#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgr s SER 100 N 0.00 6.29 0.20 1.61 0.01 -1.26 -5.02 113.70 115.53 2dgr s SER 100 Ca 0.00 -1.38 0.10 0.00 1.31 0.00 0.00 55.95 55.97 2dgr s SER 100 Cb 0.00 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.81 2dgr s SER 100 CO 0.00 -1.25 -0.13 -0.44 0.41 0.00 0.00 173.24 171.83 2dgr s SER 101 N 3.63 4.03 0.00 2.44 0.01 -1.26 -5.07 113.70 117.49 2dgr s SER 101 Ca 0.22 -0.68 0.00 0.00 1.31 0.00 0.00 55.95 56.80 2dgr s SER 101 Cb -0.16 -0.59 0.00 0.00 0.21 0.00 0.00 66.02 65.48 2dgr s SER 101 CO 0.04 0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.40 2dgr n GLY 102 N -0.01 3.14 0.00 3.44 0.00 -1.26 -5.09 105.19 105.42 2dgr n GLY 102 Ca -0.11 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2dgr n GLY 102 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dgr n SER 103 N 0.00 2.91 -4.83 1.61 3.41 -1.26 -5.07 113.62 110.39 2dgr n SER 103 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.29 2dgr n SER 103 Cb 0.00 0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 64.07 2dgr n SER 103 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dgr s SER 104 N -3.13 6.32 0.22 4.04 0.15 -1.26 -4.92 113.70 115.12 2dgr s SER 104 Ca 0.00 1.62 -0.01 0.00 0.70 0.00 0.00 55.95 58.27 2dgr s SER 104 Cb 0.00 -2.51 0.49 0.00 -1.71 0.00 0.00 66.02 62.29 2dgr s SER 104 CO 0.00 -0.80 1.14 0.61 1.20 0.00 0.00 173.24 175.39 2dgr n GLY 105 N -1.54 -1.06 0.00 9.45 0.00 -1.26 -4.72 105.19 106.06 2dgr n GLY 105 Ca 0.07 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.83 2dgr n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dgr n GLY 106 N -1.40 -1.45 3.96 -0.02 0.00 -1.26 -5.15 105.19 99.87 2dgr n GLY 106 Ca 0.16 0.48 -0.22 0.00 0.00 0.00 0.00 46.02 46.43 2dgr n GLY 106 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2dgr s GLN 107 N 0.00 3.40 0.17 1.61 -2.07 -1.26 -4.71 119.66 116.79 2dgr s GLN 107 Ca 0.00 -0.62 0.06 0.00 -1.82 0.00 0.00 55.36 52.98 2dgr s GLN 107 Cb 0.00 -2.78 -0.04 0.00 -1.09 0.00 0.00 33.01 29.09 2dgr s GLN 107 CO 0.00 0.25 -0.13 -0.08 -1.32 0.00 0.00 175.29 174.01 2dgr s THR 108 N -2.16 1.48 -0.18 3.63 -1.32 -0.50 -4.94 115.64 111.66 2dgr s THR 108 Ca 0.38 -2.04 -0.01 0.00 -1.21 0.00 0.00 61.69 58.81 2dgr s THR 108 Cb -0.09 -1.86 0.05 0.00 -1.51 0.00 0.00 72.50 69.08 2dgr s THR 108 CO 0.32 -0.59 -0.03 -0.89 -2.21 0.00 0.00 174.62 171.22 2dgr s THR 109 N -2.86 1.00 0.16 5.08 2.01 -1.26 -0.25 115.64 119.52 2dgr s THR 109 Ca 0.17 -0.65 0.04 0.00 0.31 0.00 0.00 61.69 61.56 2dgr s THR 109 Cb -0.01 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 2dgr s THR 109 CO 0.04 0.03 0.19 0.27 -0.69 0.00 0.00 174.62 174.47 2dgr s ILE 110 N 1.67 4.81 -0.34 1.82 -4.36 -0.41 -4.94 121.20 119.45 2dgr s ILE 110 Ca -0.00 -0.92 -0.04 0.00 -0.26 0.00 0.00 60.65 59.43 2dgr s ILE 110 Cb -0.16 -3.46 0.06 0.00 1.25 0.00 0.00 42.46 40.15 2dgr s ILE 110 CO -0.07 -0.10 0.08 -1.10 0.24 0.00 0.00 174.94 173.99 2dgr s GLN 111 N -3.14 2.42 0.28 0.37 1.11 -1.26 -0.92 119.66 118.51 2dgr s GLN 111 Ca 0.32 -1.35 -0.29 0.00 0.01 0.00 0.00 55.36 54.06 2dgr s GLN 111 Cb -0.10 -3.36 -0.09 0.00 -1.01 0.00 0.00 33.01 28.44 2dgr s GLN 111 CO 0.25 -0.73 1.00 0.08 0.01 0.00 0.00 175.29 175.91 2dgr s VAL 112 N 1.28 3.88 -0.26 1.09 1.01 0.89 -4.90 120.40 123.41 2dgr s VAL 112 Ca -0.01 1.79 -0.05 0.00 0.00 0.00 0.00 61.98 63.70 2dgr s VAL 112 Cb -0.20 -4.09 -0.00 0.00 0.00 0.00 0.00 36.38 32.08 2dgr s VAL 112 CO -0.00 0.34 0.02 -0.60 0.00 0.00 0.00 175.10 174.86 2dgr s ARG 113 N -1.55 3.24 0.04 2.72 3.00 -1.26 -1.48 118.95 123.65 2dgr s ARG 113 Ca 0.45 -0.74 0.01 0.00 -1.00 0.00 0.00 55.73 54.46 2dgr s ARG 113 Cb -0.26 -3.19 -0.02 0.00 0.00 0.00 0.00 34.95 31.48 2dgr s ARG 113 CO 0.33 -0.32 -0.06 0.14 0.00 0.00 0.00 175.30 175.39 2dgr s VAL 114 N 1.48 0.38 0.04 7.11 -7.23 -1.16 -4.99 120.40 116.04 2dgr s VAL 114 Ca 0.04 -1.11 -0.31 0.00 -1.81 0.00 0.00 61.98 58.80 2dgr s VAL 114 Cb -0.16 -0.60 -0.06 0.00 0.56 0.00 0.00 36.38 36.12 2dgr s VAL 114 CO -0.00 -0.48 1.42 -2.16 -0.31 0.00 0.00 175.10 173.56 2dgr s PRO 115 N -1.79 4.29 0.37 4.82 0.04 -1.26 -4.54 135.00 136.93 2dgr s PRO 115 Ca -0.10 2.03 0.28 0.00 0.04 0.00 0.00 61.00 63.25 2dgr s PRO 115 Cb -0.08 -3.48 1.25 0.00 0.04 0.00 0.00 34.50 32.24 2dgr s PRO 115 CO -0.01 -0.54 1.29 0.98 0.04 0.00 0.00 177.00 178.76 2dgr n TYR 116 N 4.94 0.53 -0.09 0.56 9.36 -1.26 0.20 117.16 131.39 2dgr n TYR 116 Ca 0.13 0.54 -0.09 0.00 3.32 0.00 0.00 57.90 61.80 2dgr n TYR 116 Cb 0.43 -0.95 -0.01 0.00 -0.63 0.00 0.00 39.34 38.18 2dgr n TYR 116 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 2dgr h ARG 117 N 0.00 0.41 -0.03 2.98 9.65 -2.01 -2.54 114.38 122.84 2dgr h ARG 117 Ca 0.73 -0.02 -0.14 0.00 -1.10 0.00 0.00 59.98 59.45 2dgr h ARG 117 Cb 2.42 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 30.89 2dgr h ARG 117 CO -0.35 0.27 -0.63 0.28 2.80 0.00 0.00 179.97 182.34 2dgr h VAL 118 N 0.42 1.43 -0.44 0.20 2.07 0.19 -3.30 116.25 116.81 2dgr h VAL 118 Ca 0.12 -2.10 0.05 0.00 0.82 0.00 0.00 66.70 65.60 2dgr h VAL 118 Cb -0.03 2.11 -0.09 0.00 -1.52 0.00 0.00 31.29 31.76 2dgr h VAL 118 CO -0.04 0.61 -0.55 0.58 0.02 0.00 0.00 177.57 178.19 2dgr h VAL 119 N 0.07 0.01 -0.91 2.57 2.07 -0.84 0.12 116.25 119.34 2dgr h VAL 119 Ca -0.01 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.66 2dgr h VAL 119 Cb 1.12 0.01 -0.09 0.00 -1.52 0.00 0.00 31.29 30.81 2dgr h VAL 119 CO 0.09 0.00 0.51 1.23 0.02 0.00 0.00 177.57 179.42 2dgr h GLY 120 N -0.37 1.51 0.92 2.17 0.00 -1.63 0.18 103.07 105.84 2dgr h GLY 120 Ca 0.08 