#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3aha h MET 118 N 0.00 0.82 -0.53 -0.99 2.86 -2.06 -0.45 114.93 114.58 3aha h MET 118 Ca 0.00 -0.24 -0.07 0.00 -2.06 0.00 0.00 59.70 57.33 3aha h MET 118 Cb 0.00 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 3aha h MET 118 CO 0.00 0.84 0.04 0.93 1.06 0.00 0.00 176.91 179.78 3aha h GLU 119 N 0.69 0.92 -0.26 1.72 4.39 -2.05 -2.58 114.58 117.40 3aha h GLU 119 Ca 0.14 -0.27 0.03 0.00 0.34 0.00 0.00 59.36 59.61 3aha h GLU 119 Cb 0.44 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.96 3aha h GLU 119 CO 0.01 0.91 0.06 2.35 -1.16 0.00 0.00 179.01 181.18 3aha h TRP 120 N 0.79 0.10 -0.62 4.33 7.01 -1.95 -0.95 115.95 124.66 3aha h TRP 120 Ca 0.16 0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.23 3aha h TRP 120 Cb 0.47 -0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.47 3aha h TRP 120 CO 0.03 0.03 0.33 -0.44 -2.79 0.00 0.00 178.44 175.60 3aha h ASP 121 N 0.16 0.47 -0.32 2.65 3.32 -0.95 0.77 116.42 122.52 3aha h ASP 121 Ca 0.12 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 3aha h ASP 121 Cb 0.12 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3aha h ASP 121 CO -0.15 0.31 0.17 -0.09 -1.72 0.00 0.00 179.24 177.75 3aha h ARG 122 N 0.61 0.45 -0.40 3.56 2.43 -1.06 -1.92 114.38 118.05 3aha h ARG 122 Ca 0.28 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.26 3aha h ARG 122 Cb 0.20 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3aha h ARG 122 CO -0.19 0.40 -0.30 0.93 -1.51 0.00 0.00 179.97 179.30 3aha h GLU 123 N 0.39 0.86 -0.54 0.20 5.08 -0.74 -1.17 114.58 118.67 3aha h GLU 123 Ca 0.11 -0.40 0.05 0.00 -1.00 0.00 0.00 59.36 58.12 3aha h GLU 123 Cb 0.09 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 3aha h GLU 123 CO -0.02 1.04 0.28 0.82 -1.00 0.00 0.00 179.01 180.14 3aha h ILE 124 N 0.73 0.96 -0.35 3.13 1.08 -0.79 -1.57 117.51 120.70 3aha h ILE 124 Ca 0.08 -0.18 -0.02 0.00 -0.39 0.00 0.00 64.86 64.35 3aha h ILE 124 Cb 0.85 0.37 -0.02 0.00 -3.07 0.00 0.00 36.82 34.96 3aha h ILE 124 CO 0.08 0.10 0.14 0.78 -0.69 0.00 0.00 178.15 178.56 3aha h ASN 125 N 0.54 0.47 -0.32 1.72 2.35 -0.95 -0.41 115.58 118.98 3aha h ASN 125 Ca 0.24 -0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3aha h ASN 125 Cb 0.14 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 3aha h ASN 125 CO -0.16 0.50 0.19 0.11 -1.65 0.00 0.00 177.43 176.42 3aha h LYS 126 N 0.41 0.44 -0.07 0.81 1.57 -1.03 -1.36 116.57 117.33 3aha h LYS 126 Ca 0.12 -0.04 -0.18 0.00 -1.87 0.00 0.00 60.65 58.67 3aha h LYS 126 Cb 0.17 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3aha h LYS 126 CO -0.01 0.34 -0.74 1.88 -0.57 0.00 0.00 179.45 180.35 3aha h TYR 127 N 0.41 0.53 -0.62 -1.35 0.05 -1.24 -1.50 116.97 113.25 3aha h TYR 127 Ca 0.11 -0.24 0.00 0.00 0.05 0.00 0.00 58.73 58.66 3aha h TYR 127 Cb 0.02 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 3aha h TYR 127 CO -0.04 1.00 0.40 1.15 -1.05 0.00 0.00 178.16 179.62 3aha h THR 128 N 0.27 1.17 -0.25 -2.88 2.02 -0.95 -0.42 112.91 111.85 3aha h THR 128 Ca -0.03 