#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhg s SER 88 N 0.00 5.56 -0.10 1.61 0.01 -1.26 -4.96 113.70 114.56 2dhg s SER 88 Ca 0.00 1.69 0.00 0.00 1.31 0.00 0.00 55.95 58.96 2dhg s SER 88 Cb 0.00 -2.51 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 2dhg s SER 88 CO 0.00 -1.91 -0.11 -0.94 0.41 0.00 0.00 173.24 170.69 2dhg s SER 89 N 7.73 4.25 -0.43 2.44 1.04 -1.26 -5.04 113.70 122.43 2dhg s SER 89 Ca 0.94 -0.21 0.01 0.00 0.48 0.00 0.00 55.95 57.18 2dhg s SER 89 Cb -0.29 -1.37 0.23 0.00 0.10 0.00 0.00 66.02 64.68 2dhg s SER 89 CO 0.34 0.25 0.97 0.61 0.98 0.00 0.00 173.24 176.39 2dhg n GLY 90 N 3.00 -0.96 3.01 7.32 0.00 -1.26 -5.15 105.19 111.15 2dhg n GLY 90 Ca -0.18 0.71 -0.21 0.00 0.00 0.00 0.00 46.02 46.35 2dhg n GLY 90 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhg s SER 91 N 0.01 1.28 0.40 1.61 0.01 -1.26 -5.12 113.70 110.63 2dhg s SER 91 Ca 0.28 -0.20 -0.27 0.00 1.31 0.00 0.00 55.95 57.07 2dhg s SER 91 Cb 0.13 -0.35 -0.10 0.00 0.21 0.00 0.00 66.02 65.91 2dhg s SER 91 CO -0.12 0.07 1.37 -0.24 0.41 0.00 0.00 173.24 174.73 2dhg n SER 92 N 3.30 3.10 -1.80 2.44 2.88 -1.26 -4.34 113.62 117.94 2dhg n SER 92 Ca -0.18 1.16 -0.00 0.00 -1.33 0.00 0.00 58.87 58.51 2dhg n SER 92 Cb 0.54 -1.55 0.00 0.00 -0.75 0.00 0.00 64.21 62.45 2dhg n SER 92 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dhg n GLY 93 N 0.65 -2.67 3.55 0.46 0.00 -1.26 -4.90 105.19 101.03 2dhg n GLY 93 Ca 0.04 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.61 2.61 0.11 1.61 0.04 -1.26 -4.95 135.00 132.55 2dhg s PRO 94 Ca 0.01 0.43 0.03 0.00 0.04 0.00 0.00 61.00 61.51 2dhg s PRO 94 Cb -0.00 -4.52 -0.04 0.00 0.04 0.00 0.00 34.50 29.97 2dhg s PRO 94 CO 0.19 -2.87 -0.08 -2.00 0.04 0.00 0.00 177.00 172.28 2dhg s GLU 95 N 7.04 0.88 -0.48 4.56 2.56 -1.26 -5.12 118.70 126.88 2dhg s GLU 95 Ca 0.68 -1.31 0.03 0.00 0.00 0.00 0.00 54.97 54.37 2dhg s GLU 95 Cb -0.11 -0.38 0.14 0.00 2.00 0.00 0.00 34.13 35.78 2dhg s GLU 95 CO 0.16 0.03 0.26 0.71 -0.56 0.00 0.00 175.26 175.86 2dhg s TYR 96 N -3.25 2.52 -0.09 5.30 2.02 -1.26 -5.08 117.35 117.52 2dhg s TYR 96 Ca 0.11 -2.77 -0.00 0.00 -0.37 0.00 0.00 57.07 54.04 2dhg s TYR 96 Cb 0.03 -2.28 -0.03 0.00 -0.40 0.00 0.00 41.96 39.28 2dhg s TYR 96 CO -0.02 -0.75 -0.06 -1.54 -1.57 0.00 0.00 175.55 171.60 2dhg s SER 97 N -0.01 4.69 0.05 2.29 1.04 -1.26 -1.58 113.70 118.92 2dhg s SER 97 Ca 0.18 -0.04 0.05 0.00 0.48 0.00 0.00 55.95 56.62 2dhg s SER 97 Cb -0.23 -1.31 -0.04 0.00 0.10 0.00 0.00 66.02 64.54 2dhg s SER 97 CO -0.01 0.33 -0.07 -0.76 0.98 0.00 0.00 173.24 173.71 2dhg s LEU 98 N -0.59 3.17 -0.12 2.42 1.43 -0.99 -3.56 118.68 120.44 2dhg s LEU 98 Ca 0.09 -0.22 -0.17 0.00 -1.03 0.00 0.00 54.13 52.80 2dhg s LEU 98 Cb -0.12 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 2dhg s LEU 98 CO 0.02 0.23 0.42 0.12 0.23 0.00 0.00 176.35 177.38 2dhg s PHE 99 N -1.11 3.51 0.10 0.29 5.36 -0.94 -1.53 117.98 123.67 2dhg s PHE 99 Ca 0.20 0.82 0.09 0.00 -0.96 0.00 0.00 56.93 57.07 2dhg s PHE 99 Cb -0.11 -2.48 -0.03 0.00 -0.34 0.00 0.00 43.02 40.06 2dhg s PHE 99 CO 0.11 0.22 -0.23 0.14 -1.46 0.00 0.00 175.22 174.00 2dhg s VAL 100 N 0.46 1.86 0.00 3.12 -7.23 0.23 -1.93 120.40 116.91 2dhg s VAL 100 Ca 0.23 -1.56 0.00 0.00 -1.81 0.00 0.00 61.98 58.84 2dhg s VAL 100 Cb -0.15 -1.67 0.00 0.00 0.56 0.00 0.00 