#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 -0.24 -1.00 1.61 0.01 -1.26 -4.94 113.70 107.88 2dhg s SER 88 Ca 0.00 -0.62 -0.05 0.00 1.31 0.00 0.00 55.95 56.59 2dhg s SER 88 Cb 0.00 0.67 0.25 0.00 0.21 0.00 0.00 66.02 67.14 2dhg s SER 88 CO 0.00 -1.23 0.94 -0.55 0.41 0.00 0.00 173.24 172.81 2dhg s SER 89 N -2.92 6.63 0.00 2.44 0.15 -1.26 -4.98 113.70 113.76 2dhg s SER 89 Ca 0.13 -3.67 0.00 0.00 0.70 0.00 0.00 55.95 53.11 2dhg s SER 89 Cb -0.04 -2.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.22 2dhg s SER 89 CO 0.05 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.86 2dhg n GLY 90 N 2.50 1.83 0.10 9.45 0.00 -1.26 -4.64 105.19 113.18 2dhg n GLY 90 Ca 0.23 -1.85 -0.21 0.00 0.00 0.00 0.00 46.02 44.19 2dhg n GLY 90 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhg n SER 91 N 0.00 1.86 0.01 1.61 7.64 -1.26 -4.51 113.62 118.97 2dhg n SER 91 Ca 0.00 0.43 -0.13 0.00 1.01 0.00 0.00 58.87 60.19 2dhg n SER 91 Cb 0.00 -0.95 -0.09 0.00 -1.01 0.00 0.00 64.21 62.16 2dhg n SER 91 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2dhg h SER 92 N -1.00 -0.05 0.00 6.43 4.64 -2.02 -3.49 113.55 118.06 2dhg h SER 92 Ca -0.34 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.58 2dhg h SER 92 Cb 1.26 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2dhg h SER 92 CO -0.21 0.38 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 2dhg n GLY 93 N 0.05 0.74 3.74 -0.77 0.00 -1.26 -5.12 105.19 102.57 2dhg n GLY 93 Ca -0.08 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.35 1.64 1.12 1.61 0.04 -1.26 -5.05 135.00 132.76 2dhg s PRO 94 Ca 0.00 0.96 -0.18 0.00 0.04 0.00 0.00 61.00 61.82 2dhg s PRO 94 Cb 0.00 -1.84 0.26 0.00 0.04 0.00 0.00 34.50 32.96 2dhg s PRO 94 CO 0.00 -2.01 1.18 -1.21 0.04 0.00 0.00 177.00 175.00 2dhg s GLU 95 N -4.92 -0.62 -0.27 4.56 8.01 -1.26 -5.01 118.70 119.19 2dhg s GLU 95 Ca 0.63 -0.19 -0.01 0.00 0.01 0.00 0.00 54.97 55.40 2dhg s GLU 95 Cb -0.18 -1.68 0.08 0.00 -4.31 0.00 0.00 34.13 28.05 2dhg s GLU 95 CO 0.57 -3.29 0.07 0.71 0.01 0.00 0.00 175.26 173.32 2dhg s TYR 96 N -3.31 1.52 0.15 1.61 2.02 -1.26 -4.94 117.35 113.14 2dhg s TYR 96 Ca 0.72 -1.45 0.09 0.00 -0.37 0.00 0.00 57.07 56.05 2dhg s TYR 96 Cb -0.08 -1.48 -0.04 0.00 -0.40 0.00 0.00 41.96 39.97 2dhg s TYR 96 CO 0.55 -0.79 -0.19 -1.12 -1.57 0.00 0.00 175.55 172.43 2dhg s SER 97 N 1.68 2.67 0.02 2.29 0.01 -1.26 -0.26 113.70 118.86 2dhg s SER 97 Ca 0.05 -0.83 0.06 0.00 1.31 0.00 0.00 55.95 56.55 2dhg s SER 97 Cb -0.17 -0.16 -0.02 0.00 0.21 0.00 0.00 66.02 65.88 2dhg s SER 97 CO -0.19 -0.01 -0.18 -0.76 0.41 0.00 0.00 173.24 172.51 2dhg s LEU 98 N -2.51 2.12 0.05 2.44 1.43 -0.39 -4.05 118.68 117.78 2dhg s LEU 98 Ca 0.14 -0.44 -0.14 0.00 -1.03 0.00 0.00 54.13 52.66 2dhg s LEU 98 Cb -0.07 -0.86 -0.06 0.00 0.03 0.00 0.00 46.19 45.24 2dhg s LEU 98 CO 0.06 0.15 0.45 0.12 0.23 0.00 0.00 176.35 177.36 2dhg s PHE 99 N -0.68 3.68 0.07 0.29 5.36 -0.88 -0.63 117.98 125.20 2dhg s PHE 99 Ca 0.06 0.99 0.04 0.00 -0.96 0.00 0.00 56.93 57.06 2dhg s PHE 99 Cb -0.08 -2.30 -0.03 0.00 -0.34 0.00 0.00 43.02 40.28 2dhg s PHE 99 CO 0.01 0.57 -0.12 0.14 -1.46 0.00 0.00 175.22 174.35 2dhg s VAL 100 N -1.23 0.98 0.16 3.12 -7.23 0.34 -2.40 120.40 114.13 2dhg s VAL 100 Ca 0.29 -1.32 0.03 0.00 -1.81 0.00 0.00 61.98 59.17 2dhg s VAL 100 Cb -0.16 -1.03 -0.01 0.00 0.56 0.00 0.00 36.38 35.74 2dhg s VAL 100 CO 0.16 -0.31 0.11 0.61 -0.31 0.00 0.00 175.10 175.36 2dhg n GLY 101 N 1.20 3.59 3.93 2.32 0.00 -1.16 -0.93 105.19 114.14 2dhg n GLY 101 Ca -0.21 -1.84 -0.32 0.00 0.00 0.00 0.00 46.02 43.66 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 -2.23 -2.35 -4.45 1.61 8.00 0.44 -3.80 116.55 113.76 2dhg n ASP 102 Ca 0.02 -1.09 -0.41 0.00 0.71 0.00 0.00 54.79 54.01 2dhg n ASP 102 Cb 0.27 -2.76 -0.11 0.00 -0.02 0.00 0.00 41.12 38.50 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 -6.95 4.73 0.57 0.64 1.43 -0.09 -4.35 118.68 114.66 2dhg s LEU 103 Ca 0.23 -0.76 -0.19 0.00 -1.03 0.00 0.00 54.13 52.38 2dhg s LEU 103 Cb -0.10 -2.10 -0.06 0.00 0.03 0.00 0.00 46.19 43.96 2dhg s LEU 103 CO 0.91 -0.35 0.88 0.35 0.23 0.00 0.00 176.35 178.37 2dhg n THR 104 N 5.08 3.26 0.97 5.49 -2.24 -1.26 -3.99 114.28 121.59 2dhg n THR 104 Ca -0.12 -0.50 0.06 0.00 -2.27 0.00 0.00 64.05 61.22 2dhg n THR 104 Cb 0.48 -1.05 0.36 0.00 -2.10 0.00 0.00 70.33 68.02 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 -0.68 0.49 0.01 -0.78 -0.04 -1.26 -1.97 135.00 130.77 2dhg n PRO 105 Ca 0.13 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.70 2dhg n PRO 105 Cb 0.46 -1.39 -0.11 0.00 -0.04 0.00 0.00 33.50 32.42 2dhg n PRO 105 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2dhg n ASP 106 N -0.89 0.35 -4.82 3.54 -0.08 -1.26 -4.71 116.55 108.68 2dhg n ASP 106 Ca 0.09 -0.16 -0.36 0.00 -1.51 0.00 0.00 54.79 52.85 2dhg n ASP 106 Cb 0.04 1.48 -0.06 0.00 2.34 0.00 0.00 41.12 44.92 2dhg n ASP 106 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2dhg s VAL 107 N -3.37 4.67 0.32 5.18 1.01 -0.83 -5.08 120.40 122.30 2dhg s VAL 107 Ca -0.03 1.15 0.03 0.00 0.00 0.00 0.00 61.98 63.13 2dhg s VAL 107 Cb 0.14 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 2dhg s VAL 107 CO 0.87 0.28 0.10 1.51 0.00 0.00 0.00 175.10 177.87 2dhg s ASP 108 N -1.57 1.95 0.23 3.32 -4.77 -1.26 -4.90 116.67 109.67 2dhg s ASP 108 Ca 0.39 -1.46 -0.07 0.00 -3.30 0.00 0.00 52.55 48.11 2dhg s ASP 108 Cb -0.17 0.18 0.41 0.00 -1.09 0.00 0.00 42.92 42.25 2dhg s ASP 108 CO 0.20 -0.75 1.68 -2.24 0.70 0.00 0.00 175.17 174.77 2dhg h ASP 109 N 2.15 -0.04 -0.96 2.11 2.03 -1.92 0.23 116.42 120.02 2dhg h ASP 109 Ca -0.38 0.14 0.28 0.00 -0.73 0.00 0.00 57.03 56.34 2dhg h ASP 109 Cb 1.25 0.20 -0.04 0.00 -0.83 0.00 0.00 39.33 39.92 2dhg h ASP 109 CO 0.62 -0.04 0.75 1.23 -1.03 0.00 0.00 179.24 180.76 2dhg h GLY 110 N 0.24 0.00 0.00 7.15 0.00 -1.96 -1.90 103.07 106.59 2dhg h GLY 110 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 2dhg h GLY 110 CO -0.50 0.00 -0.11 -0.33 0.00 0.00 0.00 176.54 175.60 2dhg h MET 111 N 0.00 0.00 -1.35 4.80 2.86 -0.97 -3.29 114.93 116.99 2dhg h MET 111 Ca 0.46 0.00 0.42 0.00 -2.06 0.00 0.00 59.70 58.52 2dhg h MET 111 Cb 1.95 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 33.52 2dhg h MET 111 CO -0.00 0.00 0.93 -0.11 1.06 0.00 0.00 176.91 178.78 2dhg n LEU 112 N -3.03 0.08 0.14 1.22 7.94 -0.87 -0.10 117.00 122.38 2dhg n LEU 112 Ca -0.02 0.94 -0.06 0.00 -1.11 0.00 0.00 56.01 55.76 2dhg n LEU 112 Cb 0.06 -0.46 -0.03 0.00 0.53 0.00 0.00 43.42 43.52 2dhg n LEU 112 CO 0.02 -0.98 0.29 0.22 -1.11 0.00 0.00 177.39 175.83 2dhg h TYR 113 N 0.00 -0.35 -0.98 1.96 3.20 -1.51 -2.95 116.97 116.34 2dhg