#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhg n SER 88 N 0.00 -4.15 -0.05 1.61 2.88 -1.26 -4.98 113.62 107.68 2dhg n SER 88 Ca 0.00 -0.34 -0.01 0.00 -1.33 0.00 0.00 58.87 57.19 2dhg n SER 88 Cb 0.00 -3.29 -0.00 0.00 -0.75 0.00 0.00 64.21 60.17 2dhg n SER 88 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dhg h SER 89 N -1.56 0.00 -0.60 -3.46 0.02 -2.09 -3.50 113.55 102.36 2dhg h SER 89 Ca -0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2dhg h SER 89 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2dhg h SER 89 CO 0.34 0.50 0.00 0.61 -1.14 0.00 0.00 176.83 177.14 2dhg n GLY 90 N 1.77 0.68 3.30 -3.77 0.00 -1.26 -4.99 105.19 100.92 2dhg n GLY 90 Ca -0.01 -0.38 -0.56 0.00 0.00 0.00 0.00 46.02 45.07 2dhg n GLY 90 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dhg n SER 91 N -0.30 0.08 -4.45 1.61 3.41 -1.26 -4.95 113.62 107.76 2dhg n SER 91 Ca 0.00 1.09 -0.22 0.00 -0.26 0.00 0.00 58.87 59.48 2dhg n SER 91 Cb 0.12 -0.86 -0.10 0.00 -0.26 0.00 0.00 64.21 63.11 2dhg n SER 91 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dhg s SER 92 N 0.22 3.13 0.00 4.04 1.04 -1.26 -5.10 113.70 115.77 2dhg s SER 92 Ca 0.86 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2dhg s SER 92 Cb -1.21 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 64.68 2dhg s SER 92 CO 0.55 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.17 2dhg n GLY 93 N -0.61 0.02 3.77 7.32 0.00 -1.26 -5.12 105.19 109.32 2dhg n GLY 93 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 2dhg n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhg s PRO 94 N -0.20 2.48 0.57 1.61 0.04 -1.26 -5.04 135.00 133.20 2dhg s PRO 94 Ca 0.00 1.26 -0.07 0.00 0.04 0.00 0.00 61.00 62.23 2dhg s PRO 94 Cb 0.00 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 2dhg s PRO 94 CO 0.00 -1.48 0.91 -1.83 0.04 0.00 0.00 177.00 174.64 2dhg s GLU 95 N -4.56 3.28 -0.32 4.56 4.04 -1.26 -5.07 118.70 119.37 2dhg s GLU 95 Ca 0.64 0.29 0.01 0.00 0.04 0.00 0.00 54.97 55.94 2dhg s GLU 95 Cb -0.19 -2.24 0.10 0.00 0.02 0.00 0.00 34.13 31.83 2dhg s GLU 95 CO 0.50 -0.53 0.09 0.71 -1.84 0.00 0.00 175.26 174.18 2dhg s TYR 96 N -2.98 2.40 0.06 4.83 2.02 -1.25 -5.07 117.35 117.35 2dhg s TYR 96 Ca 0.52 -2.18 0.08 0.00 -0.37 0.00 0.00 57.07 55.13 2dhg s TYR 96 Cb -0.11 -2.12 -0.03 0.00 -0.40 0.00 0.00 41.96 39.30 2dhg s TYR 96 CO 0.48 -0.90 -0.20 -1.54 -1.57 0.00 0.00 175.55 171.82 2dhg s SER 97 N 1.34 3.67 0.10 2.29 1.04 -1.26 -0.89 113.70 120.00 2dhg s SER 97 Ca 0.10 -0.50 0.06 0.00 0.48 0.00 0.00 55.95 56.09 2dhg s SER 97 Cb -0.18 -0.51 -0.04 0.00 0.10 0.00 0.00 66.02 65.39 2dhg s SER 97 CO -0.19 0.24 -0.04 -0.76 0.98 0.00 0.00 173.24 173.47 2dhg s LEU 98 N -1.58 3.30 -0.19 2.42 1.43 -0.94 -3.98 118.68 119.14 2dhg s LEU 98 Ca 0.15 -0.27 -0.14 0.00 -1.03 0.00 0.00 54.13 52.84 2dhg s LEU 98 Cb -0.10 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 2dhg s LEU 98 CO 0.06 0.17 0.30 0.12 0.23 0.00 0.00 176.35 177.23 2dhg s PHE 99 N -1.31 3.40 0.07 0.29 5.36 -0.75 -1.50 117.98 123.52 2dhg s PHE 99 Ca 0.24 0.52 0.09 0.00 -0.96 0.00 0.00 56.93 56.83 2dhg s PHE 99 Cb -0.11 -2.39 -0.03 0.00 -0.34 0.00 0.00 43.02 40.14 2dhg s PHE 99 CO 0.17 0.11 -0.25 0.14 -1.46 0.00 0.00 175.22 173.92 2dhg s VAL 100 N 0.91 2.27 0.28 3.12 -7.23 -0.26 -1.67 120.40 117.82 2dhg s VAL 100 Ca 0.15 -1.46 0.06 0.00 -1.81 0.00 0.00 61.98 58.92 2dhg s VAL 100 Cb -0.14 -1.93 -0.02 0.00 0.56 0.00 0.00 36.38 34.85 2dhg s VAL 100 CO 0.05 0.28 0.22 0.61 -0.31 0.00 0.00 175.10 175.96 2dhg n GLY 101 N 1.50 3.14 3.72 2.32 0.00 -1.17 -0.26 105.19 114.44 2dhg n GLY 101 Ca -0.17 -1.88 -0.23 0.00 0.00 0.00 0.00 46.02 43.74 2dhg n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dhg n ASP 102 N -1.88 -1.72 -4.58 1.61 8.00 0.20 -3.39 116.55 114.79 2dhg n ASP 102 Ca 0.05 -0.87 -0.39 0.00 0.71 0.00 0.00 54.79 54.29 2dhg n ASP 102 Cb 0.50 -3.87 -0.10 0.00 -0.02 0.00 0.00 41.12 37.62 2dhg n ASP 102 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2dhg s LEU 103 N -6.64 4.17 0.67 0.64 1.43 -0.37 -4.30 118.68 114.28 2dhg s LEU 103 Ca 0.07 -0.01 -0.17 0.00 -1.03 0.00 0.00 54.13 53.00 2dhg s LEU 103 Cb -0.02 -2.26 0.00 0.00 0.03 0.00 0.00 46.19 43.94 2dhg s LEU 103 CO 0.83 -0.17 1.25 0.42 0.23 0.00 0.00 176.35 178.90 2dhg s THR 104 N 1.91 2.24 -2.00 5.49 -4.23 -1.26 -3.92 115.64 113.87 2dhg s THR 104 Ca 0.10 0.14 0.16 0.00 -1.18 0.00 0.00 61.69 60.91 2dhg s THR 104 Cb -0.16 -2.92 0.44 0.00 1.34 0.00 0.00 72.50 71.20 2dhg s THR 104 CO 0.11 -0.04 1.34 -0.81 -0.54 0.00 0.00 174.62 174.68 2dhg n PRO 105 N -2.15 0.49 0.00 3.99 -0.04 -1.26 -1.88 135.00 134.15 2dhg n PRO 105 Ca 0.15 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 2dhg n PRO 105 Cb 0.49 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.57 2dhg n PRO 105 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dhg n ASP 106 N -1.00 2.87 -4.61 3.54 8.00 -1.26 -4.72 116.55 119.37 2dhg n ASP 106 Ca 0.12 -1.95 -0.31 0.00 0.71 0.00 0.00 54.79 53.36 2dhg n ASP 106 Cb 0.05 0.02 -0.10 0.00 -0.02 0.00 0.00 41.12 41.08 2dhg n ASP 106 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2dhg s VAL 107 N -2.02 3.64 0.37 2.53 1.01 -0.78 -5.02 120.40 120.12 2dhg s VAL 107 Ca 0.28 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 61.30 2dhg s VAL 107 Cb 0.20 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 2dhg s VAL 107 CO 0.32 0.22 0.15 -0.90 0.00 0.00 0.00 175.10 174.89 2dhg n ASP 108 N 1.01 0.97 -0.21 3.32 5.75 -1.26 -4.85 116.55 121.27 2dhg n ASP 108 Ca -0.14 -3.01 -0.02 0.00 -0.01 0.00 0.00 54.79 51.62 2dhg n ASP 108 Cb 0.52 1.03 0.20 0.00 -1.03 0.00 0.00 41.12 41.84 2dhg n ASP 108 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 2dhg h ASP 109 N 1.55 0.88 -0.50 -1.12 2.03 -1.90 -1.94 116.42 115.42 2dhg h ASP 109 Ca -0.28 -0.08 0.15 0.00 -0.73 0.00 0.00 57.03 56.08 2dhg h ASP 109 Cb 1.12 -0.23 -0.02 0.00 -0.83 0.00 0.00 39.33 39.38 2dhg h ASP 109 CO 0.45 0.73 0.47 1.23 -1.03 0.00 0.00 179.24 181.08 2dhg h GLY 110 N 1.04 0.00 0.41 7.15 0.00 -1.97 -1.27 103.07 108.43 2dhg h GLY 110 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 47.21 2dhg h GLY 110 CO -0.04 0.00 -2.16 1.03 0.00 0.00 0.00 176.54 175.38 2dhg n MET 111 N -3.88 0.72 0.04 4.80 2.81 -0.79 -3.67 117.12 117.15 2dhg n MET 111 Ca 0.09 0.22 0.17 0.00 -1.81 0.00 0.00 57.70 56.37 2dhg n MET 111 Cb 0.68 -1.64 0.66 0.00 -0.71 0.00 0.00 33.22 32.20 2dhg n MET 111 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2dhg h LEU 112 N 0.04 0.04 0.04 4.03 5.85 -0.66 0.37 115.31 125.03 2dhg h LEU 112 Ca -0.47 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 2dhg h LEU 112 Cb 1.99 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 43.02 2dhg h LEU 112 CO 0.03 0.02 -0.02 0.22 -0.34 0.00 0.00 178.44 178.35 2dhg h TYR 113 N 0.04 -0.05 -0.87 1.25 3.20 -1.49 -3.24 116.97 115.81 2dhg h TYR 113 Ca 0.21 -0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.24 2dhg h TYR 113 Cb 0.77 0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.99 2dhg h TYR 113 CO -0.00 -0.03 0.57 0.93 -1.64 0.00 0.00 178.16 177.99 2dhg h GLU 114 N -0.63 0.57 -0.53 1.82 5.08 -1.60 0.43 114.58 119.72 2dhg h GLU 114 Ca -0.01 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 2dhg h GLU 114 Cb 0.04 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 2dhg h GLU 114 CO 0.01 0.38 0.36 0.35 -1.00 0.00 0.00 179.01 179.10 2dhg h PHE 115 N 0.59 0.52 0.00 4.33 3.57 -0.39 -2.21 116.94 123.34 2dhg h PHE 115 Ca 0.44 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.96 2dhg h PHE 115 Cb 0.85 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.41 2dhg h PHE 115 CO -0.00 0.28 -0.55 1.19 -2.23 0.00 0.00 178.31 177.00 2dhg n PHE 116 N -4.47 0.33 -0.31 0.41 3.72 0.34 -4.14 117.46 113.34 2dhg n PHE 116 Ca 0.07 0.14 0.32 0.00 -0.05 0.00 0.00 57.45 57.93 2dhg n PHE 116 Cb 0.22 -0.49 0.49 0.00 -0.94 0.00 0.00 39.48 38.75 2dhg n PHE 116 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2dhg n VAL 117 N -3.95 0.00 0.20 -4.37 3.14 0.13 0.12 118.33 113.60 2dhg n VAL 117 Ca -0.08 1.22 -0.09 0.00 -2.96 0.00 0.00 64.34 62.43 2dhg n VAL 117 Cb 0.29 -2.14 -0.04 0.00 -1.06 0.00 0.00 33.84 30.89 2dhg n VAL 117 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 2dhg h LYS 118 N 0.00 -0.55 0.00 1.45 3.64 -1.58 -3.21 116.57 116.32 2dhg h LYS 118 Ca 0.56 0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.93 2dhg h LYS 118 Cb 2.92 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 34.85 2dhg h LYS 118 CO -0.01 -0.36 -0.22 -0.24 -2.27 0.00 0.00 179.45 176.35 2dhg h VAL 119 N -1.08 0.74 -3.22 2.00 3.04 -0.48 -3.40 116.25 113.85 2dhg h VAL 119 Ca -0.06 -0.92 -0.48 0.00 -1.01 0.00 0.00 66.70 64.23 2dhg h VAL 119 Cb 0.44 1.57 -0.40 0.00 -2.01 0.00 0.00 31.29 30.89 2dhg h VAL 119 CO 0.10 0.22 -0.76 -0.31 -1.01 0.00 0.00 177.57 175.80 2dhg s TYR 120 N -4.01 0.75 -2.00 3.17 2.02 0.81 -4.99 117.35 113.09 2dhg s TYR 120 Ca -0.02 -0.57 0.11 0.00 -0.37 0.00 0.00 57.07 56.22 2dhg s TYR 120 Cb 0.12 -0.89 0.67 0.00 -0.40 0.00 0.00 41.96 41.46 2dhg s TYR 120 CO 0.64 -0.52 1.10 -0.35 -1.57 0.00 0.00 175.55 174.85 2dhg n PRO 121 N 5.13 0.49 -0.98 -1.71 -0.04 -1.21 -2.64 135.00 134.04 2dhg n PRO 121 Ca -0.08 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.27 2dhg n PRO 121 Cb 0.48 -1.36 0.22 0.00 -0.04 0.00 0.00 33.50 32.80 2dhg n PRO 121 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dhg n SER 122 N -0.86 3.54 -4.67 3.54 7.64 -1.26 -4.96 113.62 116.59 2dhg n SER 122 Ca 0.08 -3.54 -0.40 0.00 1.01 0.00 0.00 58.87 56.02 2dhg n SER 122 Cb 0.04 -0.73 -0.06 0.00 -1.01 0.00 0.00 64.21 62.45 2dhg n SER 122 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dhg h ARG 124 N 7.33 0.42 0.00 0.00 3.08 -0.99 -3.46 114.38 120.76 2dhg h ARG 124 Ca -0.33 -0.65 0.00 0.00 0.07 0.00 0.00 59.98 59.07 2dhg h ARG 124 Cb 1.15 0.23 0.00 0.00 0.08 0.00 0.00 29.97 31.44 2dhg h ARG 124 CO 0.77 1.30 0.00 0.41 -1.07 0.00 0.00 179.97 181.38 2dhg n GLY 125 N 1.57 2.10 3.41 0.04 0.00 -1.22 -4.95 105.19 106.14 2dhg n GLY 125 Ca -0.14 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 2dhg n GLY 125 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dhg s GLY 126 N 0.00 1.51 -0.05 -0.02 0.00 -1.26 -0.54 107.32 106.97 2dhg