36.38 35.12 2dhg s VAL 100 CO 0.09 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 2dhg n GLY 101 N 1.14 4.34 4.20 2.32 0.00 -1.15 -0.48 105.19 115.56 2dhg n GLY 101 Ca -0.19 -1.63 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 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 -2.21 -0.55 -4.32 1.61 8.00 0.63 -3.75 116.55 115.97 2dhg n ASP 102 Ca 0.00 -1.24 -0.45 0.00 0.71 0.00 0.00 54.79 53.81 2dhg n ASP 102 Cb 0.00 -1.84 -0.06 0.00 -0.02 0.00 0.00 41.12 39.19 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 -7.33 5.94 0.56 0.64 1.43 0.13 -4.27 118.68 115.78 2dhg s LEU 103 Ca 0.13 -1.67 -0.18 0.00 -1.03 0.00 0.00 54.13 51.38 2dhg s LEU 103 Cb -0.07 -2.17 -0.10 0.00 0.03 0.00 0.00 46.19 43.88 2dhg s LEU 103 CO 0.98 -0.77 0.37 0.35 0.23 0.00 0.00 176.35 177.50 2dhg n THR 104 N 5.19 1.72 0.98 5.49 -2.24 -1.26 -3.90 114.28 120.25 2dhg n THR 104 Ca -0.13 -0.50 0.05 0.00 -2.27 0.00 0.00 64.05 61.21 2dhg n THR 104 Cb 0.41 -0.52 0.32 0.00 -2.10 0.00 0.00 70.33 68.44 2dhg n THR 104 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2dhg n PRO 105 N 0.30 0.49 0.00 -0.78 -0.04 -1.26 -1.91 135.00 131.80 2dhg n PRO 105 Ca 0.11 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.68 2dhg n PRO 105 Cb 0.47 -1.34 0.08 0.00 -0.04 0.00 0.00 33.50 32.67 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 -0.84 2.80 -4.61 3.54 8.00 -1.26 -4.75 116.55 119.43 2dhg n ASP 106 Ca 0.08 -1.90 -0.34 0.00 0.71 0.00 0.00 54.79 53.34 2dhg n ASP 106 Cb 0.04 0.07 -0.11 0.00 -0.02 0.00 0.00 41.12 41.11 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 4.11 0.48 2.53 1.01 -0.80 -5.04 120.40 120.66 2dhg s VAL 107 Ca 0.26 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.96 2dhg s VAL 107 Cb 0.19 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 2dhg s VAL 107 CO 0.33 0.56 0.04 1.51 0.00 0.00 0.00 175.10 177.55 2dhg s ASP 108 N -0.44 4.12 0.36 3.32 1.47 -1.26 -4.88 116.67 119.36 2dhg s ASP 108 Ca 0.07 -1.52 0.05 0.00 1.18 0.00 0.00 52.55 52.33 2dhg s ASP 108 Cb -0.12 0.22 0.72 0.00 -0.34 0.00 0.00 42.92 43.40 2dhg s ASP 108 CO 0.02 -0.75 1.98 -2.24 0.68 0.00 0.00 175.17 174.86 2dhg h ASP 109 N 1.42 0.67 -0.78 2.11 3.04 -1.90 -1.56 116.42 119.42 2dhg h ASP 109 Ca -0.43 -0.00 0.17 0.00 -3.24 0.00 0.00 57.03 53.52 2dhg h ASP 109 Cb 1.29 -0.15 -0.05 0.00 -1.04 0.00 0.00 39.33 39.38 2dhg h ASP 109 CO 0.75 0.45 0.52 1.23 -2.04 0.00 0.00 179.24 180.15 2dhg h GLY 110 N 0.78 0.66 0.00 7.15 0.00 -1.96 -2.14 103.07 107.56 2dhg h GLY 110 Ca 0.29 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.41 2dhg h GLY 110 CO -0.09 0.04 -0.33 -0.33 0.00 0.00 0.00 176.54 175.83 2dhg h MET 111 N 0.37 0.00 -1.24 4.80 2.86 -1.70 -3.23 114.93 116.79 2dhg h MET 111 Ca 0.39 0.00 0.44 0.00 -2.06 0.00 0.00 59.70 58.47 2dhg h MET 111 Cb 0.98 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.49 2dhg h MET 111 CO -0.12 0.50 0.76 1.25 1.06 0.00 0.00 176.91 180.36 2dhg h LEU 112 N -1.00 0.27 0.20 1.22 5.85 -1.21 0.32 115.31 120.96 2dhg h LEU 112 Ca -0.07 0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 2dhg h LEU 112 Cb 0.65 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.86 2dhg h LEU 112 CO -0.04 -0.28 -0.10 0.22 -0.34 0.00 0.00 178.44 177.91 2dhg h TYR 113 N 0.05 -0.25 -0.38 1.25 3.20 -1.52 -3.13 116.97 116.19 2dhg h TYR 