h TYR 113 Ca 0.73 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.69 2dhg h TYR 113 Cb 2.65 0.12 -0.08 0.00 1.54 0.00 0.00 36.73 40.96 2dhg h TYR 113 CO -0.00 -0.22 0.63 0.93 -1.64 0.00 0.00 178.16 177.86 2dhg h GLU 114 N -0.60 0.99 -0.72 1.82 5.08 -0.57 0.39 114.58 120.97 2dhg h GLU 114 Ca -0.04 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.41 2dhg h GLU 114 Cb 0.29 -0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.27 2dhg h GLU 114 CO 0.06 0.66 0.49 0.35 -1.00 0.00 0.00 179.01 179.57 2dhg h PHE 115 N 1.02 0.45 0.00 4.33 3.57 -0.78 -1.60 116.94 123.93 2dhg h PHE 115 Ca 0.46 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.98 2dhg h PHE 115 Cb 0.39 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.99 2dhg h PHE 115 CO -0.00 0.18 -0.39 1.19 -2.23 0.00 0.00 178.31 177.06 2dhg n PHE 116 N -4.47 0.23 -0.57 0.41 3.72 -0.16 -4.18 117.46 112.44 2dhg n PHE 116 Ca 0.14 0.10 0.44 0.00 -0.05 0.00 0.00 57.45 58.07 2dhg n PHE 116 Cb 0.52 -0.38 0.68 0.00 -0.94 0.00 0.00 39.48 39.36 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 -3.48 -0.03 0.33 -4.37 3.14 0.12 0.54 118.33 114.59 2dhg n VAL 117 Ca -0.05 1.30 -0.15 0.00 -2.96 0.00 0.00 64.34 62.48 2dhg n VAL 117 Cb 0.20 -2.16 -0.07 0.00 -1.06 0.00 0.00 33.84 30.75 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 -0.84 -0.27 1.45 3.64 -1.48 -3.08 116.57 115.98 2dhg h LYS 118 Ca 0.79 0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 60.17 2dhg h LYS 118 Cb 3.08 0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 35.08 2dhg h LYS 118 CO -0.07 -0.53 -0.08 -0.24 -2.27 0.00 0.00 179.45 176.27 2dhg h VAL 119 N -1.15 1.20 -3.25 2.00 3.04 -0.07 -3.40 116.25 114.62 2dhg h VAL 119 Ca -0.09 -0.86 -0.46 0.00 -1.01 0.00 0.00 66.70 64.28 2dhg h VAL 119 Cb 0.70 1.08 -0.39 0.00 -2.01 0.00 0.00 31.29 30.68 2dhg h VAL 119 CO 0.15 0.28 -0.77 -0.31 -1.01 0.00 0.00 177.57 175.91 2dhg s TYR 120 N -4.83 0.75 -2.00 3.17 2.02 -0.02 -5.00 117.35 111.45 2dhg s TYR 120 Ca -0.07 -0.38 0.13 0.00 -0.37 0.00 0.00 57.07 56.38 2dhg s TYR 120 Cb 0.15 -0.87 0.75 0.00 -0.40 0.00 0.00 41.96 41.60 2dhg s TYR 120 CO 0.76 -0.42 1.18 -0.35 -1.57 0.00 0.00 175.55 175.14 2dhg n PRO 121 N 5.12 0.49 0.09 -1.71 -0.04 -1.17 -2.29 135.00 135.49 2dhg n PRO 121 Ca -0.08 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.44 2dhg n PRO 121 Cb 0.49 -1.40 -0.02 0.00 -0.04 0.00 0.00 33.50 32.53 2dhg n PRO 121 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2dhg h SER 122 N 0.00 0.00 -1.92 3.54 4.64 -1.93 -3.47 113.55 114.40 2dhg h SER 122 Ca 0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 2dhg h SER 122 Cb 0.00 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.18 2dhg h SER 122 CO 0.00 0.33 0.08 0.00 -0.87 0.00 0.00 176.83 176.37 2dhg n ARG 124 N 1.27 0.67 0.00 0.00 1.74 -0.38 -4.83 116.66 115.13 2dhg n ARG 124 Ca 0.14 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.33 2dhg n ARG 124 Cb 0.26 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2dhg n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dhg n GLY 125 N 2.07 3.10 3.83 -0.13 0.00 -1.26 -5.02 105.19 107.77 2dhg n GLY 125 Ca -0.40 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 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 2.54 -0.20 -0.02 0.00 -1.26 -3.21 107.32 105.16 2dhg s GLY 126 