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 2dgr h GLY 120 CO -0.62 0.01 0.05 1.41 0.00 0.00 0.00 176.54 177.39 2dgr h LEU 121 N 0.74 0.13 0.22 3.11 3.38 -1.11 -1.57 115.31 120.20 2dgr h LEU 121 Ca 0.49 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.35 2dgr h LEU 121 Cb 0.65 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2dgr h LEU 121 CO -0.34 0.19 -0.10 0.58 0.09 0.00 0.00 178.44 178.86 2dgr h VAL 122 N 0.06 0.85 -0.25 1.22 2.07 0.00 -3.22 116.25 116.98 2dgr h VAL 122 Ca 0.03 -0.40 0.06 0.00 0.82 0.00 0.00 66.70 67.21 2dgr h VAL 122 Cb 0.09 1.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.88 2dgr h VAL 122 CO -0.01 0.09 -0.39 0.58 0.02 0.00 0.00 177.57 177.87 2dgr h VAL 123 N -0.49 0.18 0.00 2.57 2.07 -0.67 -2.60 116.25 117.31 2dgr h VAL 123 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2dgr h VAL 123 Cb 0.37 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2dgr h VAL 123 CO 0.05 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.25 2dgr n GLY 124 N -1.42 -0.55 3.51 2.17 0.00 -0.59 -1.98 105.19 106.32 2dgr n GLY 124 Ca -0.02 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 43.87 2dgr n GLY 124 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dgr n PRO 125 N -0.59 0.44 -3.97 1.61 -0.02 -1.26 -1.11 135.00 130.10 2dgr n PRO 125 Ca 0.00 0.01 -0.30 0.00 -2.02 0.00 0.00 63.50 61.19 2dgr n PRO 125 Cb 0.00 -2.27 0.01 0.00 -0.02 0.00 0.00 33.50 31.21 2dgr n PRO 125 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2dgr n LYS 126 N 8.66 -4.47 -2.48 -0.52 5.02 -1.26 -3.47 118.16 119.63 2dgr n LYS 126 Ca 0.54 0.51 -0.05 0.00 -2.02 0.00 0.00 58.31 57.29 2dgr n LYS 126 Cb 0.23 -5.18 0.01 0.00 -0.02 0.00 0.00 35.03 30.06 2dgr n LYS 126 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dgr n GLY 127 N -1.65 -1.37 0.00 0.72 0.00 -0.27 -5.01 105.19 97.61 2dgr n GLY 127 Ca -0.06 0.85 0.00 0.00 0.00 0.00 0.00 46.02 46.81 2dgr n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dgr n ALA 128 N -0.29 1.59 0.01 4.61 0.00 -0.84 -4.70 120.51 120.90 2dgr n ALA 128 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.31 2dgr n ALA 128 Cb 0.31 0.15 -0.14 0.00 0.00 0.00 0.00 19.45 19.77 2dgr n ALA 128 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2dgr h THR 129 N 0.00 0.66 0.00 0.00 2.02 -1.64 -3.33 112.91 110.61 2dgr h THR 129 Ca 0.00 -2.37 -0.05 0.00 0.77 0.00 0.00 66.41 64.76 2dgr h THR 129 Cb 0.52 2.52 -0.01 0.00 -1.74 0.00 0.00 68.15 69.44 2dgr h THR 129 CO 0.00 0.88 -0.24 -0.29 0.37 0.00 0.00 175.52 176.25 2dgr h ILE 130 N 0.07 1.10 -0.40 3.11 6.09 -1.03 -2.74 117.51 123.71 2dgr h ILE 130 Ca -0.41 -0.83 -0.10 0.00 -1.37 0.00 0.00 64.86 62.15 2dgr h ILE 130 Cb 2.04 1.45 -0.01 0.00 0.47 0.00 0.00 36.82 40.77 2dgr h ILE 130 CO 0.10 0.23 -0.13 0.11 -3.07 0.00 0.00 178.15 