113 Ca 0.85 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.79 2dhg h TYR 113 Cb 2.52 0.08 -0.09 0.00 1.54 0.00 0.00 36.73 40.79 2dhg h TYR 113 CO -0.01 -0.16 -0.26 0.93 -1.64 0.00 0.00 178.16 177.02 2dhg h GLU 114 N -0.48 -0.20 -1.36 1.82 5.08 -1.20 0.63 114.58 118.86 2dhg h GLU 114 Ca -0.03 0.01 0.41 0.00 -1.00 0.00 0.00 59.36 58.75 2dhg h GLU 114 Cb 0.21 0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.41 2dhg h GLU 114 CO 0.05 -0.13 0.93 0.35 -1.00 0.00 0.00 179.01 179.21 2dhg h PHE 115 N -0.21 0.31 0.00 4.33 3.57 -0.55 0.71 116.94 125.10 2dhg h PHE 115 Ca 0.18 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2dhg h PHE 115 Cb 0.49 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.15 2dhg h PHE 115 CO -0.48 -0.06 -0.23 1.19 -2.23 0.00 0.00 178.31 176.50 2dhg n PHE 116 N -4.39 0.19 -0.57 0.41 3.72 0.53 -4.10 117.46 113.25 2dhg n PHE 116 Ca 0.33 0.08 0.44 0.00 -0.05 0.00 0.00 57.45 58.25 2dhg n PHE 116 Cb 1.40 -0.32 0.68 0.00 -0.94 0.00 0.00 39.48 40.29 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 -3.08 -0.04 0.33 -4.37 3.14 0.19 0.22 118.33 114.73 2dhg n VAL 117 Ca -0.03 1.31 -0.13 0.00 -2.96 0.00 0.00 64.34 62.53 2dhg n VAL 117 Cb 0.12 -2.18 -0.06 0.00 -1.06 0.00 0.00 33.84 30.65 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 -0.85 -0.18 1.45 3.64 -1.05 -3.11 116.57 116.48 2dhg h LYS 118 Ca 0.79 0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 60.18 2dhg h LYS 118 Cb 3.08 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 35.08 2dhg h LYS 118 CO -0.08 -0.56 -0.13 -0.24 -2.27 0.00 0.00 179.45 176.17 2dhg h VAL 119 N -1.11 1.19 -3.33 2.00 3.04 -0.38 -3.40 116.25 114.27 2dhg h VAL 119 Ca -0.09 -0.85 -0.53 0.00 -1.01 0.00 0.00 66.70 64.22 2dhg h VAL 119 Cb 0.67 1.20 -0.38 0.00 -2.01 0.00 0.00 31.29 30.77 2dhg h VAL 119 CO 0.15 0.27 -0.78 -0.31 -1.01 0.00 0.00 177.57 175.88 2dhg s TYR 120 N -4.72 1.43 -2.00 3.17 2.02 0.37 -4.99 117.35 112.63 2dhg s TYR 120 Ca -0.06 -0.96 0.14 0.00 -0.37 0.00 0.00 57.07 55.82 2dhg s TYR 120 Cb 0.15 -1.19 0.83 0.00 -0.40 0.00 0.00 41.96 41.36 2dhg s TYR 120 CO 0.74 -0.59 1.25 -0.35 -1.57 0.00 0.00 175.55 175.03 2dhg n PRO 121 N 4.94 0.49 -1.17 -1.71 -0.04 -1.18 -2.79 135.00 133.54 2dhg n PRO 121 Ca -0.10 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.15 2dhg n PRO 121 Cb 0.47 -1.45 0.16 0.00 -0.04 0.00 0.00 33.50 32.65 2dhg n PRO 121 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dhg n SER 122 N -0.95 4.07 -4.67 3.54 3.41 -1.26 -4.96 113.62 112.80 2dhg n SER 122 Ca 0.10 -3.69 -0.39 0.00 -0.26 0.00 0.00 58.87 54.63 2dhg n SER 122 Cb 0.05 -0.79 -0.06 0.00 -0.26 0.00 0.00 64.21 63.14 2dhg n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dhg h ARG 124 N 7.36 0.55 0.00 0.00 3.08 -1.21 -3.47 114.38 120.69 2dhg h ARG 124 Ca -0.34 -0.86 0.00 0.00 0.07 0.00 0.00 59.98 58.84 2dhg h ARG 124 Cb 1.16 0.31 0.00 0.00 0.08 0.00 0.00 29.97 31.51 2dhg h ARG 124 CO 0.75 1.41 0.00 0.41 -1.07 0.00 0.00 179.97 181.46 2dhg n GLY 125 N 1.58 3.42 3.89 0.04 0.00 -1.24 -4.98 105.19 107.89 2dhg n GLY 125 Ca -0.15 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 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 2.24 -0.15 -0.02 0.00 -1.26 -2.39 107.32 105.74 2dhg s GLY 126 Ca 0.00 -0.61 -0.03 0.00 0.00 0.00 0.00 44.72 44.07 2dhg s GLY 126 