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 44.72 44.76 2dhg s GLY 126 CO 0.00 0.37 0.00 1.25 0.00 0.00 0.00 173.10 174.72 2dhg s LYS 127 N -2.08 1.00 -0.11 2.90 2.47 -0.01 -4.77 119.74 119.15 2dhg s LYS 127 Ca 0.42 -0.59 -0.05 0.00 -1.56 0.00 0.00 55.97 54.19 2dhg s LYS 127 Cb -0.15 -2.22 -0.04 0.00 -1.46 0.00 0.00 37.83 33.95 2dhg s LYS 127 CO 0.20 -0.60 0.09 0.54 0.16 0.00 0.00 175.35 175.74 2dhg s VAL 128 N 1.70 5.08 0.47 4.02 0.11 -1.26 -0.36 120.40 130.16 2dhg s VAL 128 Ca -0.02 0.05 -0.07 0.00 -2.93 0.00 0.00 61.98 59.00 2dhg s VAL 128 Cb -0.17 -3.19 -0.05 0.00 -1.53 0.00 0.00 36.38 31.44 2dhg s VAL 128 CO -0.07 0.61 0.80 0.68 -3.33 0.00 0.00 175.10 173.79 2dhg s VAL 129 N -0.96 4.85 0.19 2.04 -7.23 -0.99 -4.95 120.40 113.37 2dhg s VAL 129 Ca 0.14 0.39 0.00 0.00 -1.81 0.00 0.00 61.98 60.70 2dhg s VAL 129 Cb -0.12 -3.82 -0.04 0.00 0.56 0.00 0.00 36.38 32.95 2dhg s VAL 129 CO 0.03 -0.77 0.08 -0.76 -0.31 0.00 0.00 175.10 173.37 2dhg s LEU 130 N -4.50 1.63 0.51 1.32 1.43 -1.26 -2.81 118.68 115.00 2dhg s LEU 130 Ca 0.49 -1.30 0.08 0.00 -1.03 0.00 0.00 54.13 52.37 2dhg s LEU 130 Cb -0.10 0.17 0.05 0.00 0.03 0.00 0.00 46.19 46.33 2dhg s LEU 130 CO 0.41 -0.73 0.63 -0.62 0.23 0.00 0.00 176.35 176.27 2dhg s ASP 131 N -3.18 5.19 0.34 2.29 2.15 -1.01 -4.72 116.67 117.73 2dhg s ASP 131 Ca 0.32 -0.77 0.13 0.00 0.43 0.00 0.00 52.55 52.66 2dhg s ASP 131 Cb 0.07 -0.07 1.07 0.00 -0.30 0.00 0.00 42.92 43.69 2dhg s ASP 131 CO 0.08 -1.06 1.61 -0.61 -0.17 0.00 0.00 175.17 175.02 2dhg h GLN 132 N 0.49 0.11 -0.04 4.34 4.15 -2.03 1.37 115.11 123.51 2dhg h GLN 132 Ca -0.35 -0.01 -0.15 0.00 0.77 0.00 0.00 58.65 58.91 2dhg h GLN 132 Cb 1.29 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.94 2dhg h GLN 132 CO 0.46 0.07 -0.65 1.79 -1.93 0.00 0.00 178.83 178.57 2dhg h THR 133 N 0.11 1.43 0.00 2.39 1.35 -2.06 -3.47 112.91 112.66 2dhg h THR 133 Ca 0.72 -2.14 0.00 0.00 -0.55 0.00 0.00 66.41 64.44 2dhg h THR 133 Cb 1.73 2.13 0.00 0.00 -1.73 0.00 0.00 68.15 70.27 2dhg h THR 133 CO -0.75 0.62 0.00 0.61 -0.25 0.00 0.00 175.52 175.76 2dhg n GLY 134 N 0.37 1.44 3.70 5.82 0.00 0.47 -5.10 105.19 111.88 2dhg n GLY 134 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 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 5.38 -0.66 1.61 -7.23 -1.26 -4.67 120.40 111.57 2dhg s VAL 135 Ca 0.00 0.21 -0.40 0.00 -1.81 0.00 0.00 61.98 59.99 2dhg s VAL 135 Cb 0.00 -3.50 -0.20 0.00 0.56 0.00 0.00 36.38 33.25 2dhg s VAL 135 CO 0.00 0.39 2.32 -0.24 -0.31 0.00 0.00 175.10 177.26 2dhg n SER 136 N 3.87 0.63 -0.31 4.85 2.88 -1.26 -2.40 113.62 121.88 2dhg n SER 136 Ca -0.15 0.51 0.19 0.00 -1.33 0.00 0.00 58.87 58.09 2dhg n SER 136 Cb 0.52 -0.91 0.45 0.00 -0.75 0.00 0.00 64.21 63.52 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 10.04 0.49 0.00 -1.46 1.57 -1.81 -3.42 116.57 121.99 2dhg h LYS 137 Ca -0.09 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2dhg h LYS 137 Cb 1.38 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.58 2dhg h LYS 137 CO 1.19 0.33 0.00 0.41 -0.57 0.00 0.00 179.45 180.80 2dhg n GLY 138 N -1.44 1.03 3.83 3.86 0.00 -1.26 -4.95 105.19 106.26 2dhg n GLY 138 Ca 0.23 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.12 -0.07 0.00 1.61 -0.85 -1.26 -0.42 117.35 115.24 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 