.13 53.09 2hey s LEU 154 Cb 0.01 -0.80 -0.04 0.00 0.03 0.00 0.00 46.19 45.39 2hey s LEU 154 CO 0.06 -0.02 0.11 0.42 0.23 0.00 0.00 176.35 177.16 2hey s THR 155 N 0.99 4.32 -0.20 5.49 -4.23 -0.29 -1.28 115.64 120.44 2hey s THR 155 Ca -0.08 -1.20 -0.05 0.00 -1.18 0.00 0.00 61.69 59.18 2hey s THR 155 Cb -0.15 -3.22 -0.02 0.00 1.34 0.00 0.00 72.50 70.45 2hey s THR 155 CO -0.00 -0.14 0.00 -0.69 -0.54 0.00 0.00 174.62 173.25 2hey s VAL 156 N -1.80 3.99 -0.88 2.29 1.01 -0.09 -1.45 120.40 123.47 2hey s VAL 156 Ca 0.31 -0.30 -0.21 0.00 0.00 0.00 0.00 61.98 61.78 2hey s VAL 156 Cb -0.10 -2.81 0.10 0.00 0.00 0.00 0.00 36.38 33.58 2hey s VAL 156 CO 0.23 0.43 1.15 0.21 0.00 0.00 0.00 175.10 177.11 2hey s ASN 157 N 1.00 6.49 0.01 3.32 3.04 0.12 -4.83 114.94 124.09 2hey s ASN 157 Ca 0.02 -1.66 -0.29 0.00 0.04 0.00 0.00 52.86 50.97 2hey s ASN 157 Cb -0.14 -2.44 0.10 0.00 -1.54 0.00 0.00 41.25 37.23 2hey s ASN 157 CO 0.02 -1.25 1.03 0.00 -3.04 0.00 0.00 177.10 173.86 2hey s ALA 158 N 3.49 -1.89 0.76 1.71 0.00 -1.26 -4.49 121.76 120.09 2hey s ALA 158 Ca 0.33 0.81 -0.14 0.00 0.00 0.00 0.00 51.96 52.96 2hey s ALA 158 Cb -0.07 0.38 0.06 0.00 0.00 0.00 0.00 23.12 23.49 2hey s ALA 158 CO -0.04 -0.83 1.22 -2.14 0.00 0.00 0.00 175.76 173.96 2hey s PRO 159 N -2.93 1.91 0.29 0.00 0.02 -1.26 -4.86 135.00 128.17 2hey s PRO 159 Ca 0.09 1.80 0.04 0.00 0.02 0.00 0.00 61.00 62.96 2hey s PRO 159 Cb -0.00 -1.80 0.71 0.00 0.02 0.00 0.00 34.50 33.42 2hey s PRO 159 CO -0.04 -2.02 1.75 -0.44 -0.33 0.00 0.00 177.00 175.92 2hey h ASP 160 N -0.53 0.61 -0.73 2.53 3.32 -2.01 -1.95 116.42 117.67 2hey h ASP 160 Ca -0.47 0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.70 2hey h ASP 160 Cb 1.30 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 40.83 2hey h ASP 160 CO 0.48 0.18 0.48 0.74 -1.72 0.00 0.00 179.24 179.40 2hey h THR 161 N 0.63 1.17 -0.48 0.35 2.02 -2.00 -2.15 112.91 112.45 2hey h THR 161 Ca 0.56 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.41 2hey h THR 161 Cb 0.92 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2hey h THR 161 CO -0.42 0.18 0.32 0.25 0.37 0.00 0.00 175.52 176.21 2hey h LEU 162 N 0.97 0.56 -0.23 2.58 6.46 -1.71 -2.90 115.31 121.04 2hey h LEU 162 Ca 0.27 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 58.02 2hey h LEU 162 Cb -0.09 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 2hey h LEU 162 CO -0.07 0.41 0.15 0.00 -0.62 0.00 0.00 178.44 178.30 2hey h GLU 164 N 0.30 0.25 -0.17 0.00 5.08 -1.27 -2.44 114.58 116.33 2hey h GLU 164 Ca 0.08 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2hey h GLU 164 Cb -0.01 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2hey h GLU 164 CO -0.02 0.17 0.00 0.72 -1.00 0.00 0.00 179.01 178.88 2hey n HIS 165 N -4.50 0.21 -2.04 4.33 8.25 -1.11 -4.93 115.22 115.43 2hey n HIS 165 Ca 0.01 -0.13 -0.42 0.00 -0.26 0.00 0.00 57.72 56.92 2hey n HIS 165 Cb 0.13 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.21 2hey n HIS 165 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2hey s LEU 166 N -1.45 4.37 -0.14 2.41 2.96 -0.62 -5.01 118.68 121.20 2hey s LEU 166 Ca 0.27 2.45 -0.00 0.00 -0.22 0.00 0.00 54.13 56.63 2hey s LEU 166 Cb 0.17 