CO 0.00 -0.48 0.06 1.25 0.00 0.00 0.00 173.10 173.93 2dhg s LYS 127 N -2.13 0.31 -0.25 2.90 2.36 -0.26 -4.79 119.74 117.87 2dhg s LYS 127 Ca 0.33 -0.11 -0.07 0.00 -2.55 0.00 0.00 55.97 53.57 2dhg s LYS 127 Cb -0.13 -1.64 -0.02 0.00 -1.05 0.00 0.00 37.83 34.98 2dhg s LYS 127 CO 0.21 -0.57 0.06 0.54 1.55 0.00 0.00 175.35 177.14 2dhg s VAL 128 N 2.03 4.21 0.75 4.02 0.11 -1.26 -0.42 120.40 129.84 2dhg s VAL 128 Ca 0.02 -0.25 -0.14 0.00 -2.93 0.00 0.00 61.98 58.68 2dhg s VAL 128 Cb -0.15 -2.99 0.05 0.00 -1.53 0.00 0.00 36.38 31.76 2dhg s VAL 128 CO -0.07 0.32 1.18 0.68 -3.33 0.00 0.00 175.10 173.87 2dhg s VAL 129 N 1.59 2.48 0.22 2.04 -7.23 -1.06 -4.89 120.40 113.55 2dhg s VAL 129 Ca 0.06 0.22 0.01 0.00 -1.81 0.00 0.00 61.98 60.46 2dhg s VAL 129 Cb -0.15 -2.69 -0.05 0.00 0.56 0.00 0.00 36.38 34.05 2dhg s VAL 129 CO 0.03 -0.15 0.06 -0.76 -0.31 0.00 0.00 175.10 173.97 2dhg s LEU 130 N -5.37 1.81 0.52 1.32 1.43 -1.26 -3.14 118.68 113.99 2dhg s LEU 130 Ca 0.71 -1.30 0.09 0.00 -1.03 0.00 0.00 54.13 52.60 2dhg s LEU 130 Cb -0.26 0.00 0.06 0.00 0.03 0.00 0.00 46.19 46.02 2dhg s LEU 130 CO 0.47 -0.67 0.72 -0.62 0.23 0.00 0.00 176.35 176.48 2dhg s ASP 131 N -3.25 5.28 0.32 2.29 2.15 -0.61 -4.77 116.67 118.08 2dhg s ASP 131 Ca 0.32 -0.67 0.07 0.00 0.43 0.00 0.00 52.55 52.71 2dhg s ASP 131 Cb 0.07 -0.07 0.90 0.00 -0.30 0.00 0.00 42.92 43.52 2dhg s ASP 131 CO 0.10 -1.15 1.62 0.06 -0.17 0.00 0.00 175.17 175.63 2dhg h GLN 132 N 0.32 0.15 0.00 4.34 3.07 -2.02 1.27 115.11 122.23 2dhg h GLN 132 Ca -0.34 -0.01 -0.11 0.00 0.09 0.00 0.00 58.65 58.28 2dhg h GLN 132 Cb 1.29 -0.03 -0.02 0.00 0.08 0.00 0.00 27.48 28.80 2dhg h GLN 132 CO 0.42 0.10 -0.54 1.79 0.09 0.00 0.00 178.83 180.70 2dhg h THR 133 N 0.15 1.23 0.00 1.86 1.35 -2.06 -3.47 112.91 111.98 2dhg h THR 133 Ca 0.65 -1.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 2dhg h THR 133 Cb 1.43 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.94 2dhg h THR 133 CO -0.72 0.53 0.00 0.61 -0.25 0.00 0.00 175.52 175.68 2dhg n GLY 134 N 0.29 1.63 3.74 5.82 0.00 0.44 -5.11 105.19 112.00 2dhg n GLY 134 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 4.89 -0.37 1.61 -7.23 -1.26 -4.68 120.40 111.37 2dhg s VAL 135 Ca 0.00 -0.02 -0.37 0.00 -1.81 0.00 0.00 61.98 59.78 2dhg s VAL 135 Cb 0.00 -3.13 -0.13 0.00 0.56 0.00 0.00 36.38 33.68 2dhg s VAL 135 CO 0.00 0.57 2.16 -0.24 -0.31 0.00 0.00 175.10 177.28 2dhg n SER 136 N 2.47 1.90 -0.07 4.85 2.88 -1.26 -1.57 113.62 122.82 2dhg n SER 136 Ca -0.19 0.49 0.10 0.00 -1.33 0.00 0.00 58.87 57.94 2dhg n SER 136 Cb 0.54 -1.19 0.48 0.00 -0.75 0.00 0.00 64.21 63.28 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 11.57 0.44 0.00 -1.46 1.57 -1.84 -3.42 116.57 123.43 2dhg h LYS 137 Ca -0.25 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2dhg h LYS 137 Cb 1.34 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2dhg h LYS 137 CO 1.03 0.29 0.00 0.41 -0.57 0.00 0.00 179.45 180.61 2dhg n GLY 138 N -1.51 1.10 3.83 3.86 0.00 -1.25 -4.96 105.19 106.26 2dhg n GLY 138 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.27 -0.04 0.00 1.61 -0.85 -1.26 -0.27 117.35 115.27 2dhg s TYR 139 Ca 0.00 -0.46 0.00 0.00 -0.52 0.00 0.00 57.07 56.09 2dhg s TYR 139 Cb 0.00 0.74 0.00 0.00 0.38 0.00 0.00 41.96 43.08 2dhg s TYR 139 CO 0.00 -1.24 0.00 0.41 -1.52 0.00 