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 3aha h THR 128 Cb 1.31 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3aha h THR 128 CO 0.13 0.17 0.11 -1.28 0.37 0.00 0.00 175.52 175.02 3aha h SER 129 N 0.84 0.33 -0.19 4.18 0.87 -1.11 -2.05 113.55 116.42 3aha h SER 129 Ca 0.23 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 3aha h SER 129 Cb -0.07 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 3aha h SER 129 CO -0.05 0.38 0.12 0.25 -0.53 0.00 0.00 176.83 177.01 3aha h LEU 130 N 0.27 0.22 -0.82 2.23 5.85 -1.03 -1.86 115.31 120.17 3aha h LEU 130 Ca 0.09 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.79 3aha h LEU 130 Cb 0.14 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 3aha h LEU 130 CO -0.01 0.18 0.53 0.40 -0.34 0.00 0.00 178.44 179.20 3aha h ILE 131 N 0.25 1.21 -0.32 4.05 2.04 -1.04 -0.76 117.51 122.95 3aha h ILE 131 Ca 0.07 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 65.54 3aha h ILE 131 Cb -0.01 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.07 3aha h ILE 131 CO -0.01 0.21 0.19 -0.74 0.00 0.00 0.00 178.15 177.79 3aha h HIS 132 N 1.11 0.35 -0.74 1.37 2.76 -1.10 0.66 115.15 119.56 3aha h HIS 132 Ca 0.30 0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.52 3aha h HIS 132 Cb -0.12 -0.11 -0.05 0.00 1.55 0.00 0.00 27.41 28.68 3aha h HIS 132 CO -0.01 0.21 0.45 0.77 -1.30 0.00 0.00 177.93 178.05 3aha h SER 133 N 0.39 0.72 -0.46 3.26 0.02 -0.94 -1.35 113.55 115.19 3aha h SER 133 Ca 0.12 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.96 3aha h SER 133 Cb -0.01 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 3aha h SER 133 CO -0.05 0.48 -0.20 -0.07 -1.14 0.00 0.00 176.83 175.86 3aha h LEU 134 N 0.86 0.96 -0.53 5.07 3.38 -0.70 -0.88 115.31 123.47 3aha h LEU 134 Ca 0.31 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 3aha h LEU 134 Cb 0.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3aha h LEU 134 CO -0.14 1.14 0.07 0.40 0.09 0.00 0.00 178.44 180.00 3aha h ILE 135 N 0.78 1.26 -0.42 1.22 2.04 -0.69 0.11 117.51 121.81 3aha h ILE 135 Ca 0.10 -0.99 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 3aha h ILE 135 Cb 0.77 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 3aha h ILE 135 CO 0.06 0.35 0.25 -0.33 0.00 0.00 0.00 178.15 178.49 3aha h GLU 136 N 0.77 0.57 -0.65 2.37 4.39 -1.13 0.95 114.58 121.84 3aha h GLU 136 Ca 0.16 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.82 3aha h GLU 136 Cb 0.43 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.93 3aha h GLU 136 CO 0.01 0.42 0.43 0.37 -1.16 0.00 0.00 179.01 179.08 3aha h GLN 137 N 0.55 0.84 -0.67 2.33 4.15 -0.97 -1.56 115.11 119.78 3aha h GLN 137 Ca 0.15 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.48 3aha h GLN 137 Cb 0.00 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.47 3aha h GLN 137 CO -0.03 0.56 0.25 0.77 -1.93 0.00 0.00 178.83 178.45 3aha h SER 138 N 0.87 0.93 -0.37 -0.69 0.02 -0.39 -1.22 113.55 112.70 3aha h SER 138 Ca 0.25 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3aha h SER 138 Cb -0.07 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 