175.39 2dgr h LYS 131 N 0.00 0.80 -0.70 2.19 6.56 -1.83 -3.06 116.57 120.54 2dgr h LYS 131 Ca -0.00 -0.32 0.07 0.00 -1.06 0.00 0.00 60.65 59.33 2dgr h LYS 131 Cb 0.44 -0.04 -0.06 0.00 -0.57 0.00 0.00 32.23 32.00 2dgr h LYS 131 CO 0.03 0.94 0.38 0.00 -2.06 0.00 0.00 179.45 178.75 2dgr h ARG 132 N 0.61 0.67 -0.58 3.15 3.08 -1.60 -2.02 114.38 117.69 2dgr h ARG 132 Ca 0.10 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.15 2dgr h ARG 132 Cb 0.67 -0.15 -0.05 0.00 0.08 0.00 0.00 29.97 30.52 2dgr h ARG 132 CO 0.05 0.44 0.32 0.82 -1.07 0.00 0.00 179.97 180.53 2dgr h ILE 133 N 0.69 0.99 -0.97 2.04 2.04 -1.49 0.30 117.51 121.10 2dgr h ILE 133 Ca 0.32 -0.21 0.19 0.00 1.00 0.00 0.00 64.86 66.16 2dgr h ILE 133 Cb 0.24 0.32 -0.09 0.00 -0.74 0.00 0.00 36.82 36.55 2dgr h ILE 133 CO -0.21 0.11 0.61 1.56 0.00 0.00 0.00 178.15 180.23 2dgr h GLN 134 N 0.62 0.64 0.00 2.37 4.20 -1.27 0.34 115.11 122.01 2dgr h GLN 134 Ca 0.25 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.92 2dgr h GLN 134 Cb 0.12 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.76 2dgr h GLN 134 CO -0.15 0.42 -0.00 1.96 -0.67 0.00 0.00 178.83 180.39 2dgr h GLN 135 N 0.66 -0.01 -0.47 1.46 1.08 -1.19 1.00 115.11 117.64 2dgr h GLN 135 Ca 0.54 0.00 0.12 0.00 -1.45 0.00 0.00 58.65 57.86 2dgr h GLN 135 Cb 0.97 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.38 2dgr h GLN 135 CO -0.30 0.85 0.33 0.00 -0.95 0.00 0.00 178.83 178.76 2dgr h ARG 136 N -0.97 0.07 0.00 1.46 2.47 -0.43 -1.05 114.38 115.94 2dgr h ARG 136 Ca -0.00 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2dgr h ARG 136 Cb 0.86 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.16 2dgr h ARG 136 CO 0.00 0.05 -0.76 0.25 0.56 0.00 0.00 179.97 180.07 2dgr n THR 137 N -4.42 0.00 -3.57 2.04 -2.24 0.11 -5.01 114.28 101.19 2dgr n THR 137 Ca 0.08 -0.18 -0.20 0.00 -2.27 0.00 0.00 64.05 61.48 2dgr n THR 137 Cb 0.49 0.93 0.05 0.00 -2.10 0.00 0.00 70.33 69.71 2dgr n THR 137 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2dgr n HIS 138 N -1.39 -2.05 -4.05 4.78 8.25 0.31 -4.78 115.22 116.28 2dgr n HIS 138 Ca 0.02 0.85 -0.14 0.00 -0.26 0.00 0.00 57.72 58.20 2dgr n HIS 138 Cb 0.23 -4.53 -0.13 0.00 1.12 0.00 0.00 29.99 26.68 2dgr n HIS 138 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2dgr s THR 139 N -3.54 0.31 -0.84 1.59 -4.23 0.74 -4.92 115.64 104.75 2dgr s THR 139 Ca 0.07 -0.42 -0.25 0.00 -1.18 0.00 0.00 61.69 59.91 2dgr s THR 139 Cb -0.02 -0.31 0.03 0.00 1.34 0.00 0.00 72.50 73.54 2dgr s THR 139 CO 0.78 -0.08 1.44 -0.47 -0.54 0.00 0.00 174.62 175.76 2dgr s TYR 140 N -0.49 2.28 -0.44 3.99 5.04 -0.65 -4.44 117.35 122.63 2dgr s TYR 140 Ca -0.03 -0.22 -0.23 0.00 -2.44 0.00 0.00 57.07 54.15 2dgr s TYR 140 Cb -0.04 -4.56 0.02 0.00 0.35 0.00 0.00 41.96 37.73 2dgr s TYR 140 