#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cxx s GLU 118 N 0.00 4.02 -0.20 0.00 2.02 -1.26 -4.59 118.70 118.69 1cxx s GLU 118 Ca 0.00 -2.36 -0.16 0.00 0.02 0.00 0.00 54.97 52.47 1cxx s GLU 118 Cb 0.00 -5.15 0.05 0.00 0.10 0.00 0.00 34.13 29.13 1cxx s GLU 118 CO 0.00 -1.88 0.51 -1.59 0.02 0.00 0.00 175.26 172.33 1cxx s LYS 119 N 2.28 0.58 -0.35 1.61 0.00 -1.26 -3.00 119.74 119.61 1cxx s LYS 119 Ca 0.44 0.76 -0.20 0.00 0.00 0.00 0.00 55.97 56.97 1cxx s LYS 119 Cb -0.02 0.24 0.00 0.00 0.00 0.00 0.00 37.83 38.05 1cxx s LYS 119 CO 0.01 -0.09 0.63 0.00 0.00 0.00 0.00 175.35 175.90 1cxx n SER 121 N 6.02 0.54 -0.07 0.00 7.64 -1.26 -1.85 113.62 124.63 1cxx n SER 121 Ca -0.01 -1.56 -0.07 0.00 1.01 0.00 0.00 58.87 58.24 1cxx n SER 121 Cb 0.49 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.61 1cxx n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1cxx h ALA 122 N 3.68 0.04 0.00 -0.43 0.00 -1.90 -3.39 119.26 117.25 1cxx h ALA 122 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1cxx h ALA 122 Cb 0.15 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1cxx h ALA 122 CO 0.00 0.39 -0.72 0.00 0.00 0.00 0.00 179.25 178.92 1cxx n GLY 124 N 1.39 1.39 3.90 0.00 0.00 -0.77 -5.04 105.19 106.05 1cxx n GLY 124 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1cxx n GLY 124 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cxx s ASP 125 N -3.14 6.35 0.52 1.61 1.01 -1.17 -4.85 116.67 117.00 1cxx s ASP 125 Ca 0.00 0.88 -0.11 0.00 0.71 0.00 0.00 52.55 54.03 1cxx s ASP 125 Cb 0.00 -2.22 -0.06 0.00 1.01 0.00 0.00 42.92 41.65 1cxx s ASP 125 CO 0.00 -0.44 0.92 -0.55 0.21 0.00 0.00 175.17 175.31 1cxx s SER 126 N -3.74 6.41 0.61 0.27 0.15 -1.26 -1.11 113.70 115.04 1cxx s SER 126 Ca 0.47 1.32 -0.06 0.00 0.70 0.00 0.00 55.95 58.37 1cxx s SER 126 Cb -0.10 -2.41 0.02 0.00 -1.71 0.00 0.00 66.02 61.81 1cxx s SER 126 CO 0.38 -0.64 0.92 0.68 1.20 0.00 0.00 173.24 175.79 1cxx s VAL 127 N -2.77 3.43 0.00 4.45 -7.23 -1.16 -4.71 120.40 112.41 1cxx s VAL 127 Ca 0.54 -0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.68 1cxx s VAL 127 Cb -0.10 -3.38 0.00 0.00 0.56 0.00 0.00 36.38 33.45 1cxx s VAL 127 CO 0.41 -0.40 0.00 0.00 -0.31 0.00 0.00 175.10 174.80 1cxx n TYR 128 N -2.64 0.00 0.07 2.82 9.36 -1.26 -4.87 117.16 120.64 1cxx n TYR 128 Ca 0.05 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.27 1cxx n TYR 128 Cb 0.58 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.29 1cxx n TYR 128 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1cxx n ALA 129 N -3.00 0.00 -3.30 2.98 0.00 -1.26 -5.01 120.51 110.93 1cxx n ALA 129 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1cxx n ALA 129 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1cxx