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.27 2hey s LEU 166 CO 0.25 -0.77 -0.14 -1.10 -1.32 0.00 0.00 176.35 173.28 2hey s GLN 167 N 1.47 3.33 -0.10 1.98 -0.21 -1.26 -4.25 119.66 120.62 2hey s GLN 167 Ca 0.68 -0.71 0.03 0.00 0.02 0.00 0.00 55.36 55.39 2hey s GLN 167 Cb -0.40 -2.64 0.01 0.00 1.00 0.00 0.00 33.01 30.98 2hey s GLN 167 CO 0.31 0.14 -0.20 0.42 -2.12 0.00 0.00 175.29 173.83 2hey s ILE 168 N 0.54 1.80 0.16 1.08 1.01 -0.92 -4.32 121.20 120.55 2hey s ILE 168 Ca -0.09 -0.85 0.06 0.00 0.00 0.00 0.00 60.65 59.78 2hey s ILE 168 Cb -0.16 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 2hey s ILE 168 CO 0.04 0.50 0.04 0.20 0.00 0.00 0.00 174.94 175.72 2hey s ASN 169 N 0.60 5.01 -1.47 3.58 0.01 -0.35 -4.49 114.94 117.84 2hey s ASN 169 Ca -0.14 -0.29 -0.11 0.00 -0.71 0.00 0.00 52.86 51.61 2hey s ASN 169 Cb -0.17 -1.16 0.06 0.00 0.41 0.00 0.00 41.25 40.40 2hey s ASN 169 CO 0.04 0.09 0.94 -0.67 -1.51 0.00 0.00 177.10 176.00 2hey n ASP 170 N -0.10 -4.19 -4.59 -1.22 2.03 -1.26 -0.36 116.55 106.85 2hey n ASP 170 Ca -0.09 -0.77 -0.35 0.00 0.52 0.00 0.00 54.79 54.09 2hey n ASP 170 Cb 0.55 -4.01 -0.10 0.00 -0.72 0.00 0.00 41.12 36.83 2hey n ASP 170 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2hey s GLY 171 N -3.53 1.89 -0.23 0.27 0.00 -1.24 -3.38 107.32 101.11 2hey s GLY 171 Ca 0.52 -0.88 -0.17 0.00 0.00 0.00 0.00 44.72 44.19 2hey s GLY 171 CO 0.82 0.26 0.58 1.85 0.00 0.00 0.00 173.10 176.61 2hey s GLU 172 N 0.86 0.63 -0.10 2.90 2.12 -0.28 -0.94 118.70 123.89 2hey s GLU 172 Ca 0.05 0.93 0.02 0.00 0.36 0.00 0.00 54.97 56.33 2hey s GLU 172 Cb -0.13 0.20 -0.01 0.00 0.26 0.00 0.00 34.13 34.45 2hey s GLU 172 CO 0.03 -0.12 -0.18 -1.17 -0.54 0.00 0.00 175.26 173.28 2hey s LEU 173 N 0.92 2.44 -0.08 2.70 2.96 0.08 -1.39 118.68 126.31 2hey s LEU 173 Ca -0.05 -0.41 0.03 0.00 -0.22 0.00 0.00 54.13 53.48 2hey s LEU 173 Cb -0.05 -1.51 0.01 0.00 0.50 0.00 0.00 46.19 45.14 2hey s LEU 173 CO -0.08 0.20 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.37 2hey s ILE 174 N 0.13 1.40 -0.14 6.68 1.01 0.19 -0.99 121.20 129.49 2hey s ILE 174 Ca -0.09 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 59.96 2hey s ILE 174 Cb -0.15 -1.26 0.01 0.00 0.01 0.00 0.00 42.46 41.06 2hey s ILE 174 CO 0.06 0.42 -0.22 -0.69 0.00 0.00 0.00 174.94 174.50 2hey s VAL 175 N 0.65 2.07 -0.10 2.92 1.01 -0.53 -0.42 120.40 125.99 2hey s VAL 175 Ca -0.14 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 60.80 2hey s VAL 175 Cb -0.16 -1.82 0.04 0.00 0.00 0.00 0.00 36.38 34.44 2hey s VAL 175 CO 0.04 0.55 0.24 0.54 0.00 0.00 0.00 175.10 176.47 2hey s VAL 176 N 0.75 -0.04 0.13 2.92 0.11 -0.41 -1.10 120.40 122.77 2hey s VAL 176 Ca -0.09 0.15 -0.30 0.00 -2.93 0.00 0.00 61.98 58.81 2hey s VAL 176 Cb -0.16 -0.37 -0.07 0.00 -1.53 0.00 0.00 36.38 34.26 2hey s VAL 176 CO -0.01 0.06 1.08 -1.58 -3.33 0.00 0.00 175.10 171.32 2hey s GLN 177 N 1.21 4.58 -0.11 1.54 0.74 -0.03 -0.81 119.66 126.79 2hey s GLN 177 Ca -0.09 1.65 0.15 0.00 0.05 0.00 0.00 55.36 57.12 2hey s GLN 177 Cb -0.10 -3.32 -0.21 0.00 1.10 0.00 0.00 33.01 30.47 2hey s GLN 177 CO -0.08 0.04 0.15 1.28 -0.55 0.00 0.00 175.29 176.13 2hey n LEU 178 N 2.84 0.00 -4.04 3.68 4.77 0.18 -4.74 