0.75 0.00 0.00 0.38 0.00 0.00 41.96 43.09 2dhg s TYR 139 CO 0.00 -1.31 0.00 0.41 -1.52 0.00 0.00 175.55 173.13 2dhg n GLY 140 N -0.49 0.86 3.33 5.49 0.00 -0.11 -2.34 105.19 111.93 2dhg n GLY 140 Ca -0.06 -0.70 -0.15 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.45 -0.32 0.43 1.61 0.40 0.51 -0.51 117.98 117.64 2dhg s PHE 141 Ca 0.00 0.50 0.04 0.00 -0.60 0.00 0.00 56.93 56.87 2dhg s PHE 141 Cb 0.00 0.20 -0.04 0.00 0.51 0.00 0.00 43.02 43.68 2dhg s PHE 141 CO 0.00 -0.47 0.04 0.14 0.70 0.00 0.00 175.22 175.63 2dhg s VAL 142 N -1.40 1.25 0.10 -0.44 -7.23 0.19 -0.83 120.40 112.05 2dhg s VAL 142 Ca -0.12 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.07 2dhg s VAL 142 Cb -0.03 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 2dhg s VAL 142 CO 0.05 0.00 -0.08 -0.54 -0.31 0.00 0.00 175.10 174.23 2dhg s LYS 143 N -3.80 0.84 0.08 4.82 3.01 -1.20 -1.26 119.74 122.23 2dhg s LYS 143 Ca 0.23 -1.28 -0.04 0.00 -1.01 0.00 0.00 55.97 53.87 2dhg s LYS 143 Cb 0.05 -0.32 -0.02 0.00 -1.01 0.00 0.00 37.83 36.52 2dhg s LYS 143 CO 0.12 0.02 0.08 -0.06 0.51 0.00 0.00 175.35 176.01 2dhg s PHE 144 N -3.21 0.42 -0.58 3.18 0.40 0.64 -1.25 117.98 117.59 2dhg s PHE 144 Ca 0.10 -0.89 0.23 0.00 -0.60 0.00 0.00 56.93 55.76 2dhg s PHE 144 Cb 0.02 -0.26 -0.03 0.00 0.51 0.00 0.00 43.02 43.26 2dhg s PHE 144 CO -0.03 -0.48 0.95 0.25 0.70 0.00 0.00 175.22 176.61 2dhg n THR 145 N 0.00 0.14 -4.19 0.64 -2.24 -0.23 -4.22 114.28 104.18 2dhg n THR 145 Ca -0.13 -0.25 -0.27 0.00 -2.27 0.00 0.00 64.05 61.13 2dhg n THR 145 Cb 0.62 0.26 -0.17 0.00 -2.10 0.00 0.00 70.33 68.95 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 -3.92 2.15 0.22 3.42 2.15 -1.26 -5.02 116.67 114.41 2dhg s ASP 146 Ca 0.03 -0.34 -0.07 0.00 0.43 0.00 0.00 52.55 52.60 2dhg s ASP 146 Cb 0.14 -0.91 0.18 0.00 -0.30 0.00 0.00 42.92 42.04 2dhg s ASP 146 CO 0.82 -0.05 1.74 -0.08 -0.17 0.00 0.00 175.17 177.43 2dhg h GLU 147 N 7.71 1.07 -0.73 4.34 4.81 -1.92 -2.41 114.58 127.44 2dhg h GLU 147 Ca -0.31 -0.25 0.17 0.00 -0.13 0.00 0.00 59.36 58.83 2dhg h GLU 147 Cb 1.15 -0.14 -0.12 0.00 0.63 0.00 0.00 28.75 30.27 2dhg h GLU 147 CO 0.45 0.95 0.07 -0.07 -0.73 0.00 0.00 179.01 179.68 2dhg h LEU 148 N 1.01 -0.20 -0.39 1.64 3.38 -1.95 0.12 115.31 118.92 2dhg h LEU 148 Ca 0.21 0.17 -0.18 0.00 0.09 0.00 0.00 57.88 58.17 2dhg h LEU 148 Cb 0.36 0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2dhg h LEU 148 CO 0.00 -0.13 -0.79 -0.33 0.09 0.00 0.00 178.44 177.29 2dhg h GLU 149 N 0.16 0.26 -0.97 1.13 4.39 -1.96 -3.03 114.58 114.57 2dhg h GLU 149 Ca 0.41 -0.24 0.27 0.00 0.34 0.00 0.00 59.36 60.13 2dhg h GLU 149 Cb 0.71 0.06 -0.14 0.00 -0.10 0.00 0.00 28.75 29.29 2dhg h GLU 149 CO -0.59 0.92 0.51 0.37 -1.16 0.00 0.00 179.01 179.06 2dhg h GLN 150 N 0.17 0.41 0.08 2.33 4.15 -0.26 -0.96 115.11 121.02 2dhg h GLN 150 Ca -0.04 -0.02 -0.13 0.00 0.77 0.00 0.00 58.65 59.23 2dhg h GLN 150 Cb 1.37 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.98 2dhg h GLN 150 CO 0.12 0.27 -0.64 0.87 -1.93 0.00 0.00 178.83 177.53 2dhg h LYS 151 N 0.42 0.16 -0.97 1.69 1.79 -1.51 -3.26 116.57 114.89 2dhg h LYS 151 Ca 0.65 -0.27 0.31 0.00 -2.18 0.00 0.00 60.65 59.16 2dhg h LYS 151 Cb 1.35 0.10 -0.15 0.00 -1.58 0.00 0.00 32.23 31.95 2dhg h LYS 151 CO -0.55 1.13 0.46 0.00 -1.08 0.00 0.00 179.45 