CO -0.00 -2.02 0.79 0.42 -1.34 0.00 0.00 175.55 173.39 2dgr s ILE 141 N 6.08 4.65 -0.26 3.14 1.01 -1.26 -1.44 121.20 133.12 2dgr s ILE 141 Ca 0.45 0.47 -0.15 0.00 0.00 0.00 0.00 60.65 61.42 2dgr s ILE 141 Cb -0.05 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 2dgr s ILE 141 CO 0.05 -0.69 0.36 -0.69 0.00 0.00 0.00 174.94 173.97 2dgr s VAL 142 N 3.28 5.19 0.40 2.92 1.01 0.60 -4.96 120.40 128.84 2dgr s VAL 142 Ca 0.30 0.56 -0.23 0.00 0.00 0.00 0.00 61.98 62.61 2dgr s VAL 142 Cb -0.12 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 2dgr s VAL 142 CO 0.22 0.18 0.99 0.42 0.00 0.00 0.00 175.10 176.91 2dgr s THR 143 N 1.93 4.05 1.06 3.92 -4.23 -1.26 -1.95 115.64 119.16 2dgr s THR 143 Ca 0.15 1.47 -0.14 0.00 -1.18 0.00 0.00 61.69 61.99 2dgr s THR 143 Cb -0.16 -3.71 0.22 0.00 1.34 0.00 0.00 72.50 70.20 2dgr s THR 143 CO 0.09 -0.09 1.10 -2.16 -0.54 0.00 0.00 174.62 173.02 2dgr s PRO 144 N -2.68 -0.09 0.97 3.99 0.04 -1.23 -4.96 135.00 131.03 2dgr s PRO 144 Ca 0.58 0.34 -0.16 0.00 0.04 0.00 0.00 61.00 61.81 2dgr s PRO 144 Cb -0.17 -1.69 0.20 0.00 0.04 0.00 0.00 34.50 32.88 2dgr s PRO 144 CO 0.21 -3.04 1.31 0.20 0.04 0.00 0.00 177.00 175.72 2dgr s GLY 145 N -3.56 1.77 0.13 0.56 0.00 -1.26 -4.99 107.32 99.96 2dgr s GLY 145 Ca 0.67 -1.18 -0.00 0.00 0.00 0.00 0.00 44.72 44.20 2dgr s GLY 145 CO 0.57 -0.42 1.28 0.07 0.00 0.00 0.00 173.10 174.61 2dgr h ARG 146 N -1.67 0.23 -1.01 2.90 0.11 -1.98 -3.29 114.38 109.67 2dgr h ARG 146 Ca -0.44 -0.30 -0.62 0.00 0.10 0.00 0.00 59.98 58.71 2dgr h ARG 146 Cb 1.24 0.10 -0.36 0.00 1.11 0.00 0.00 29.97 32.06 2dgr h ARG 146 CO 0.38 1.06 0.01 -3.47 0.10 0.00 0.00 179.97 178.06 2dgr n ASP 147 N -3.60 6.22 -4.12 0.08 2.03 -1.26 -4.99 116.55 110.91 2dgr n ASP 147 Ca -0.05 -3.77 -0.09 0.00 0.52 0.00 0.00 54.79 51.40 2dgr n ASP 147 Cb 0.89 -0.66 -0.10 0.00 -0.72 0.00 0.00 41.12 40.53 2dgr n ASP 147 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2dgr s LYS 148 N -3.72 0.71 0.50 -0.67 -0.14 -1.24 -5.14 119.74 110.03 2dgr s LYS 148 Ca 0.56 -1.24 -0.23 0.00 -1.36 0.00 0.00 55.97 53.71 2dgr s LYS 148 Cb 0.45 -0.01 -0.07 0.00 -1.68 0.00 0.00 37.83 36.52 2dgr s LYS 148 CO -0.03 -0.06 1.23 -0.85 -0.76 0.00 0.00 175.35 174.87 2dgr n GLU 149 N 0.13 1.61 -2.04 1.68 0.00 -1.26 -4.72 120.64 116.04 2dgr n GLU 149 Ca -0.14 0.59 -0.35 0.00 0.00 0.00 0.00 57.16 57.26 2dgr n GLU 149 Cb 0.60 -2.39 -0.04 0.00 0.00 0.00 0.00 31.44 29.62 2dgr n GLU 149 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 2dgr s PRO 150 N -2.53 2.60 -0.09 3.44 0.04 -1.26 -4.76 135.00 132.44 2dgr s PRO 150 Ca 0.68 0.32 -0.05 0.00 0.04 0.00 0.00 61.00 61.98 2dgr s PRO 150 Cb -0.46 -4.61 0.04 0.00 0.04 0.00 0.00 34.50 29.51 2dgr s PRO 150 CO 0.53 -2.94 0.21 0.08 0.04 0.00 0.00 177.00 174.92 2dgr s VAL 151 N 9.40 -0.03 -0.30 -0.36 1.01 -1.26 -3.00 120.40 125.85 2dgr s VAL 151 Ca 0.68 0.12 -0.11 0.00 0.00 0.00 0.00 61.98 62.67 2dgr s VAL 151 Cb -0.11 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 2dgr s VAL 151 CO 0.14 0.05 0.17 -0.36 0.00 0.00 0.00 175.10 175.10 2dgr s PHE 152 N 0.94 3.19 -0.45 5.22 0.08 -0.55 -3.54 117.98 122.86 2dgr s PHE 152 Ca -0.07 -0.29 -0.21 0.00 0.12 0.00 0.00 56.93 56.48 2dgr s PHE 152 Cb -0.08 -2.38 0.03 0.00 -0.57 0.00 0.00 43.02 40.02 2dgr s PHE 152 CO -0.06 -0.35 0.69 0.00 -0.10 0.00 0.00 175.22 175.41 2dgr s ALA 153 N 1.68 3.33 -0.26 5.36 0.00 -0.82 -0.07 121.76 130.97 2dgr s ALA 153 Ca 0.06 -1.21 -0.11 0.00 0.00 0.00 0.00 51.96 50.70 2dgr s ALA 153 Cb -0.17 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.54 2dgr s ALA 153 CO 0.08 -1.87 0.17 0.08 0.00 0.00 0.00 175.76 174.22 2dgr s VAL 154 N 2.97 5.31 -0.15 0.00 1.01 -0.10 -0.29 120.40 129.15 2dgr s VAL 154 Ca 0.24 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.35 2dgr s VAL 154 Cb -0.14 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 2dgr s VAL 154 CO 0.19 0.30 -0.02 -0.89 0.00 0.00 0.00 175.10 174.68 2dgr s THR 155 N 1.39 4.05 0.00 3.92 2.01 -0.52 -1.29 115.64 125.20 2dgr s THR 155 Ca 0.07 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 61.76 2dgr s THR 155 Cb -0.15 -2.77 0.00 0.00 0.01 0.00 0.00 72.50 69.60 2dgr s THR 155 CO 0.08 0.51 0.00 0.61 -0.69 0.00 0.00 174.62 175.12 2dgr n GLY 156 N 3.29 0.01 3.10 4.40 0.00 0.65 -1.64 105.19 115.00 2dgr n GLY 156 Ca -0.17 -1.36 -0.36 0.00 0.00 0.00 0.00 46.02 44.13 2dgr n GLY 156 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dgr n MET 157 N -1.14 -0.05 0.00 1.61 2.81 -1.26 -1.41 117.12 117.69 2dgr n MET 157 Ca 0.00 -0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.96 2dgr n MET 157 Cb 0.00 -1.17 0.42 0.00 -0.71 0.00 0.00 33.22 31.76 2dgr n MET 157 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2dgr n PRO 158 N 1.62 0.49 -0.01 0.03 -0.04 -1.26 -2.18 135.00 133.65 2dgr n PRO 158 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.45 2dgr n PRO 158 Cb 0.55 -1.46 -0.01 0.00 -0.04 0.00 0.00 33.50 32.54 2dgr n PRO 158 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2dgr n GLU 159 N -0.96 1.03 -0.06 0.54 0.28 -1.26 -4.38 120.64 115.83 2dgr n GLU 159 Ca 0.11 0.01 -0.13 0.00 -0.16 0.00 0.00 57.16 56.99 2dgr n GLU 159 Cb 0.05 -1.04 -0.06 0.00 1.43 0.00 0.00 31.44 31.82 2dgr n GLU 159 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2dgr h ASN 160 N 0.00 0.44 -0.25 -1.84 4.21 -1.85 -2.88 115.58 113.41 2dgr h ASN 160 Ca -0.05 -0.46 -0.11 0.00 1.21 0.00 0.00 56.30 56.89 2dgr h ASN 160 Cb 1.08 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 38.14 2dgr h ASN 160 CO -0.00 0.80 -0.24 -0.37 -1.29 0.00 0.00 177.43 176.33 2dgr h VAL 161 