0.00 175.55 173.20 2dhg n GLY 140 N -0.52 0.89 3.34 5.49 0.00 0.36 -2.56 105.19 112.19 2dhg n GLY 140 Ca -0.06 -0.64 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.18 -0.37 0.38 1.61 0.40 0.44 -0.60 117.98 117.66 2dhg s PHE 141 Ca 0.00 0.68 0.00 0.00 -0.60 0.00 0.00 56.93 57.02 2dhg s PHE 141 Cb 0.00 0.20 0.00 0.00 0.51 0.00 0.00 43.02 43.73 2dhg s PHE 141 CO 0.00 -0.43 0.04 1.33 0.70 0.00 0.00 175.22 176.87 2dhg n VAL 142 N 1.45 0.00 -3.93 -0.44 0.24 -0.58 -1.10 118.33 113.97 2dhg n VAL 142 Ca -0.19 -1.77 -0.09 0.00 -2.04 0.00 0.00 64.34 60.25 2dhg n VAL 142 Cb 0.56 0.29 -0.09 0.00 -1.47 0.00 0.00 33.84 33.14 2dhg n VAL 142 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2dhg s LYS 143 N -3.41 0.67 0.10 7.34 1.02 -1.01 -2.35 119.74 122.10 2dhg s LYS 143 Ca 0.03 -0.89 -0.09 0.00 0.02 0.00 0.00 55.97 55.05 2dhg s LYS 143 Cb -0.00 0.26 -0.00 0.00 -0.52 0.00 0.00 37.83 37.57 2dhg s LYS 143 CO 0.02 -0.18 0.20 -0.06 -0.92 0.00 0.00 175.35 174.41 2dhg s PHE 144 N -3.19 0.19 -0.37 3.18 0.08 -0.62 -0.71 117.98 116.54 2dhg s PHE 144 Ca -0.00 -0.61 0.19 0.00 0.12 0.00 0.00 56.93 56.63 2dhg s PHE 144 Cb 0.02 -0.07 -0.27 0.00 -0.57 0.00 0.00 43.02 42.14 2dhg s PHE 144 CO -0.07 -0.56 0.58 0.25 -0.10 0.00 0.00 175.22 175.31 2dhg n THR 145 N -0.08 0.00 -4.07 0.64 -2.24 0.12 -4.22 114.28 104.44 2dhg n THR 145 Ca -0.14 -0.29 -0.32 0.00 -2.27 0.00 0.00 64.05 61.03 2dhg n THR 145 Cb 0.62 0.42 -0.15 0.00 -2.10 0.00 0.00 70.33 69.13 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 -3.69 4.33 0.24 3.42 -1.08 -1.26 -4.99 116.67 113.63 2dhg s ASP 146 Ca -0.02 -1.34 -0.06 0.00 -0.52 0.00 0.00 52.55 50.62 2dhg s ASP 146 Cb 0.13 -1.53 0.30 0.00 -1.46 0.00 0.00 42.92 40.37 2dhg s ASP 146 CO 0.80 -0.18 1.87 -0.08 0.52 0.00 0.00 175.17 178.10 2dhg h GLU 147 N 7.79 1.00 -0.68 4.34 4.81 -1.96 -1.47 114.58 128.42 2dhg h GLU 147 Ca -0.21 -0.06 0.15 0.00 -0.13 0.00 0.00 59.36 59.11 2dhg h GLU 147 Cb 1.05 -0.23 -0.12 0.00 0.63 0.00 0.00 28.75 30.09 2dhg h GLU 147 CO 0.47 0.66 0.00 -0.07 -0.73 0.00 0.00 179.01 179.35 2dhg h LEU 148 N 1.03 -0.30 -0.13 1.64 3.38 -2.02 -1.39 115.31 117.52 2dhg h LEU 148 Ca 0.36 0.17 -0.11 0.00 0.09 0.00 0.00 57.88 58.39 2dhg h LEU 148 Cb 0.09 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2dhg h LEU 148 CO -0.15 -0.14 -0.35 -0.33 0.09 0.00 0.00 178.44 177.56 2dhg h GLU 149 N 0.11 0.46 -0.74 1.13 3.07 -1.87 -3.20 114.58 113.55 2dhg h GLU 149 Ca 0.36 -0.33 0.08 0.00 -0.50 0.00 0.00 59.36 58.97 2dhg h GLU 149 Cb 0.60 0.05 -0.10 0.00 -0.84 0.00 0.00 28.75 28.47 2dhg h GLU 149 CO -0.58 0.94 -0.40 0.94 -1.40 0.00 0.00 179.01 178.51 2dhg n GLN 150 N -4.35 -0.29 0.00 2.33 7.27 -0.54 0.23 117.38 122.03 2dhg n GLN 150 Ca -0.07 1.13 0.00 0.00 0.07 0.00 0.00 57.00 58.13 2dhg n GLN 150 Cb 0.51 -1.66 0.31 0.00 2.41 0.00 0.00 30.24 31.81 2dhg n GLN 150 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 2dhg h LYS 151 N 0.00 0.52 -0.95 3.69 1.79 -1.60 -2.61 116.57 117.41 2dhg h LYS 151 Ca 0.15 -0.10 0.17 0.00 -2.18 0.00 0.00 60.65 58.69 2dhg h LYS 151 Cb 0.34 -0.08 -0.10 0.00 -1.58 0.00 0.00 32.23 30.80 2dhg h LYS 151 CO -0.71 0.52 0.54 -0.09 -1.08 0.00 0.00 179.45 178.64 2dhg h ARG 152 N 0.50 0.69 -0.14 3.15 9.65 0.29 -1.25 114.38 127.28 2dhg h ARG 152 Ca 0.11 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.85 