s GLY 126 Ca 0.00 -0.94 0.03 0.00 0.00 0.00 0.00 44.72 43.80 2dhg s GLY 126 CO 0.00 -0.49 -0.11 1.25 0.00 0.00 0.00 173.10 173.75 2dhg s LYS 127 N -0.17 1.37 -0.11 2.90 2.47 -0.66 -4.61 119.74 120.92 2dhg s LYS 127 Ca -0.01 -0.37 0.03 0.00 -1.56 0.00 0.00 55.97 54.06 2dhg s LYS 127 Cb -0.13 -1.19 -0.00 0.00 -1.46 0.00 0.00 37.83 35.04 2dhg s LYS 127 CO 0.03 0.08 -0.20 0.54 0.16 0.00 0.00 175.35 175.96 2dhg s VAL 128 N 0.44 2.38 0.39 4.02 0.11 -1.26 -1.03 120.40 125.45 2dhg s VAL 128 Ca -0.09 -0.90 -0.25 0.00 -2.93 0.00 0.00 61.98 57.81 2dhg s VAL 128 Cb -0.13 -1.94 -0.09 0.00 -1.53 0.00 0.00 36.38 32.69 2dhg s VAL 128 CO 0.02 0.55 1.09 0.68 -3.33 0.00 0.00 175.10 174.10 2dhg s VAL 129 N 0.37 3.53 0.27 2.04 -7.23 -0.96 -4.89 120.40 113.53 2dhg s VAL 129 Ca -0.16 1.23 0.09 0.00 -1.81 0.00 0.00 61.98 61.33 2dhg s VAL 129 Cb -0.17 -3.66 -0.05 0.00 0.56 0.00 0.00 36.38 33.05 2dhg s VAL 129 CO 0.07 0.06 -0.12 -0.76 -0.31 0.00 0.00 175.10 174.05 2dhg s LEU 130 N -2.51 2.56 0.00 1.32 1.43 -1.26 -2.21 118.68 118.02 2dhg s LEU 130 Ca 0.57 -1.10 0.01 0.00 -1.03 0.00 0.00 54.13 52.57 2dhg s LEU 130 Cb -0.25 -0.80 0.12 0.00 0.03 0.00 0.00 46.19 45.28 2dhg s LEU 130 CO 0.32 -0.19 0.83 0.47 0.23 0.00 0.00 176.35 178.01 2dhg n ASP 131 N -0.56 1.23 -0.38 2.29 8.00 0.10 -4.74 116.55 122.49 2dhg n ASP 131 Ca -0.06 -2.01 -0.10 0.00 0.71 0.00 0.00 54.79 53.33 2dhg n ASP 131 Cb 0.62 -0.53 -0.08 0.00 -0.02 0.00 0.00 41.12 41.11 2dhg n ASP 131 CO 0.00 0.00 0.00 0.06 -0.39 0.00 0.00 177.20 176.87 2dhg h GLN 132 N 0.00 -0.05 -0.07 -1.24 3.07 -2.02 0.78 115.11 115.59 2dhg h GLN 132 Ca -0.28 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.44 2dhg h GLN 132 Cb 1.04 0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.61 2dhg h GLN 132 CO 0.31 -0.03 -0.07 0.00 0.09 0.00 0.00 178.83 179.12 2dhg h THR 133 N -0.05 1.10 0.00 1.86 1.03 -2.05 -3.46 112.91 111.34 2dhg h THR 133 Ca 0.18 -0.43 0.00 0.00 -0.01 0.00 0.00 66.41 66.15 2dhg h THR 133 Cb 0.46 1.13 0.00 0.00 -1.07 0.00 0.00 68.15 68.67 2dhg h THR 133 CO -0.90 0.13 0.00 0.61 -0.01 0.00 0.00 175.52 175.35 2dhg n GLY 134 N -1.18 0.94 3.76 2.99 0.00 0.27 -5.11 105.19 106.87 2dhg n GLY 134 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2dhg n GLY 134 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dhg s VAL 135 N -2.00 3.41 -0.31 1.61 -7.23 -1.26 -4.37 120.40 110.26 2dhg s VAL 135 Ca 0.00 1.36 -0.37 0.00 -1.81 0.00 0.00 61.98 61.16 2dhg s VAL 135 Cb 0.00 -3.84 -0.13 0.00 0.56 0.00 0.00 36.38 32.97 2dhg s VAL 135 CO 0.00 0.27 2.04 -0.24 -0.31 0.00 0.00 175.10 176.86 2dhg n SER 136 N 0.90 2.31 0.16 4.85 2.88 -1.26 -0.72 113.62 122.73 2dhg n SER 136 Ca 0.00 0.66 0.10 0.00 -1.33 0.00 0.00 58.87 58.31 2dhg n SER 136 Cb 0.45 -1.23 0.61 0.00 -0.75 0.00 0.00 64.21 63.30 2dhg n SER 136 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2dhg h LYS 137 N 10.53 0.09 0.00 -1.46 1.57 -1.73 -3.43 116.57 122.14 2dhg h LYS 137 Ca -0.34 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2dhg h LYS 137 Cb 1.32 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.61 2dhg h LYS 137 CO 1.00 0.06 0.00 0.41 -0.57 0.00 0.00 179.45 180.35 2dhg n GLY 138 N -1.55 1.85 3.74 3.86 0.00 -1.25 -4.94 105.19 106.89 2dhg n GLY 138 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 2dhg n GLY 138 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dhg s TYR 139 N -1.99 -0.22 0.00 1.61 -0.85 -1.26 0.59 117.35 115.23 2dhg s TYR 139 Ca 0.00 -0.12 0.00 0.00 -0.52 0.00 0.00 57.07 56.43 2dhg s TYR 139 Cb 0.00 0.65 0.00 0.00 0.38 0.00 0.00 41.96 42.99 2dhg s TYR 139 CO 0.00 -0.97 0.00 0.41 -1.52 0.00 0.00 175.55 173.47 2dhg n GLY 140 N -0.44 1.53 3.38 5.49 0.00 0.64 -2.26 105.19 113.53 2dhg n GLY 140 Ca -0.07 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 2dhg n GLY 140 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dhg s PHE 141 N -3.05 -0.53 0.52 1.61 0.08 -0.19 -1.10 117.98 115.31 2dhg s PHE 141 Ca 0.00 1.29 0.06 0.00 0.12 0.00 0.00 56.93 58.39 2dhg s PHE 141 Cb 0.00 0.18 0.02 0.00 -0.57 0.00 0.00 43.02 42.65 2dhg s PHE 141 CO 0.00 -0.25 0.35 0.14 -0.10 0.00 0.00 175.22 175.35 2dhg s VAL 142 N 0.26 1.78 0.10 -0.44 -7.23 -0.57 -1.65 120.40 112.66 2dhg s VAL 142 Ca -0.00 -1.54 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 2dhg s VAL 142 Cb -0.03 -2.32 -0.04 0.00 0.56 0.00 0.00 36.38 34.55 2dhg s VAL 142 CO 0.01 0.00 -0.09 -0.54 -0.31 0.00 0.00 175.10 174.16 2dhg s LYS 143 N -4.20 0.87 0.02 4.82 1.02 0.30 -2.21 119.74 120.36 2dhg s LYS 143 Ca 0.34 -1.22 -0.13 0.00 0.02 0.00 0.00 55.97 54.98 2dhg s LYS 143 Cb -0.01 -0.48 0.02 0.00 -0.52 0.00 0.00 37.83 36.83 2dhg s LYS 143 CO 0.21 0.06 0.27 -0.06 -0.92 0.00 0.00 175.35 174.90 2dhg s PHE 144 N -2.75 -0.08 -0.12 3.18 0.08 -0.07 -0.38 117.98 117.84 2dhg s PHE 144 Ca 0.08 0.01 0.19 0.00 0.12 0.00 0.00 56.93 57.33 2dhg s PHE 144 Cb -0.01 0.05 -0.22 0.00 -0.57 0.00 0.00 43.02 42.27 2dhg s PHE 144 CO -0.01 -0.42 0.51 0.25 -0.10 0.00 0.00 175.22 175.45 2dhg n THR 145 N 0.94 0.86 -3.87 0.64 -2.24 0.85 -3.97 114.28 107.49 2dhg n THR 145 Ca -0.20 -0.68 -0.35 0.00 -2.27 0.00 0.00 64.05 60.56 2dhg n THR 145 Cb 0.58 -0.41 -0.13 0.00 -2.10 0.00 0.00 70.33 68.26 2dhg n THR 145 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dhg s ASP 146 N -5.29 5.03 0.23 3.42 -1.08 -1.25 -4.98 116.67 112.75 2dhg s ASP 146 Ca -0.06 -1.79 -0.08 0.00 -0.52 0.00 0.00 52.55 50.10 2dhg s ASP 146 Cb 0.10 -1.75 0.39 0.00 -1.46 0.00 0.00 42.92 40.20 2dhg s ASP 146 CO 0.85 -0.41 1.66 -0.08 0.52 0.00 0.00 175.17 177.71 2dhg h GLU 147 N 7.95 0.16 -0.98 4.34 4.22 -1.94 -0.09 114.58 128.23 2dhg h GLU 147 Ca -0.14 -0.01 0.32 0.00 0.08 0.00 0.00 59.36 59.61 2dhg h GLU 147 Cb 1.05 -0.04 -0.18 0.00 0.50 0.00 0.00 28.75 30.08 2dhg h GLU 147 CO 0.61 0.10 0.19 1.28 -2.18 0.00 0.00 179.01 179.01 2dhg n LEU 148 N -5.26 0.04 -0.05 1.64 4.77 -1.26 0.12 117.00 117.00 2dhg n LEU 148 Ca 0.12 1.66 -0.16 0.00 -0.03 0.00 0.00 56.01 57.60 2dhg n LEU 148 Cb 0.42 -0.67 -0.06 0.00 -2.33 0.00 0.00 43.42 40.78 2dhg n LEU 148 CO 0.10 -1.74 0.35 -0.33 -1.33 0.00 0.00 177.39 174.44 2dhg h GLU 149 N 0.00 0.79 -0.91 3.23 4.39 -1.43 -3.06 114.58 117.60 2dhg h GLU 149 Ca 0.68 -0.58 0.08 0.00 0.34 0.00 0.00 59.36 59.88 2dhg h GLU 149 Cb 1.56 0.10 -0.11 0.00 -0.10 0.00 0.00 28.75 30.20 2dhg h GLU 149 CO -0.87 1.20 -0.55 0.37 -1.16 0.00 0.00 179.01 177.99 2dhg h GLN 150 N 0.53 -0.02 -0.44 2.33 4.15 0.11 0.14 115.11 121.90 2dhg h GLN 150 Ca -0.02 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 2dhg h GLN 150 Cb 1.26 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.93 2dhg h GLN 150 CO 0.14 -0.01 0.21 0.87 -1.93 0.00 0.00 178.83 178.10 2dhg h LYS 151 N -0.02 0.64 -0.90 1.69 1.57 -1.60 -2.55 116.57 115.41 2dhg h LYS 151 Ca 0.15 -0.10 0.22 0.00 -1.87 0.00 0.00 60.65 59.05 2dhg h LYS 