179.41 2dhg h ARG 152 N -0.64 0.25 -0.36 3.15 3.08 -1.11 0.44 114.38 119.19 2dhg h ARG 152 Ca -0.13 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 59.82 2dhg h ARG 152 Cb 1.40 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.38 2dhg h ARG 152 CO 0.06 0.16 -0.13 0.00 -1.07 0.00 0.00 179.97 178.99 2dhg h ALA 153 N 1.85 0.49 -0.97 0.04 0.00 -1.34 0.56 119.26 119.90 2dhg h ALA 153 Ca 0.70 -0.33 0.18 0.00 0.00 0.00 0.00 54.91 55.46 2dhg h ALA 153 Cb 1.58 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 19.15 2dhg h ALA 153 CO -0.65 0.39 0.61 -0.07 0.00 0.00 0.00 179.25 179.53 2dhg h LEU 154 N 0.50 0.67 0.04 0.00 3.38 -0.18 1.65 115.31 121.37 2dhg h LEU 154 Ca 0.08 0.07 -0.33 0.00 0.09 0.00 0.00 57.88 57.79 2dhg h LEU 154 Cb 0.66 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 2dhg h LEU 154 CO 0.04 0.27 -1.94 1.07 0.09 0.00 0.00 178.44 177.97 2dhg n THR 155 N -4.65 1.62 -0.02 0.22 5.66 -0.90 -3.49 114.28 112.71 2dhg n THR 155 Ca 0.21 -0.75 -0.01 0.00 -3.05 0.00 0.00 64.05 60.46 2dhg n THR 155 Cb 0.59 -1.18 -0.00 0.00 -1.55 0.00 0.00 70.33 68.19 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 0.02 0.00 0.00 1.09 4.39 0.94 -3.34 114.58 117.68 2dhg h GLU 156 Ca -0.38 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.32 2dhg h GLU 156 Cb 2.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.70 2dhg h GLU 156 CO 0.06 0.00 0.01 0.00 -1.16 0.00 0.00 179.01 177.92 2dhg n GLN 158 N -2.01 0.00 -3.48 0.00 -0.06 -0.78 -0.14 117.38 110.91 2dhg n GLN 158 Ca -0.01 0.00 -0.25 0.00 -2.00 0.00 0.00 57.00 54.74 2dhg n GLN 158 Cb 0.03 -0.95 0.00 0.00 -4.06 0.00 0.00 30.24 25.26 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 1.92 -0.49 3.61 1.69 0.00 -0.95 -4.84 105.19 106.12 2dhg n GLY 159 Ca 0.17 0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.02 2.95 -0.12 4.61 0.00 0.80 -4.52 121.76 122.45 2dhg s ALA 160 Ca 0.46 0.36 0.03 0.00 0.00 0.00 0.00 51.96 52.81 2dhg s ALA 160 Cb -0.24 -3.99 -0.24 0.00 0.00 0.00 0.00 23.12 18.66 2dhg s ALA 160 CO 0.56 -2.50 0.34 0.28 0.00 0.00 0.00 175.76 174.44 2dhg n VAL 161 N 7.25 1.65 -0.37 0.00 0.31 -1.26 -1.89 118.33 124.02 2dhg n VAL 161 Ca 0.23 -0.71 0.31 0.00 -0.01 0.00 0.00 64.34 64.16 2dhg n VAL 161 Cb 0.46 -1.34 0.52 0.00 -0.91 0.00 0.00 33.84 32.57 2dhg n VAL 161 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dhg n GLY 162 N 1.87 -0.65 3.62 2.92 0.00 -1.26 -3.88 105.19 107.81 2dhg n GLY 162 Ca -0.29 0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 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 -8.38 4.08 0.33 0.99 2.96 -1.26 -4.90 118.68 112.51 2dhg s LEU 163 Ca -0.06 0.72 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 2dhg s LEU 163 Cb 0.24 -3.10 0.00 0.00 0.50 0.00 0.00 46.19 43.82 2dhg s LEU 163 CO 0.63 -0.61 0.00 0.61 -1.32 0.00 0.00 176.35 175.65 2dhg n GLY 164 N 4.14 -2.41 1.60 7.98 0.00 -1.25 -4.06 105.19 111.19 2dhg n GLY 164 Ca 0.04 -1.22 -0.04 0.00 0.00 0.00 0.00 46.02 44.80 2dhg n GLY 164 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhg n SER 165 N -3.73 5.59 -3.54 1.61 7.64 -1.26 -4.79 113.62 115.14 2dhg n SER 165 Ca -0.03 -2.56 -0.08 0.00 1.01 0.00 0.00 58.87 57.22 2dhg n SER 165 Cb 0.47 -1.12 -0.03 0.00 -1.01 0.00 0.00 64.21 62.51 2dhg n SER 165 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2dhg