n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cxx n ALA 130 N -2.86 4.40 0.14 0.00 0.00 -1.26 -4.60 120.51 116.33 1cxx n ALA 130 Ca 0.00 -4.79 0.00 0.00 0.00 0.00 0.00 53.44 48.65 1cxx n ALA 130 Cb 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.16 1cxx n ALA 130 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1cxx n GLU 131 N 0.94 0.00 -1.80 0.00 2.13 -1.26 -5.13 120.64 115.52 1cxx n GLU 131 Ca 0.29 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.70 1cxx n GLU 131 Cb 0.39 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.09 1cxx n GLU 131 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1cxx s LYS 132 N -1.74 4.13 -0.07 5.31 0.00 -1.26 -4.55 119.74 121.56 1cxx s LYS 132 Ca 0.00 2.56 -0.21 0.00 0.00 0.00 0.00 55.97 58.33 1cxx s LYS 132 Cb 0.00 -3.01 -0.04 0.00 0.00 0.00 0.00 37.83 34.77 1cxx s LYS 132 CO 0.00 -0.59 0.59 0.08 0.00 0.00 0.00 175.35 175.43 1cxx s VAL 133 N -0.32 5.06 -0.15 1.79 1.01 -0.42 -4.88 120.40 122.49 1cxx s VAL 133 Ca 0.60 1.21 -0.09 0.00 0.00 0.00 0.00 61.98 63.70 1cxx s VAL 133 Cb -0.47 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 1cxx s VAL 133 CO 0.52 0.33 0.15 -0.51 0.00 0.00 0.00 175.10 175.59 1cxx s ILE 134 N 0.43 5.46 -0.69 2.22 2.07 -1.26 -2.04 121.20 127.39 1cxx s ILE 134 Ca 0.31 0.23 0.02 0.00 -1.41 0.00 0.00 60.65 59.80 1cxx s ILE 134 Cb -0.17 -3.44 0.37 0.00 0.13 0.00 0.00 42.46 39.35 1cxx s ILE 134 CO 0.15 0.54 1.53 0.61 -1.91 0.00 0.00 174.94 175.86 1cxx n GLY 135 N 2.60 5.80 2.60 1.50 0.00 -0.67 -4.88 105.19 112.14 1cxx n GLY 135 Ca -0.18 -2.64 -0.05 0.00 0.00 0.00 0.00 46.02 43.15 1cxx n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cxx n ALA 136 N -0.41 -3.14 0.00 4.61 0.00 -1.26 -4.30 120.51 116.01 1cxx n ALA 136 Ca 0.45 0.82 0.00 0.00 0.00 0.00 0.00 53.44 54.71 1cxx n ALA 136 Cb 0.41 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.38 1cxx n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cxx n GLY 137 N -0.05 2.07 3.51 0.00 0.00 -1.26 -4.96 105.19 104.50 1cxx n GLY 137 Ca 0.07 -0.47 -0.45 0.00 0.00 0.00 0.00 46.02 45.17 1cxx n GLY 137 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1cxx n LYS 138 N 0.00 1.20 -3.75 1.61 2.85 -1.26 -4.96 118.16 113.85 1cxx n LYS 138 Ca 0.00 0.27 -0.36 0.00 -1.05 0.00 0.00 58.31 57.16 1cxx n LYS 138 Cb 0.00 -2.78 -0.07 0.00 -0.65 0.00 0.00 35.03 31.54 1cxx n LYS 138 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1cxx s PRO 139 N 6.90 3.85 0.08 -1.58 0.04 -1.26 -1.67 135.00 141.36 1cxx s PRO 139 Ca 1.07 -0.08 0.04 0.00 0.04 0.00 0.00 61.00 62.07 1cxx s PRO 139 Cb -0.62 -3.30 -0.03 0.00 0.04 0.00 0.00 34.50 30.58 1cxx s PRO 139 CO 0.41 0.53 -0.12 -1.58 0.04 0.00 0.00 177.00 176.28 1cxx s TRP 140 N -0.35 1.09 0.78 0.56 0.52 -0.86 -3.32 118.94 117.36 1cxx s TRP 140 Ca 0.14 -0.52 -0.11 0.00 0.02 0.00 0.00 56.10 55.62 1cxx s TRP 140 Cb -0.12 -0.61 0.06 0.00 -1.15 0.00 0.00 33.47 31.65 1cxx s TRP 140 CO 0.03 0.02 1.11 -1.01 0.02 0.00 0.00 176.95 177.12 1cxx s HIS 141 N -1.63 2.42 0.30 -1.98 3.76 -1.26 -1.29 115.29 115.60 1cxx s HIS 141 Ca -0.01 1.59 -0.02 0.00 -0.15 0.00 0.00 55.06 56.47 1cxx s HIS 141 Cb -0.08 -3.12 0.44 0.00 1.11 0.00 0.00 32.58 30.92 1cxx s HIS 141 CO 0.01 -1.97 1.96 0.87 -0.85 0.00 0.00 174.74 174.77 1cxx h LYS 142 N -1.06 1.08 0.10 1.40 1.57 -1.92 -1.79 116.57 115.95 1cxx h LYS 142 Ca -0.44 -0.07 -0.27 0.00 -1.87 0.00 0.00 60.65 58.00 1cxx h LYS 142 Cb 1.24 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 1cxx h LYS 142 CO 0.50 0.72 -1.25 -0.91 -0.57 0.00 0.00 179.45 177.95 1cxx h ASN 143 N 1.11 0.32 0.66 0.86 2.35 -1.94 -3.26 115.58 115.69 1cxx h ASN 143 Ca 0.30 -0.36 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1cxx h ASN 143 Cb -0.11 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.16 1cxx h ASN 143 CO -0.06 1.29 0.00 0.00 -1.65 0.00 0.00 177.43 177.01 1cxx s PHE 145 N -2.88 2.23 -0.03 0.00 2.19 -0.71 -4.85 117.98 113.94 1cxx s PHE 145 Ca 0.14 -0.08 0.04 0.00 0.33 0.00 0.00 56.93 57.35 1cxx s PHE 145 Cb 0.15 -4.55 -0.00 0.00 -1.31 0.00 0.00 43.02 37.30 1cxx s PHE 145 CO 0.39 -2.06 -0.15 1.03 1.83 0.00 0.00 175.22 176.25 1cxx s ARG 146 N 5.80 1.47 0.91 10.12 0.52 -1.26 -3.15 118.95 133.37 1cxx s ARG 146 Ca 0.43 -0.53 -0.11 0.00 -0.52 0.00 0.00 55.73 55.00 1cxx s ARG 146 Cb -0.07 -1.33 0.14 0.00 0.52 0.00 0.00 34.95 34.22 1cxx s ARG 146 CO 0.10 0.24 1.11 0.00 0.02 0.00 0.00 175.30 176.76 1cxx n ALA 148 N -4.11 2.50 -0.05 0.00 0.00 -0.20 -3.87 120.51 114.79 1cxx n ALA 148 Ca 0.09 -0.48 -0.04 0.00 0.00 0.00 0.00 53.44 53.00 1cxx n ALA 148 Cb 0.53 -0.17 -0.01 0.00 0.00 0.00 0.00 19.45 19.79 1cxx n ALA 148 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1cxx n LYS 149 N 0.10 0.28 -0.08 0.00 4.76 -1.26 -4.83 118.16 117.13 1cxx n LYS 149 Ca 0.03 0.17 -0.23 0.00 -2.87 0.00 0.00 58.31 55.41 1cxx n LYS 149 Cb 0.12 -1.05 -0.12 0.00 -1.84 0.00 0.00 35.03 32.14 1cxx n LYS 149 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1cxx n GLY 151 N 1.62 0.85 2.60 0.00 0.00 -1.25 -5.03 105.19 103.99 1cxx n GLY 151 Ca -0.36 -0.59 -0.19 0.00 0.00 0.00 0.00 46.02 44.88 1cxx n GLY 151 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1cxx n LYS 152 N -0.62 0.60 -2.04 1.61 2.85 -1.26 -4.79 118.16 114.50 1cxx n LYS 152 Ca 0.00 -2.68 -0.39 0.00 -1.05 0.00 0.00 58.31 54.19 1cxx n LYS 152 Cb 0.21 1.58 0.00 0.00 -0.65 0.00 0.00 35.03 36.18 1cxx n LYS 152 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1cxx s SER 153 N -2.94 6.16 -0.27 -5.58 1.04 -1.26 -2.04 