151 Cb 0.40 -0.11 -0.12 0.00 0.08 0.00 0.00 32.23 32.47 2dhg h LYS 151 CO -0.86 0.56 0.40 0.00 -0.57 0.00 0.00 179.45 178.97 2dhg h ARG 152 N 0.58 0.39 -0.21 3.15 3.08 -0.74 -0.03 114.38 120.60 2dhg h ARG 152 Ca 0.15 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 2dhg h ARG 152 Cb 0.13 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 2dhg h ARG 152 CO -0.02 0.26 -0.15 0.00 -1.07 0.00 0.00 179.97 178.99 2dhg h ALA 153 N 1.71 0.30 -0.98 0.04 0.00 -0.55 0.25 119.26 120.03 2dhg h ALA 153 Ca 0.56 -0.33 0.32 0.00 0.00 0.00 0.00 54.91 55.47 2dhg h ALA 153 Cb 1.06 -0.07 -0.16 0.00 0.00 0.00 0.00 17.79 18.63 2dhg h ALA 153 CO -0.53 0.19 0.46 -0.07 0.00 0.00 0.00 179.25 179.30 2dhg h LEU 154 N 0.15 0.30 0.08 0.00 3.38 -0.60 1.56 115.31 120.18 2dhg h LEU 154 Ca 0.04 0.21 -0.36 0.00 0.09 0.00 0.00 57.88 57.87 2dhg h LEU 154 Cb 0.68 0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2dhg h LEU 154 CO 0.04 -0.22 -2.02 1.07 0.09 0.00 0.00 178.44 177.40 2dhg n THR 155 N -5.16 1.69 0.16 0.22 5.66 -1.06 -3.25 114.28 112.53 2dhg n THR 155 Ca 0.30 -0.55 -0.07 0.00 -3.05 0.00 0.00 64.05 60.68 2dhg n THR 155 Cb 0.98 -1.72 -0.03 0.00 -1.55 0.00 0.00 70.33 68.00 2dhg n THR 155 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2dhg h GLU 156 N -0.12 -0.42 0.00 1.09 4.39 0.71 -3.16 114.58 117.08 2dhg h GLU 156 Ca -0.46 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2dhg h GLU 156 Cb 1.90 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.65 2dhg h GLU 156 CO -0.00 -0.28 0.00 0.00 -1.16 0.00 0.00 179.01 177.57 2dhg n GLN 158 N -1.02 0.52 -2.95 0.00 -0.06 -0.88 0.35 117.38 113.34 2dhg n GLN 158 Ca 0.13 0.19 -0.21 0.00 -2.00 0.00 0.00 57.00 55.11 2dhg n GLN 158 Cb 0.06 -1.75 0.01 0.00 -4.06 0.00 0.00 30.24 24.50 2dhg n GLN 158 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2dhg n GLY 159 N 2.01 -0.51 3.60 1.69 0.00 -0.39 -4.81 105.19 106.78 2dhg n GLY 159 Ca 0.19 0.08 -0.55 0.00 0.00 0.00 0.00 46.02 45.74 2dhg n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dhg n ALA 160 N -3.14 0.26 -0.05 4.61 0.00 0.15 -4.13 120.51 118.21 2dhg n ALA 160 Ca -0.11 0.24 -0.11 0.00 0.00 0.00 0.00 53.44 53.47 2dhg n ALA 160 Cb 0.60 -2.32 -0.15 0.00 0.00 0.00 0.00 19.45 17.59 2dhg n ALA 160 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dhg n VAL 161 N 5.49 1.55 -0.40 0.00 0.31 -1.26 -1.29 118.33 122.72 2dhg n VAL 161 Ca 0.32 -0.79 0.37 0.00 -0.01 0.00 0.00 64.34 64.23 2dhg n VAL 161 Cb 0.15 -0.93 0.72 0.00 -0.91 0.00 0.00 33.84 32.86 2dhg n VAL 161 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2dhg h GLY 162 N 3.38 0.33 -6.89 2.92 0.00 -1.90 -3.36 103.07 97.55 2dhg h GLY 162 Ca -0.40 -0.04 -0.63 0.00 0.00 0.00 0.00 47.33 46.26 2dhg h GLY 162 CO 0.06 -0.06 0.10 -2.27 0.00 0.00 0.00 176.54 174.36 2dhg s LEU 163 N -8.59 4.23 0.42 3.11 2.96 -1.26 -4.91 118.68 114.64 2dhg s LEU 163 Ca -0.06 0.20 0.00 0.00 -0.22 0.00 0.00 54.13 54.05 2dhg s LEU 163 Cb 0.25 -2.74 0.00 0.00 0.50 0.00 0.00 46.19 44.19 2dhg s LEU 163 CO 0.82 -0.52 0.00 0.61 -1.32 0.00 0.00 176.35 175.94 2dhg n GLY 164 N 4.62 -3.16 0.32 7.98 0.00 -1.26 -4.31 105.19 109.39 2dhg n GLY 164 Ca -0.02 -1.18 0.21 0.00 0.00 0.00 0.00 46.02 45.04 2dhg n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dhg h SER 165 N -0.95 0.00 -3.02 1.61 0.02 -1.91 -3.42 113.55 105.88 2dhg h SER 165 Ca -0.14 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 