3aha h SER 138 CO -0.06 0.86 0.22 1.56 -1.14 0.00 0.00 176.83 178.26 3aha h GLN 139 N 0.95 0.50 -0.67 3.45 4.20 -0.48 0.34 115.11 123.40 3aha h GLN 139 Ca 0.22 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 3aha h GLN 139 Cb 0.23 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 3aha h GLN 139 CO -0.02 0.39 0.33 -0.91 -0.67 0.00 0.00 178.83 177.95 3aha h ASN 140 N 0.48 0.87 -0.27 1.46 2.35 -1.13 -1.94 115.58 117.40 3aha h ASN 140 Ca 0.13 -0.13 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 3aha h ASN 140 Cb 0.02 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 3aha h ASN 140 CO -0.02 0.75 -0.18 -0.61 -1.65 0.00 0.00 177.43 175.72 3aha h GLN 141 N 0.92 0.71 -0.38 0.81 5.75 -1.02 -2.19 115.11 119.72 3aha h GLN 141 Ca 0.23 -0.26 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 3aha h GLN 141 Cb 0.11 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.59 3aha h GLN 141 CO -0.03 0.84 0.20 0.37 -2.65 0.00 0.00 178.83 177.56 3aha h GLN 142 N 0.64 0.53 -0.71 1.69 5.75 -0.62 0.59 115.11 122.98 3aha h GLN 142 Ca 0.10 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 3aha h GLN 142 Cb 0.65 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.07 3aha h GLN 142 CO 0.05 0.45 0.37 0.93 -2.65 0.00 0.00 178.83 177.97 3aha h GLU 143 N 0.48 1.01 -0.24 1.69 4.39 -1.25 -1.28 114.58 119.37 3aha h GLU 143 Ca 0.13 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 3aha h GLU 143 Cb 0.08 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 3aha h GLU 143 CO -0.02 0.78 0.12 -0.22 -1.16 0.00 0.00 179.01 178.51 3aha h LYS 144 N 0.99 0.35 -0.86 2.33 3.64 -1.10 -2.11 116.57 119.81 3aha h LYS 144 Ca 0.25 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 3aha h LYS 144 Cb 0.08 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 3aha h LYS 144 CO -0.04 0.34 0.51 -0.91 -2.27 0.00 0.00 179.45 177.09 3aha h ASN 145 N 0.26 1.03 -0.58 4.20 2.35 -0.68 -1.04 115.58 121.12 3aha h ASN 145 Ca 0.08 -0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.68 3aha h ASN 145 Cb 0.11 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 3aha h ASN 145 CO -0.01 0.79 0.04 -0.33 -1.65 0.00 0.00 177.43 176.27 3aha h GLU 146 N 1.18 1.02 -0.72 0.81 5.08 -1.12 -2.54 114.58 118.28 3aha h GLU 146 Ca 0.31 -0.29 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 3aha h GLU 146 Cb -0.04 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 3aha h GLU 146 CO -0.06 0.98 0.23 1.96 -1.00 0.00 0.00 179.01 181.11 3aha h GLN 147 N 0.94 1.11 0.00 2.33 4.20 -1.05 -2.94 115.11 119.71 3aha h GLN 147 Ca 0.18 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.66 3aha h GLN 147 Cb 0.49 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.11 3aha h GLN 147 CO 0.02 0.94 0.00 0.93 -0.67 0.00 0.00 178.83 180.06 3aha h GLU 148 N 1.07 0.00 0.00 1.46 5.08 -0.78 -3.52 114.58 117.89 3aha h GLU 148 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3aha h GLU 148 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3aha h GLU 148 CO -0.01 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.28