2dhg h ARG 152 Cb 0.28 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2dhg h ARG 152 CO 0.01 0.46 -0.31 0.00 2.80 0.00 0.00 179.97 182.92 2dhg h ALA 153 N 1.61 0.22 -1.00 2.80 0.00 -0.96 0.50 119.26 122.43 2dhg h ALA 153 Ca 0.53 -0.42 0.22 0.00 0.00 0.00 0.00 54.91 55.24 2dhg h ALA 153 Cb 0.79 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.45 2dhg h ALA 153 CO -0.38 0.26 0.62 -0.07 0.00 0.00 0.00 179.25 179.68 2dhg h LEU 154 N 0.06 0.63 0.07 0.00 3.38 -1.12 1.92 115.31 120.25 2dhg h LEU 154 Ca -0.00 0.09 -0.35 0.00 0.09 0.00 0.00 57.88 57.71 2dhg h LEU 154 Cb 0.92 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.61 2dhg h LEU 154 CO 0.07 0.19 -2.04 1.07 0.09 0.00 0.00 178.44 177.82 2dhg n THR 155 N -4.71 1.67 -0.03 0.22 5.66 -0.79 -3.50 114.28 112.81 2dhg n THR 155 Ca 0.24 -0.69 -0.01 0.00 -3.05 0.00 0.00 64.05 60.54 2dhg n THR 155 Cb 0.69 -1.44 -0.00 0.00 -1.55 0.00 0.00 70.33 68.03 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 0.04 0.00 0.00 1.09 4.39 0.77 -3.33 114.58 117.53 2dhg h GLU 156 Ca -0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2dhg h GLU 156 Cb 2.02 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.67 2dhg h GLU 156 CO 0.05 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.90 2dhg n GLN 158 N -1.41 0.00 -3.88 0.00 -0.06 -0.23 0.87 117.38 112.68 2dhg n GLN 158 Ca 0.01 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.71 2dhg n GLN 158 Cb 0.04 -1.33 0.00 0.00 -4.06 0.00 0.00 30.24 24.90 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 1.56 -0.48 3.64 1.69 0.00 -0.45 -4.82 105.19 106.32 2dhg n GLY 159 Ca 0.19 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 2dhg n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dhg s ALA 160 N -3.20 3.26 -0.03 4.61 0.00 0.25 -4.33 121.76 122.32 2dhg s ALA 160 Ca 0.63 1.14 -0.07 0.00 0.00 0.00 0.00 51.96 53.66 2dhg s ALA 160 Cb -0.33 -3.93 -0.29 0.00 0.00 0.00 0.00 23.12 18.57 2dhg s ALA 160 CO 0.78 -2.03 0.74 0.28 0.00 0.00 0.00 175.76 175.52 2dhg h VAL 161 N 6.20 1.01 -1.07 0.00 2.07 -1.87 -2.66 116.25 119.93 2dhg h VAL 161 Ca -0.47 -2.63 0.39 0.00 0.82 0.00 0.00 66.70 64.81 2dhg h VAL 161 Cb 1.24 2.74 -0.13 0.00 -1.52 0.00 0.00 31.29 33.62 2dhg h VAL 161 CO 0.95 0.83 0.66 0.61 0.02 0.00 0.00 177.57 180.64 2dhg n GLY 162 N 1.78 -0.69 3.59 2.17 0.00 -1.26 -3.86 105.19 106.92 2dhg n GLY 162 Ca -0.21 0.65 -0.42 0.00 0.00 0.00 0.00 46.02 46.04 2dhg n GLY 162 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dhg s LEU 163 N -9.07 4.09 0.48 0.99 2.96 -1.26 -4.86 118.68 112.00 2dhg s LEU 163 Ca -0.07 0.44 0.00 0.00 -0.22 0.00 0.00 54.13 54.28 2dhg s LEU 163 Cb 0.27 -3.10 0.00 0.00 0.50 0.00 0.00 46.19 43.86 2dhg s LEU 163 CO 0.68 -0.76 0.00 0.61 -1.32 0.00 0.00 176.35 175.56 2dhg n GLY 164 N 4.47 -3.72 0.40 7.98 0.00 -1.25 -4.29 105.19 108.78 2dhg n GLY 164 Ca 0.04 -0.98 0.21 0.00 0.00 0.00 0.00 46.02 45.29 2dhg n GLY 164 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2dhg h SER 165 N -0.09 0.00 -2.59 1.61 0.87 -1.89 -3.40 113.55 108.05 2dhg h SER 165 Ca -0.03 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 59.97 2dhg h SER 165 Cb 0.83 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.72 2dhg h SER 165 CO 0.01 0.00 -0.57 -0.54 -0.53 0.00 0.00 176.83 175.20 2dhg s LYS 166 N -4.56 2.84 