113.70 108.82 1cxx s SER 153 Ca 0.19 2.63 -0.21 0.00 0.48 0.00 0.00 55.95 59.04 1cxx s SER 153 Cb 0.01 -2.63 0.07 0.00 0.10 0.00 0.00 66.02 63.57 1cxx s SER 153 CO 0.13 -0.95 0.69 -1.48 0.98 0.00 0.00 173.24 172.62 1cxx s LEU 154 N -2.63 -0.77 -0.36 2.42 0.05 -1.19 -4.89 118.68 111.31 1cxx s LEU 154 Ca 0.59 1.45 -0.03 0.00 0.05 0.00 0.00 54.13 56.19 1cxx s LEU 154 Cb -0.37 2.39 0.19 0.00 -2.05 0.00 0.00 46.19 46.34 1cxx s LEU 154 CO 0.47 -0.24 0.92 -0.70 -0.55 0.00 0.00 176.35 176.25 1cxx s GLU 155 N 0.86 0.40 0.45 1.48 2.12 -1.26 -4.75 118.70 118.00 1cxx s GLU 155 Ca -0.04 -0.18 0.08 0.00 0.36 0.00 0.00 54.97 55.18 1cxx s GLU 155 Cb -0.05 0.04 0.08 0.00 0.26 0.00 0.00 34.13 34.45 1cxx s GLU 155 CO -0.07 -0.57 0.63 0.43 -0.54 0.00 0.00 175.26 175.14 1cxx n SER 156 N 3.73 1.64 -0.06 -1.70 7.64 -1.26 -5.07 113.62 118.54 1cxx n SER 156 Ca 0.08 -2.20 -0.05 0.00 1.01 0.00 0.00 58.87 57.71 1cxx n SER 156 Cb 0.61 -0.33 -0.04 0.00 -1.01 0.00 0.00 64.21 63.44 1cxx n SER 156 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1cxx h THR 157 N 0.08 0.44 0.00 0.44 1.35 -2.04 -3.41 112.91 109.76 1cxx h THR 157 Ca -0.21 -1.37 -0.02 0.00 -0.55 0.00 0.00 66.41 64.26 1cxx h THR 157 Cb 0.97 0.87 -0.00 0.00 -1.73 0.00 0.00 68.15 68.25 1cxx h THR 157 CO 0.30 0.15 -0.20 0.71 -0.25 0.00 0.00 175.52 176.23 1cxx h THR 158 N -1.00 0.49 -2.62 6.82 1.35 -2.03 -3.51 112.91 112.40 1cxx h THR 158 Ca -0.03 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.43 1cxx h THR 158 Cb 0.40 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 1cxx h THR 158 CO -0.02 0.16 -0.62 -0.11 -0.25 0.00 0.00 175.52 174.69 1cxx n LEU 159 N -4.68 -4.26 -4.75 3.87 0.00 -1.26 -5.00 117.00 100.91 1cxx n LEU 159 Ca -0.06 2.10 -0.35 0.00 0.00 0.00 0.00 56.01 57.70 1cxx n LEU 159 Cb 0.22 -1.68 -0.08 0.00 0.00 0.00 0.00 43.42 41.88 1cxx n LEU 159 CO 0.11 -0.27 -0.18 0.42 0.00 0.00 0.00 177.39 177.47 1cxx s THR 160 N -1.92 5.41 -0.25 1.96 -4.23 -1.26 -5.04 115.64 110.31 1cxx s THR 160 Ca 0.00 0.19 -0.13 0.00 -1.18 0.00 0.00 61.69 60.56 1cxx s THR 160 Cb 0.00 -3.45 0.08 0.00 1.34 0.00 0.00 72.50 70.47 1cxx s THR 160 CO 0.00 0.47 0.61 -1.83 -0.54 0.00 0.00 174.62 173.33 1cxx s GLU 161 N 0.13 0.60 0.52 3.99 1.03 -1.26 -2.53 118.70 121.18 1cxx s GLU 161 Ca 0.09 1.14 0.03 0.00 0.03 0.00 0.00 54.97 56.26 1cxx s GLU 161 Cb -0.11 0.19 0.01 0.00 -0.80 0.00 0.00 34.13 33.41 1cxx s GLU 161 CO -0.01 -0.16 0.19 0.15 -1.33 0.00 0.00 175.26 174.10 1cxx s LYS 162 N 1.76 2.22 -0.31 -4.83 -0.14 -0.38 -5.00 119.74 113.06 1cxx s LYS 162 Ca -0.09 -2.20 0.01 0.00 -1.36 0.00 0.00 55.97 52.33 1cxx s LYS 162 Cb -0.07 -1.81 0.36 0.00 -1.68 0.00 0.00 37.83 34.63 1cxx s LYS 162 CO -0.18 -0.46 1.71 -0.85 -0.76 0.00 0.00 175.35 174.81 