117.00 119.69 2hey n LEU 178 Ca 0.04 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.89 2hey n LEU 178 Cb 0.47 0.25 -0.12 0.00 -2.33 0.00 0.00 43.42 41.69 2hey n LEU 178 CO 0.53 0.25 -0.40 0.42 -1.33 0.00 0.00 177.39 176.87 2hey s THR 179 N -2.63 0.50 0.68 -5.08 -4.23 -1.20 -4.97 115.64 98.72 2hey s THR 179 Ca -0.07 -0.91 -0.11 0.00 -1.18 0.00 0.00 61.69 59.41 2hey s THR 179 Cb 0.07 -0.55 0.00 0.00 1.34 0.00 0.00 72.50 73.36 2hey s THR 179 CO 0.64 -0.29 1.07 -2.16 -0.54 0.00 0.00 174.62 173.35 2hey s PRO 180 N -1.30 3.02 0.02 3.99 0.04 -1.26 -4.11 135.00 135.40 2hey s PRO 180 Ca -0.08 0.50 -0.05 0.00 0.04 0.00 0.00 61.00 61.42 2hey s PRO 180 Cb -0.08 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 32.43 2hey s PRO 180 CO 0.00 -0.92 0.21 0.41 0.04 0.00 0.00 177.00 176.74 2hey n GLY 181 N -2.93 1.00 3.64 0.56 0.00 -1.13 -4.68 105.19 101.65 2hey n GLY 181 Ca 0.07 -0.94 -0.46 0.00 0.00 0.00 0.00 46.02 44.69 2hey n GLY 181 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2hey n TYR 182 N -0.15 1.90 -5.16 1.61 9.36 -1.26 -4.52 117.16 118.93 2hey n TYR 182 Ca -0.00 0.52 -0.31 0.00 3.32 0.00 0.00 57.90 61.43 2hey n TYR 182 Cb 0.11 -2.40 -0.17 0.00 -0.63 0.00 0.00 39.34 36.26 2hey n TYR 182 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2hey s ALA 184 N 0.10 3.47 0.54 0.00 0.00 -0.79 -5.00 121.76 120.08 2hey s ALA 184 Ca -0.10 0.73 -0.21 0.00 0.00 0.00 0.00 51.96 52.38 2hey s ALA 184 Cb -0.15 -3.50 -0.07 0.00 0.00 0.00 0.00 23.12 19.40 2hey s ALA 184 CO 0.06 -0.68 1.04 -2.30 0.00 0.00 0.00 175.76 173.88 2hey n PRO 185 N 4.81 1.18 -1.80 0.00 -0.02 -1.26 -4.91 135.00 133.00 2hey n PRO 185 Ca 0.11 0.44 -0.41 0.00 -2.02 0.00 0.00 63.50 61.61 2hey n PRO 185 Cb 0.46 -2.20 -0.01 0.00 -0.02 0.00 0.00 33.50 31.72 2hey n PRO 185 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2hey s GLU 186 N -2.55 4.13 -1.55 -0.52 2.12 -1.26 -3.00 118.70 116.07 2hey s GLU 186 Ca 0.71 2.56 0.00 0.00 0.36 0.00 0.00 54.97 58.60 2hey s GLU 186 Cb -0.46 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 30.91 2hey s GLU 186 CO 0.51 -0.61 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 2hey n GLY 187 N 1.98 1.49 0.64 -1.50 0.00 -1.26 -4.89 105.19 101.66 2hey n GLY 187 Ca 0.07 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.84 2hey n GLY 187 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2hey n SER 188 N -0.35 2.32 -3.81 1.61 3.41 -1.16 -4.96 113.62 110.66 2hey n SER 188 Ca -0.15 -1.66 -0.12 0.00 -0.26 0.00 0.00 58.87 56.68 2hey n SER 188 Cb 0.48 0.10 -0.13 0.00 -0.26 0.00 0.00 64.21 64.40 2hey n SER 188 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2hey s TYR 189 N -1.60 -0.16 -0.00 7.33 5.04 -1.26 -5.05 117.35 121.65 2hey s TYR 189 Ca 0.19 0.40 0.01 0.00 -2.44 0.00 0.00 57.07 55.23 2hey s TYR 189 Cb 0.15 0.04 -0.00 0.00 0.35 0.00 0.00 41.96 42.50 2hey s TYR 189 CO 0.27 -0.09 -0.03 -1.01 -1.34 0.00 0.00 175.55 173.35 2hey s HIS 190 N 0.18 0.31 -2.00 4.97 3.76 -1.26 -5.17 115.29 116.08 2hey s HIS 190 Ca -0.01 -0.06 0.14 0.00 -0.15 0.00 0.00 55.06 54.98 2hey s HIS 190 Cb -0.02 -0.20 0.84 0.00 1.11 0.00 0.00 32.58 34.31 2hey s HIS 190 CO -0.00 -0.01 1.26 0.45 -0.85 0.00 0.00 174.74 175.59