N 0.08 1.27 -0.79 2.81 -1.51 -1.66 -2.90 116.25 113.55 2dgr h VAL 161 Ca 0.03 -1.34 0.05 0.00 -1.23 0.00 0.00 66.70 64.21 2dgr h VAL 161 Cb 0.67 1.25 -0.05 0.00 -2.13 0.00 0.00 31.29 31.02 2dgr h VAL 161 CO 0.04 0.44 0.49 -0.78 -1.23 0.00 0.00 177.57 176.53 2dgr h ASP 162 N 0.64 0.78 -0.12 4.19 1.82 -1.75 -2.51 116.42 119.46 2dgr h ASP 162 Ca 0.09 0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 56.73 2dgr h ASP 162 Cb 0.74 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 40.59 2dgr h ASP 162 CO 0.06 0.52 0.04 -0.09 -1.61 0.00 0.00 179.24 178.15 2dgr h ARG 163 N 0.92 0.19 -0.65 0.28 2.43 -1.37 -3.05 114.38 113.14 2dgr h ARG 163 Ca 0.33 -0.04 0.14 0.00 -0.81 0.00 0.00 59.98 59.60 2dgr h ARG 163 Cb 0.10 -0.03 -0.11 0.00 -0.42 0.00 0.00 29.97 29.51 2dgr h ARG 163 CO -0.14 0.34 0.01 0.00 -1.51 0.00 0.00 179.97 178.67 2dgr h ALA 164 N 0.85 0.66 -0.80 2.80 0.00 -1.27 0.26 119.26 121.76 2dgr h ALA 164 Ca 0.04 0.19 0.15 0.00 0.00 0.00 0.00 54.91 55.30 2dgr h ALA 164 Cb 0.23 0.33 -0.10 0.00 0.00 0.00 0.00 17.79 18.25 2dgr h ALA 164 CO -0.00 -0.39 0.34 -0.09 0.00 0.00 0.00 179.25 179.11 2dgr h ARG 165 N 0.13 0.46 -0.69 0.00 2.43 -1.35 -0.03 114.38 115.33 2dgr h ARG 165 Ca 0.34 -0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.59 2dgr h ARG 165 Cb 0.56 -0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 29.93 2dgr h ARG 165 CO -0.55 0.30 0.29 0.93 -1.51 0.00 0.00 179.97 179.44 2dgr h GLU 166 N 0.47 0.46 0.38 0.20 5.08 -0.92 0.27 114.58 120.53 2dgr h GLU 166 Ca 0.45 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.76 2dgr h GLU 166 Cb 0.70 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2dgr h GLU 166 CO -0.42 0.31 -0.18 0.93 -1.00 0.00 0.00 179.01 178.65 2dgr h GLU 167 N 0.48 -0.49 -0.78 2.33 4.39 -0.93 0.31 114.58 119.87 2dgr h GLU 167 Ca 0.36 0.03 0.18 0.00 0.34 0.00 0.00 59.36 60.27 2dgr h GLU 167 Cb 0.46 0.11 -0.12 0.00 -0.10 0.00 0.00 28.75 29.10 2dgr h GLU 167 CO -0.33 -0.18 0.17 0.82 -1.16 0.00 0.00 179.01 178.33 2dgr h ILE 168 N -0.92 0.43 -0.18 3.13 2.04 -0.93 -0.64 117.51 120.44 2dgr h ILE 168 Ca -0.05 -0.08 -0.08 0.00 1.00 0.00 0.00 64.86 65.65 2dgr h ILE 168 Cb 0.54 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2dgr h ILE 168 CO 0.09 0.04 -0.22 -0.33 0.00 0.00 0.00 178.15 177.73 2dgr h GLU 169 N 0.23 0.46 -0.80 2.37 5.08 -0.96 -3.29 114.58 117.67 2dgr h GLU 169 Ca 0.46 -0.26 0.10 0.00 -1.00 0.00 0.00 59.36 58.66 2dgr h GLU 169 Cb 0.83 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.97 2dgr h GLU 169 CO -0.58 0.84 -0.48 0.00 -1.00 0.00 0.00 179.01 177.79 2dgr h ALA 170 N 0.61 -0.31 -1.18 3.43 0.00 0.64 0.46 119.26 122.92 2dgr h ALA 170 Ca 0.02 0.15 0.39 0.00 0.00 0.00 0.00 54.91 55.47 2dgr h ALA 170 Cb 0.78 1.11 -0.10 0.00 0.00 0.00 0.00 17.79 19.58 2dgr h