s LYS 166 N -0.37 0.66 1.07 1.43 1.02 -1.26 -4.97 119.74 117.32 2dhg s LYS 166 Ca 0.09 -0.14 -0.15 0.00 0.02 0.00 0.00 55.97 55.79 2dhg s LYS 166 Cb 0.06 0.30 0.22 0.00 -0.52 0.00 0.00 37.83 37.90 2dhg s LYS 166 CO -0.00 -0.27 1.10 -1.25 -0.92 0.00 0.00 175.35 174.01 2dhg s PRO 167 N -2.43 -0.17 -0.05 -1.68 0.04 -1.26 -4.51 135.00 124.95 2dhg s PRO 167 Ca 0.04 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.39 2dhg s PRO 167 Cb -0.01 -1.69 0.02 0.00 0.04 0.00 0.00 34.50 32.87 2dhg s PRO 167 CO -0.05 -3.09 -0.02 0.14 0.04 0.00 0.00 177.00 174.02 2dhg s VAL 168 N -2.98 0.39 -0.30 -0.36 -7.23 -0.79 -4.36 120.40 104.76 2dhg s VAL 168 Ca 0.67 0.01 -0.21 0.00 -1.81 0.00 0.00 61.98 60.65 2dhg s VAL 168 Cb -0.16 -0.47 -0.01 0.00 0.56 0.00 0.00 36.38 36.30 2dhg s VAL 168 CO 0.57 0.21 0.64 -0.60 -0.31 0.00 0.00 175.10 175.62 2dhg s ARG 169 N 1.25 3.92 0.09 4.82 3.52 -1.25 -2.24 118.95 129.06 2dhg s ARG 169 Ca -0.06 0.34 -0.11 0.00 -0.13 0.00 0.00 55.73 55.77 2dhg s ARG 169 Cb -0.14 -3.72 -0.06 0.00 -1.56 0.00 0.00 34.95 29.47 2dhg s ARG 169 CO -0.02 -0.57 0.43 -0.51 -0.81 0.00 0.00 175.30 173.82 2dhg s LEU 170 N 2.63 4.34 0.32 -0.88 1.43 -1.25 -2.96 118.68 122.31 2dhg s LEU 170 Ca 0.26 0.85 -0.16 0.00 -1.03 0.00 0.00 54.13 54.04 2dhg s LEU 170 Cb -0.15 -3.05 0.03 0.00 0.03 0.00 0.00 46.19 43.05 2dhg s LEU 170 CO 0.12 0.15 0.70 -0.44 0.23 0.00 0.00 176.35 177.11 2dhg s SER 171 N -1.77 -0.04 -0.52 2.29 0.01 -1.01 -4.96 113.70 107.70 2dhg s SER 171 Ca 0.34 -0.93 -0.17 0.00 1.31 0.00 0.00 55.95 56.50 2dhg s SER 171 Cb -0.14 0.76 0.10 0.00 0.21 0.00 0.00 66.02 66.95 2dhg s SER 171 CO 0.18 -1.46 0.51 -0.69 0.41 0.00 0.00 173.24 172.19 2dhg s VAL 172 N -3.21 5.13 -0.11 3.43 1.01 -1.26 -2.06 120.40 123.33 2dhg s VAL 172 Ca 0.16 -1.20 -0.17 0.00 0.00 0.00 0.00 61.98 60.77 2dhg s VAL 172 Cb -0.05 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 2dhg s VAL 172 CO 0.10 -0.81 0.42 0.00 0.00 0.00 0.00 175.10 174.81 2dhg s ALA 173 N 1.87 3.53 0.12 5.51 0.00 -1.26 -4.95 121.76 126.58 2dhg s ALA 173 Ca 0.06 -0.26 -0.31 0.00 0.00 0.00 0.00 51.96 51.44 2dhg s ALA 173 Cb -0.26 -2.55 -0.08 0.00 0.00 0.00 0.00 23.12 20.23 2dhg s ALA 173 CO 0.05 0.08 1.39 0.42 0.00 0.00 0.00 175.76 177.71 2dhg s ILE 174 N 0.37 3.28 0.11 0.00 1.01 -1.26 -4.68 121.20 120.02 2dhg s ILE 174 Ca 0.23 0.93 -0.14 0.00 0.00 0.00 0.00 60.65 61.67 2dhg s ILE 174 Cb -0.15 -3.59 -0.08 0.00 0.01 0.00 0.00 42.46 38.65 2dhg s ILE 174 CO 0.09 0.08 1.43 1.55 0.00 0.00 0.00 174.94 178.08 2dhg h PRO 175 N 6.72 0.74 -4.02 2.79 0.13 -1.95 -3.42 132.00 132.99 2dhg h PRO 175 Ca -0.42 -0.39 -0.57 0.00 -0.87 0.00 0.00 66.00 63.75 2dhg h PRO 175 Cb 1.21 0.01 -0.39 0.00 0.13 0.00 0.00 31.00 31.96 2dhg h PRO 175 CO 0.86 1.01 -0.78 0.21 -0.23 0.00 0.00 178.00 179.07 2dhg s LYS 176 N -4.37 1.22 0.25 0.86 2.20 -1.26 -5.12 119.74 113.52 2dhg s LYS 176 Ca -0.12 -0.75 0.02 0.00 -0.36 0.00 0.00 55.97 54.76 2dhg s LYS 176 Cb 0.09 -2.38 -0.05 0.00 -1.51 0.00 0.00 37.83 33.98 2dhg s LYS 176 CO 0.84 -0.61 0.08 0.00 -0.36 0.00 0.00 175.35 175.29 2dhg s ALA 177 N 1.59 1.72 -1.60 3.13 0.00 -1.26 -4.82 121.76 120.52 2dhg s ALA 177 Ca -0.04 -1.84 -0.19 0.00 0.00 0.00 0.00 51.96 49.89 2dhg s ALA 177 Cb -0.18 0.95 0.18 0.00 0.00 0.00 0.00 23.12 24.07 2dhg s ALA 177 CO -0.07 -0.43 0.58 