60.20 2dhg h SER 165 Cb 0.93 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.35 2dhg h SER 165 CO 0.05 0.00 -0.67 -0.54 -1.14 0.00 0.00 176.83 174.53 2dhg s LYS 166 N -4.03 2.36 1.06 3.45 1.02 -1.26 -5.08 119.74 117.26 2dhg s LYS 166 Ca -0.04 -1.08 -0.14 0.00 0.02 0.00 0.00 55.97 54.73 2dhg s LYS 166 Cb 0.12 -2.36 0.22 0.00 -0.52 0.00 0.00 37.83 35.29 2dhg s LYS 166 CO 0.42 0.47 1.10 -1.25 -0.92 0.00 0.00 175.35 175.17 2dhg s PRO 167 N -2.77 -0.05 -0.10 -1.68 0.04 -1.26 -4.73 135.00 124.45 2dhg s PRO 167 Ca 0.26 0.35 0.01 0.00 0.04 0.00 0.00 61.00 61.67 2dhg s PRO 167 Cb -0.10 -1.70 0.02 0.00 0.04 0.00 0.00 34.50 32.76 2dhg s PRO 167 CO 0.18 -3.02 -0.12 0.14 0.04 0.00 0.00 177.00 174.21 2dhg s VAL 168 N -2.98 1.29 -0.42 -0.36 -7.23 -0.41 -4.42 120.40 105.86 2dhg s VAL 168 Ca 0.67 -0.51 -0.24 0.00 -1.81 0.00 0.00 61.98 60.09 2dhg s VAL 168 Cb -0.17 -1.20 0.02 0.00 0.56 0.00 0.00 36.38 35.59 2dhg s VAL 168 CO 0.57 0.40 0.85 -0.60 -0.31 0.00 0.00 175.10 176.02 2dhg s ARG 169 N 1.10 3.59 0.11 4.82 3.52 -1.22 -1.26 118.95 129.61 2dhg s ARG 169 Ca -0.05 0.18 -0.22 0.00 -0.13 0.00 0.00 55.73 55.51 2dhg s ARG 169 Cb -0.14 -3.88 -0.07 0.00 -1.56 0.00 0.00 34.95 29.29 2dhg s ARG 169 CO -0.02 -1.07 0.65 -0.51 -0.81 0.00 0.00 175.30 173.54 2dhg s LEU 170 N 3.43 4.56 0.35 -0.88 1.43 -1.25 -3.04 118.68 123.29 2dhg s LEU 170 Ca 0.34 1.42 -0.08 0.00 -1.03 0.00 0.00 54.13 54.78 2dhg s LEU 170 Cb -0.12 -3.06 0.02 0.00 0.03 0.00 0.00 46.19 43.07 2dhg s LEU 170 CO 0.22 0.25 0.59 -0.44 0.23 0.00 0.00 176.35 177.20 2dhg s SER 171 N -1.12 0.53 -0.64 2.29 0.01 -0.67 -4.95 113.70 109.16 2dhg s SER 171 Ca 0.32 -1.33 -0.15 0.00 1.31 0.00 0.00 55.95 56.10 2dhg s SER 171 Cb -0.21 0.73 0.16 0.00 0.21 0.00 0.00 66.02 66.92 2dhg s SER 171 CO 0.22 -1.44 0.59 -0.69 0.41 0.00 0.00 173.24 172.33 2dhg s VAL 172 N -2.83 5.26 0.78 3.43 1.01 -1.26 -1.81 120.40 124.98 2dhg s VAL 172 Ca 0.24 -1.91 -0.11 0.00 0.00 0.00 0.00 61.98 60.20 2dhg s VAL 172 Cb -0.02 -4.33 0.07 0.00 0.00 0.00 0.00 36.38 32.09 2dhg s VAL 172 CO 0.16 -0.92 1.14 0.00 0.00 0.00 0.00 175.10 175.49 2dhg s ALA 173 N 1.02 2.75 -0.08 5.51 0.00 -1.26 -4.93 121.76 124.77 2dhg s ALA 173 Ca 0.09 -0.63 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 2dhg s ALA 173 Cb -0.22 -2.93 0.05 0.00 0.00 0.00 0.00 23.12 20.01 2dhg s ALA 173 CO -0.02 -1.53 0.15 0.42 0.00 0.00 0.00 175.76 174.78 2dhg s ILE 174 N -3.50 -0.23 0.13 0.00 1.01 -1.26 -4.87 121.20 112.47 2dhg s ILE 174 Ca 0.61 0.35 -0.12 0.00 0.00 0.00 0.00 60.65 61.48 2dhg s ILE 174 Cb -0.11 -0.28 -0.06 0.00 0.01 0.00 0.00 42.46 42.02 2dhg s ILE 174 CO 0.49 0.15 1.45 1.55 0.00 0.00 0.00 174.94 178.58 2dhg h PRO 175 N 8.27 0.85 -2.67 2.79 0.13 -1.98 -3.34 132.00 136.06 2dhg h PRO 175 Ca -0.16 -0.45 -0.71 0.00 -0.87 0.00 0.00 66.00 63.81 2dhg h PRO 175 Cb 1.12 0.02 -0.35 0.00 0.13 0.00 0.00 31.00 31.92 2dhg h PRO 175 CO 0.17 1.09 0.12 1.63 -0.23 0.00 0.00 178.00 180.78 2dhg n LYS 176 N -4.14 3.48 0.08 0.86 4.76 -1.26 -4.81 118.16 117.13 2dhg n LYS 176 Ca -0.03 -4.60 -0.11 0.00 -2.87 0.00 0.00 58.31 50.70 2dhg n LYS 176 Cb 0.52 -2.40 -0.04 0.00 -1.84 0.00 0.00 35.03 31.27 2dhg n LYS 176 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dhg h ALA 177 N 4.99 0.42 -1.07 7.82 0.00 -2.01 -3.32 119.26 126.09 2dhg h ALA 177 Ca 0.20 -0.74 -0.77 0.00 0.00 0.00 0.00 54.91 53.59 2dhg h ALA 177 Cb 0.66 -0.05 -0.25 0.00 0.00 0.00 