ALA 170 CO 0.05 -0.84 0.79 0.72 0.00 0.00 0.00 179.25 179.97 2dgr n HIS 171 N -5.37 0.42 -0.09 0.00 8.25 -0.94 0.16 115.22 117.63 2dgr n HIS 171 Ca 0.04 0.42 -0.06 0.00 -0.26 0.00 0.00 57.72 57.85 2dgr n HIS 171 Cb 0.33 -0.82 0.01 0.00 1.12 0.00 0.00 29.99 30.63 2dgr n HIS 171 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2dgr h ILE 172 N 0.00 0.76 -1.05 1.59 2.04 -0.24 -2.07 117.51 118.54 2dgr h ILE 172 Ca 0.69 -0.03 -0.55 0.00 1.00 0.00 0.00 64.86 65.97 2dgr h ILE 172 Cb 2.38 0.66 -0.22 0.00 -0.74 0.00 0.00 36.82 38.90 2dgr h ILE 172 CO -0.28 0.02 0.67 1.07 0.00 0.00 0.00 178.15 179.63 2dgr n THR 173 N -5.17 3.31 -4.24 -0.27 5.66 0.41 -4.94 114.28 109.05 2dgr n THR 173 Ca 0.01 -2.83 -0.31 0.00 -3.05 0.00 0.00 64.05 57.87 2dgr n THR 173 Cb 0.17 -1.33 -0.09 0.00 -1.55 0.00 0.00 70.33 67.53 2dgr n THR 173 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2dgr s LEU 174 N -2.92 3.30 -0.76 1.09 2.96 -0.78 -5.04 118.68 116.53 2dgr s LEU 174 Ca 0.51 -0.21 0.01 0.00 -0.22 0.00 0.00 54.13 54.23 2dgr s LEU 174 Cb 0.39 -2.01 0.36 0.00 0.50 0.00 0.00 46.19 45.43 2dgr s LEU 174 CO -0.13 0.21 1.58 -2.11 -1.32 0.00 0.00 176.35 174.57 2dgr n ARG 175 N 0.88 3.71 -3.73 1.98 1.85 -1.26 -4.88 116.66 115.22 2dgr n ARG 175 Ca -0.13 -4.28 -0.29 0.00 -1.00 0.00 0.00 57.85 52.15 2dgr n ARG 175 Cb 0.52 -2.31 -0.06 0.00 -1.05 0.00 0.00 32.46 29.56 2dgr n ARG 175 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2dgr n SER 176 N -0.35 -0.78 -4.03 2.89 2.88 -1.26 -4.86 113.62 108.10 2dgr n SER 176 Ca 0.45 -0.91 -0.30 0.00 -1.33 0.00 0.00 58.87 56.78 2dgr n SER 176 Cb 0.36 -1.15 0.20 0.00 -0.75 0.00 0.00 64.21 62.87 2dgr n SER 176 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dgr s GLY 177 N -2.99 1.74 -0.03 0.46 0.00 -1.26 -4.98 107.32 100.26 2dgr s GLY 177 Ca 0.44 -1.16 -0.30 0.00 0.00 0.00 0.00 44.72 43.70 2dgr s GLY 177 CO 0.74 -0.36 1.47 2.56 0.00 0.00 0.00 173.10 177.51 2dgr s PRO 178 N -5.79 4.24 0.14 2.90 0.04 -1.26 -4.98 135.00 130.29 2dgr s PRO 178 Ca 0.74 2.02 -0.31 0.00 0.04 0.00 0.00 61.00 63.49 2dgr s PRO 178 Cb -0.05 -3.69 -0.08 0.00 0.04 0.00 0.00 34.50 30.72 2dgr s PRO 178 CO 0.54 -0.67 1.35 0.45 0.04 0.00 0.00 177.00 178.71 2dgr s SER 179 N 2.28 6.87 0.78 6.66 0.15 -1.26 -4.96 113.70 124.22 2dgr s SER 179 Ca 0.66 2.33 -0.17 0.00 0.70 0.00 0.00 55.95 59.47 2dgr s SER 179 Cb -0.31 -2.59 -0.10 0.00 -1.71 0.00 0.00 66.02 61.30 2dgr s SER 179 CO 0.26 -0.60 -0.12 -0.24 1.20 0.00 0.00 173.24 173.75 2dgr n SER 180 N 3.50 -3.62 0.00 5.45 2.88 -1.26 -5.32 113.62 115.24 2dgr n SER 180 Ca 0.09 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 58.08 2dgr n SER 180 Cb 0.43 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 62.93 2dgr n SER 180 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42