0.68 2.24 1.02 -1.26 -5.05 119.74 115.65 2dhg s LYS 166 Ca -0.04 -0.95 -0.11 0.00 0.02 0.00 0.00 55.97 54.88 2dhg s LYS 166 Cb 0.15 -2.58 0.17 0.00 -0.52 0.00 0.00 37.83 35.04 2dhg s LYS 166 CO 0.52 0.46 0.60 -0.35 -0.92 0.00 0.00 175.35 175.66 2dhg n PRO 167 N -0.53 -2.20 -3.90 -1.68 -0.04 -1.26 -4.69 135.00 120.70 2dhg n PRO 167 Ca -0.08 -0.97 -0.17 0.00 -0.04 0.00 0.00 63.50 62.24 2dhg n PRO 167 Cb 0.56 -0.91 -0.16 0.00 -0.04 0.00 0.00 33.50 32.95 2dhg n PRO 167 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2dhg s VAL 168 N -2.09 0.16 -0.41 0.52 -7.23 -1.00 -4.41 120.40 105.93 2dhg s VAL 168 Ca 0.39 0.11 -0.23 0.00 -1.81 0.00 0.00 61.98 60.45 2dhg s VAL 168 Cb -0.04 -0.27 0.02 0.00 0.56 0.00 0.00 36.38 36.65 2dhg s VAL 168 CO 0.30 0.15 0.76 -0.13 -0.31 0.00 0.00 175.10 175.88 2dhg s ARG 169 N 1.15 3.54 0.04 4.82 0.52 -1.25 -1.34 118.95 126.42 2dhg s ARG 169 Ca -0.08 0.03 -0.16 0.00 -0.52 0.00 0.00 55.73 55.00 2dhg s ARG 169 Cb -0.13 -3.88 -0.06 0.00 0.52 0.00 0.00 34.95 31.39 2dhg s ARG 169 CO -0.02 -0.99 0.47 -0.51 0.02 0.00 0.00 175.30 174.27 2dhg s LEU 170 N 3.15 4.48 0.00 2.53 1.43 -1.25 -2.93 118.68 126.10 2dhg s LEU 170 Ca 0.29 1.06 -0.08 0.00 -1.03 0.00 0.00 54.13 54.38 2dhg s LEU 170 Cb -0.13 -2.74 0.03 0.00 0.03 0.00 0.00 46.19 43.38 2dhg s LEU 170 CO 0.20 0.29 0.53 -1.20 0.23 0.00 0.00 176.35 176.40 2dhg n SER 171 N 1.69 -1.52 -4.27 2.29 7.64 -0.81 -4.95 113.62 113.69 2dhg n SER 171 Ca -0.12 -2.33 -0.44 0.00 1.01 0.00 0.00 58.87 56.99 2dhg n SER 171 Cb 0.52 2.61 -0.06 0.00 -1.01 0.00 0.00 64.21 66.26 2dhg n SER 171 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2dhg s VAL 172 N -2.46 4.82 0.89 0.44 1.01 -1.26 -2.20 120.40 121.63 2dhg s VAL 172 Ca 0.16 -1.60 -0.14 0.00 0.00 0.00 0.00 61.98 60.40 2dhg s VAL 172 Cb -0.03 -4.11 0.14 0.00 0.00 0.00 0.00 36.38 32.38 2dhg s VAL 172 CO 0.12 -0.83 1.21 0.00 0.00 0.00 0.00 175.10 175.60 2dhg s ALA 173 N 1.51 2.24 -0.04 5.51 0.00 -1.23 -4.91 121.76 124.84 2dhg s ALA 173 Ca 0.04 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 2dhg s ALA 173 Cb -0.28 -2.92 0.03 0.00 0.00 0.00 0.00 23.12 19.95 2dhg s ALA 173 CO 0.02 -2.11 0.08 0.42 0.00 0.00 0.00 175.76 174.16 2dhg s ILE 174 N -3.57 -0.07 -2.00 0.00 1.01 -1.26 -4.88 121.20 110.44 2dhg s ILE 174 Ca 0.66 0.22 0.09 0.00 0.00 0.00 0.00 60.65 61.62 2dhg s ILE 174 Cb -0.10 -0.15 0.25 0.00 0.01 0.00 0.00 42.46 42.47 2dhg s ILE 174 CO 0.51 0.09 0.97 -0.81 0.00 0.00 0.00 174.94 175.70 2dhg n PRO 175 N 4.30 0.48 0.03 2.79 -0.04 -1.26 -3.54 135.00 137.77 2dhg n PRO 175 Ca -0.25 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.21 2dhg n PRO 175 Cb 0.51 -1.28 -0.00 0.00 -0.04 0.00 0.00 33.50 32.68 2dhg n PRO 175 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2dhg n LYS 176 N -0.78 0.00 -3.98 0.54 4.81 -1.26 -5.00 118.16 112.49 2dhg n LYS 176 Ca 0.07 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.17 2dhg n LYS 176 Cb 0.03 -0.50 -0.06 0.00 0.02 0.00 0.00 35.03 34.52 2dhg n LYS 176 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dhg n ALA 177 N -3.35 -1.05 -3.62 3.14 0.00 -1.23 -4.82 120.51 109.57 2dhg n ALA 177 Ca -0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 53.44 53.20 2dhg n ALA 177 Cb 0.15 -2.03 -0.06 0.00 0.00 0.00 0.00 19.45 17.51 2dhg n ALA 177 