0.00 17.79 18.15 2dhg h ALA 177 CO 1.08 0.89 1.16 -1.13 0.00 0.00 0.00 179.25 181.25 2dhg n SER 178 N -3.67 7.44 -4.17 0.00 3.41 -1.26 -4.87 113.62 110.50 2dhg n SER 178 Ca -0.05 -3.64 -0.44 0.00 -0.26 0.00 0.00 58.87 54.48 2dhg n SER 178 Cb 0.84 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 2dhg n SER 178 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2dhg n ARG 179 N 0.05 3.81 -3.93 4.33 0.63 -1.25 -4.96 116.66 115.34 2dhg n ARG 179 Ca 0.51 -4.19 -0.34 0.00 -0.92 0.00 0.00 57.85 52.90 2dhg n ARG 179 Cb 0.27 -2.71 -0.14 0.00 0.45 0.00 0.00 32.46 30.33 2dhg n ARG 179 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2dhg s VAL 180 N -0.87 2.81 0.07 5.15 1.01 -1.26 -5.09 120.40 122.22 2dhg s VAL 180 Ca 0.35 -1.57 0.03 0.00 0.00 0.00 0.00 61.98 60.78 2dhg s VAL 180 Cb -0.00 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.66 2dhg s VAL 180 CO 0.01 -0.19 -0.09 -0.54 0.00 0.00 0.00 175.10 174.29 2dhg s LYS 181 N 1.19 0.70 0.21 2.72 -0.14 -1.26 -5.13 119.74 118.02 2dhg s LYS 181 Ca -0.03 -0.98 -0.30 0.00 -1.36 0.00 0.00 55.97 53.29 2dhg s LYS 181 Cb -0.20 -0.41 -0.09 0.00 -1.68 0.00 0.00 37.83 35.45 2dhg s LYS 181 CO -0.03 0.07 1.29 -1.25 -0.76 0.00 0.00 175.35 174.67 2dhg s PRO 182 N -2.28 4.40 -0.97 -1.68 0.04 -1.26 -4.91 135.00 128.34 2dhg s PRO 182 Ca -0.01 2.05 -0.24 0.00 0.04 0.00 0.00 61.00 62.83 2dhg s PRO 182 Cb -0.06 -3.19 -0.06 0.00 0.04 0.00 0.00 34.50 31.23 2dhg s PRO 182 CO -0.00 -0.22 1.96 0.08 0.04 0.00 0.00 177.00 178.85 2dhg s VAL 183 N -0.02 3.45 0.40 -0.36 1.01 -1.26 -4.95 120.40 118.67 2dhg s VAL 183 Ca 0.55 -0.48 -0.12 0.00 0.00 0.00 0.00 61.98 61.93 2dhg s VAL 183 Cb -0.36 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 31.84 2dhg s VAL 183 CO 0.39 -0.92 0.79 -1.83 0.00 0.00 0.00 175.10 173.53 2dhg s GLU 184 N 6.96 3.85 0.15 2.72 4.04 -1.26 -5.09 118.70 130.06 2dhg s GLU 184 Ca 0.70 0.57 -0.09 0.00 0.04 0.00 0.00 54.97 56.20 2dhg s GLU 184 Cb -0.05 -2.37 -0.01 0.00 0.02 0.00 0.00 34.13 31.72 2dhg s GLU 184 CO 0.03 -0.02 0.27 -1.54 -1.84 0.00 0.00 175.26 172.15 2dhg s SER 185 N -2.96 0.06 0.03 0.83 1.04 -1.26 -5.17 113.70 106.27 2dhg s SER 185 Ca 0.53 -0.84 -0.05 0.00 0.48 0.00 0.00 55.95 56.06 2dhg s SER 185 Cb -0.10 0.42 -0.05 0.00 0.10 0.00 0.00 66.02 66.39 2dhg s SER 185 CO 0.28 -0.87 0.27 -0.83 0.98 0.00 0.00 173.24 173.08 2dhg s GLY 186 N -2.95 2.23 0.30 7.32 0.00 -1.26 -5.07 107.32 107.89 2dhg s GLY 186 Ca 0.15 -0.62 -0.29 0.00 0.00 0.00 0.00 44.72 43.96 2dhg s GLY 186 CO -0.02 -0.47 1.23 2.56 0.00 0.00 0.00 173.10 176.40 2dhg s PRO 187 N -1.98 4.46 0.03 2.90 0.04 -1.26 -5.05 135.00 134.15 2dhg s PRO 187 Ca 0.30 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.38 2dhg s PRO 187 Cb -0.13 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 2dhg s PRO 187 CO 0.19 -0.04 -0.01 0.45 0.04 0.00 0.00 177.00 177.63 2dhg s SER 188 N -0.59 0.32 0.31 6.66 0.15 -1.26 -5.15 113.70 114.14 2dhg s SER 188 Ca 0.48 -0.69 -0.25 0.00 0.70 0.00 0.00 55.95 56.19 2dhg s SER 188 Cb -0.37 0.16 -0.10 0.00 -1.71 0.00 0.00 66.02 64.01 2dhg s SER 188 CO 0.48 -0.45 0.90 -0.44 1.20 0.00 0.00 173.24 174.93 2dhg s SER 189 N -2.11 7.28 0.00 5.45 0.01 -1.26 -5.34 113.70 117.73 2dhg s SER 189 Ca -0.06 1.76 0.08 0.00 1.31 0.00 0.00 55.95 59.04 2dhg s SER 189 Cb -0.02 -2.55 0.48 0.00 0.21 0.00 0.00 66.02 64.14 2dhg s SER 189 CO -0.05 -0.05 0.94 0.61 0.41 0.00 0.00 173.24 175.09