1cxx n GLU 163 N -1.49 1.84 0.00 1.68 0.28 -1.26 -3.15 120.64 118.54 1cxx n GLU 163 Ca -0.10 -1.87 0.00 0.00 -0.16 0.00 0.00 57.16 55.03 1cxx n GLU 163 Cb 0.66 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.79 1cxx n GLU 163 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1cxx n GLY 164 N -0.31 -1.33 0.00 -1.84 0.00 -1.26 -5.14 105.19 95.30 1cxx n GLY 164 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1cxx n GLY 164 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1cxx n GLU 165 N 0.00 -0.01 -4.87 1.61 1.02 -1.19 -5.10 120.64 112.11 1cxx n GLU 165 Ca 0.00 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.85 1cxx n GLU 165 Cb 0.40 0.00 -0.17 0.00 -0.02 0.00 0.00 31.44 31.66 1cxx n GLU 165 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1cxx s ILE 166 N -2.40 1.62 0.41 -3.67 -4.36 -1.26 -1.25 121.20 110.29 1cxx s ILE 166 Ca 0.00 -0.75 0.06 0.00 -0.26 0.00 0.00 60.65 59.70 1cxx s ILE 166 Cb 0.00 -1.43 -0.07 0.00 1.25 0.00 0.00 42.46 42.21 1cxx s ILE 166 CO 0.00 0.46 0.01 -0.31 0.24 0.00 0.00 174.94 175.35 1cxx s TYR 167 N 0.55 2.43 0.09 1.37 1.51 -1.05 -1.03 117.35 121.23 1cxx s TYR 167 Ca -0.16 -0.71 -0.12 0.00 -1.01 0.00 0.00 57.07 55.07 1cxx s TYR 167 Cb -0.17 -1.73 -0.06 0.00 -0.11 0.00 0.00 41.96 39.89 1cxx s TYR 167 CO 0.06 0.40 0.45 0.00 -1.11 0.00 0.00 175.55 175.34 1cxx h LYS 169 N 3.74 0.00 0.00 0.00 -0.00 -1.95 -2.63 116.57 115.73 1cxx h LYS 169 Ca -0.49 0.00 -0.05 0.00 -0.00 0.00 0.00 60.65 60.11 1cxx h LYS 169 Cb 1.20 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.42 1cxx h LYS 169 CO 0.66 0.10 -0.23 0.78 -0.00 0.00 0.00 179.45 180.76 1cxx h GLY 170 N 1.70 0.00 1.31 0.07 0.00 -1.97 -1.81 103.07 102.38 1cxx h GLY 170 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1cxx h GLY 170 CO 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.54 1cxx h TYR 172 N 0.77 0.00 -0.35 0.00 -1.99 -1.60 -1.89 116.97 111.92 1cxx h TYR 172 Ca 0.15 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.71 1cxx h TYR 172 Cb 0.48 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.21 1cxx h TYR 172 CO 0.03 0.10 -0.44 0.00 -0.00 0.00 0.00 178.16 177.84 1cxx h ALA 173 N 1.90 0.55 -0.12 3.88 0.00 -0.93 -3.14 119.26 121.40 1cxx h ALA 173 Ca -0.01 -0.48 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 1cxx h ALA 173 Cb 1.08 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1cxx h ALA 173 CO 0.01 0.68 -0.28 0.87 0.00 0.00 0.00 179.25 180.53 1cxx h LYS 174 N 0.73 0.40 -0.01 0.00 1.57 -1.39 -3.51 116.57 114.37 1cxx h LYS 174 Ca 0.05 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1cxx h LYS 174 Cb 1.04 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1cxx h LYS 174 CO 0.10 0.88 0.00 -1.71 -0.57 0.00 0.00 179.45 178.16