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2dhg s SER 178 N -2.85 -0.31 -0.85 0.00 1.04 -1.26 -5.10 113.70 104.36 2dhg s SER 178 Ca 0.66 0.51 -0.01 0.00 0.48 0.00 0.00 55.95 57.59 2dhg s SER 178 Cb -0.38 0.48 0.21 0.00 0.10 0.00 0.00 66.02 66.43 2dhg s SER 178 CO 0.81 -0.16 0.72 -0.60 0.98 0.00 0.00 173.24 174.98 2dhg s ARG 179 N -0.29 3.12 0.24 4.02 6.06 -1.26 -5.07 118.95 125.77 2dhg s ARG 179 Ca 0.03 -3.25 -0.13 0.00 -2.50 0.00 0.00 55.73 49.88 2dhg s ARG 179 Cb -0.03 -3.87 -0.08 0.00 0.06 0.00 0.00 34.95 31.03 2dhg s ARG 179 CO -0.06 -1.26 0.62 0.08 -2.50 0.00 0.00 175.30 172.18 2dhg s VAL 180 N -1.29 4.80 -0.13 7.11 1.01 -1.26 -5.09 120.40 125.55 2dhg s VAL 180 Ca 0.26 0.77 -0.10 0.00 0.00 0.00 0.00 61.98 62.91 2dhg s VAL 180 Cb -0.08 -3.66 0.04 0.00 0.00 0.00 0.00 36.38 32.68 2dhg s VAL 180 CO -0.12 -0.01 0.33 -0.75 0.00 0.00 0.00 175.10 174.54 2dhg s LYS 181 N -2.61 0.35 -0.56 2.72 2.20 -1.26 -5.11 119.74 115.48 2dhg s LYS 181 Ca 0.47 0.52 -0.27 0.00 -0.36 0.00 0.00 55.97 56.34 2dhg s LYS 181 Cb -0.12 0.10 -0.02 0.00 -1.51 0.00 0.00 37.83 36.27 2dhg s LYS 181 CO 0.20 -0.09 1.83 -1.25 -0.36 0.00 0.00 175.35 175.68 2dhg s PRO 182 N 0.57 2.79 -0.17 4.03 0.04 -1.26 -4.92 135.00 136.08 2dhg s PRO 182 Ca -0.03 0.76 -0.35 0.00 0.04 0.00 0.00 61.00 61.42 2dhg s PRO 182 Cb -0.05 -4.34 -0.12 0.00 0.04 0.00 0.00 34.50 30.04 2dhg s PRO 182 CO -0.03 -2.54 1.94 0.28 0.04 0.00 0.00 177.00 176.69 2dhg n VAL 183 N 7.24 0.47 -4.29 -0.36 0.31 -1.26 -4.95 118.33 115.48 2dhg n VAL 183 Ca 0.21 -0.15 -0.35 0.00 -0.01 0.00 0.00 64.34 64.04 2dhg n VAL 183 Cb 0.51 -1.81 -0.10 0.00 -0.91 0.00 0.00 33.84 31.54 2dhg n VAL 183 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2dhg s GLU 184 N 4.56 3.32 -0.15 5.55 -1.05 -1.26 -5.09 118.70 124.57 2dhg s GLU 184 Ca 0.97 -0.41 -0.03 0.00 -0.15 0.00 0.00 54.97 55.35 2dhg s GLU 184 Cb -0.74 -2.91 0.05 0.00 -0.44 0.00 0.00 34.13 30.09 2dhg s GLU 184 CO 0.52 0.54 0.06 -1.12 0.95 0.00 0.00 175.26 176.20 2dhg s SER 185 N -0.41 2.32 -0.70 0.83 0.01 -1.26 -5.07 113.70 109.42 2dhg s SER 185 Ca 0.08 -0.55 0.05 0.00 1.31 0.00 0.00 55.95 56.84 2dhg s SER 185 Cb -0.12 -0.38 0.22 0.00 0.21 0.00 0.00 66.02 65.95 2dhg s SER 185 CO 0.02 -0.30 0.69 0.61 0.41 0.00 0.00 173.24 174.67 2dhg n GLY 186 N 5.18 4.52 3.65 3.44 0.00 -1.26 -5.09 105.19 115.63 2dhg n GLY 186 Ca -0.07 -2.70 -0.29 0.00 0.00 0.00 0.00 46.02 42.96 2dhg n GLY 186 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhg s PRO 187 N -2.08 -0.08 -0.16 1.61 0.04 -1.26 -5.07 135.00 128.01 2dhg s PRO 187 Ca 0.33 0.34 -0.05 0.00 0.04 0.00 0.00 61.00 61.67 2dhg s PRO 187 Cb 0.06 -1.69 0.06 0.00 0.04 0.00 0.00 34.50 32.97 2dhg s PRO 187 CO -0.07 -3.03 0.10 0.45 0.04 0.00 0.00 177.00 174.48 2dhg s SER 188 N -3.57 2.12 0.09 6.66 0.15 -1.26 -5.13 113.70 112.77 2dhg s SER 188 Ca 0.67 -0.50 -0.27 0.00 0.70 0.00 0.00 55.95 56.55 2dhg s SER 188 Cb -0.16 -0.18 0.08 0.00 -1.71 0.00 0.00 66.02 64.05 2dhg s SER 188 CO 0.57 -0.34 1.06 -0.94 1.20 0.00 0.00 173.24 174.80 2dhg s SER 189 N 2.16 -0.14 0.00 5.45 1.04 -1.26 -5.38 113.70 115.57 2dhg s SER 189 Ca 0.03 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.15 2dhg s SER 189 Cb -0.16 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.35 2dhg s SER 189 CO -0.09 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.04