0.43 0.00 0.00 0.00 175.76 176.28 2dhg n SER 178 N -0.45 -2.31 -4.84 0.00 7.64 -1.26 -4.89 113.62 107.50 2dhg n SER 178 Ca -0.01 -0.94 -0.30 0.00 1.01 0.00 0.00 58.87 58.63 2dhg n SER 178 Cb 0.66 -1.97 0.06 0.00 -1.01 0.00 0.00 64.21 61.95 2dhg n SER 178 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dhg s ARG 179 N -6.84 2.57 -0.05 1.43 3.03 -1.26 -5.07 118.95 112.75 2dhg s ARG 179 Ca 0.70 0.58 0.04 0.00 2.03 0.00 0.00 55.73 59.08 2dhg s ARG 179 Cb -0.40 -1.98 -0.02 0.00 -1.03 0.00 0.00 34.95 31.52 2dhg s ARG 179 CO 0.85 -1.27 -0.17 0.08 -1.13 0.00 0.00 175.30 173.67 2dhg s VAL 180 N -3.24 2.85 -0.05 4.99 1.01 -1.26 -5.13 120.40 119.58 2dhg s VAL 180 Ca 0.59 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 2dhg s VAL 180 Cb -0.13 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2dhg s VAL 180 CO 0.53 0.58 0.17 -0.54 0.00 0.00 0.00 175.10 175.85 2dhg s LYS 181 N -0.57 3.45 -0.46 2.72 3.01 -1.26 -5.04 119.74 121.59 2dhg s LYS 181 Ca 0.08 -0.24 -0.28 0.00 -1.01 0.00 0.00 55.97 54.53 2dhg s LYS 181 Cb -0.11 -3.13 -0.01 0.00 -1.01 0.00 0.00 37.83 33.56 2dhg s LYS 181 CO 0.01 0.71 1.76 -1.25 0.51 0.00 0.00 175.35 177.09 2dhg s PRO 182 N -1.61 3.08 -0.14 -1.68 0.04 -1.26 -4.98 135.00 128.46 2dhg s PRO 182 Ca 0.23 1.01 0.01 0.00 0.04 0.00 0.00 61.00 62.30 2dhg s PRO 182 Cb -0.12 -4.25 -0.00 0.00 0.04 0.00 0.00 34.50 30.16 2dhg s PRO 182 CO 0.14 -2.17 -0.18 0.14 0.04 0.00 0.00 177.00 174.97 2dhg s VAL 183 N 7.55 2.49 -0.05 -0.36 -7.23 -1.26 -5.12 120.40 116.43 2dhg s VAL 183 Ca 0.72 -0.84 0.06 0.00 -1.81 0.00 0.00 61.98 60.10 2dhg s VAL 183 Cb -0.17 -2.02 -0.01 0.00 0.56 0.00 0.00 36.38 34.73 2dhg s VAL 183 CO 0.28 0.53 -0.24 -0.70 -0.31 0.00 0.00 175.10 174.66 2dhg s GLU 184 N 0.62 2.47 -0.45 4.82 -6.30 -1.26 -5.09 118.70 113.51 2dhg s GLU 184 Ca -0.10 -0.89 -0.27 0.00 -2.50 0.00 0.00 54.97 51.22 2dhg s GLU 184 Cb -0.16 -2.16 0.03 0.00 0.00 0.00 0.00 34.13 31.83 2dhg s GLU 184 CO 0.03 0.43 0.99 -1.54 0.02 0.00 0.00 175.26 175.19 2dhg s SER 185 N -0.29 6.56 0.00 -1.70 1.04 -1.26 -5.03 113.70 113.02 2dhg s SER 185 Ca 0.00 0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.71 2dhg s SER 185 Cb -0.13 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2dhg s SER 185 CO 0.02 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.77 2dhg n GLY 186 N 4.84 -1.64 3.55 7.32 0.00 -1.26 -4.85 105.19 113.15 2dhg n GLY 186 Ca 0.08 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 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 0.00 2.60 0.42 1.61 0.04 -1.26 -4.97 135.00 133.44 2dhg s PRO 187 Ca 0.00 0.31 -0.22 0.00 0.04 0.00 0.00 61.00 61.13 2dhg s PRO 187 Cb 0.00 -4.62 -0.10 0.00 0.04 0.00 0.00 34.50 29.82 2dhg s PRO 187 CO 0.00 -2.96 0.97 0.45 0.04 0.00 0.00 177.00 175.50 2dhg s SER 188 N 8.10 6.90 0.85 6.66 0.15 -1.26 -5.06 113.70 130.04 2dhg s SER 188 Ca 0.68 1.76 -0.13 0.00 0.70 0.00 0.00 55.95 58.96 2dhg s SER 188 Cb -0.11 -2.55 0.11 0.00 -1.71 0.00 0.00 66.02 61.77 2dhg s SER 188 CO 0.13 -0.39 1.22 -0.44 1.20 0.00 0.00 173.24 174.96 2dhg s SER 189 N -2.05 4.14 0.00 5.45 0.01 -1.26 -5.30 113.70 114.69 2dhg s SER 189 Ca 0.61 0.64 0.00 0.00 1.31 0.00 0.00 55.95 58.51 2dhg s SER 189 Cb -0.12 -1.01 0.00 0.00 0.21 0.00 0.00 66.02 65.10 2dhg s SER 189 CO 0.16 -2.12 0.00 0.61 0.41 0.00 0.00 173.24 172.30