#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whr s SER 127 N 0.00 6.75 -0.02 1.61 0.01 -1.26 -4.96 113.70 115.83 1whr s SER 127 Ca 0.00 -2.23 0.03 0.00 1.31 0.00 0.00 55.95 55.06 1whr s SER 127 Cb 0.00 -2.46 0.00 0.00 0.21 0.00 0.00 66.02 63.77 1whr s SER 127 CO 0.00 -1.09 -0.10 -0.55 0.41 0.00 0.00 173.24 171.91 1whr s SER 128 N 3.79 1.25 -0.39 2.44 0.15 -1.26 -5.06 113.70 114.63 1whr s SER 128 Ca 0.41 -0.19 0.11 0.00 0.70 0.00 0.00 55.95 56.98 1whr s SER 128 Cb -0.02 -0.29 0.38 0.00 -1.71 0.00 0.00 66.02 64.38 1whr s SER 128 CO -0.04 0.08 1.01 0.61 1.20 0.00 0.00 173.24 176.10 1whr n GLY 129 N 3.18 1.88 3.55 9.45 0.00 -1.26 -5.08 105.19 116.92 1whr n GLY 129 Ca -0.17 -0.86 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 1whr n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1whr s SER 130 N -2.08 5.48 -0.26 1.61 0.15 -1.26 -4.88 113.70 112.46 1whr s SER 130 Ca 0.29 0.02 -0.27 0.00 0.70 0.00 0.00 55.95 56.69 1whr s SER 130 Cb 0.37 -2.54 0.17 0.00 -1.71 0.00 0.00 66.02 62.31 1whr s SER 130 CO -0.04 -2.28 1.25 -0.94 1.20 0.00 0.00 173.24 172.43 1whr s SER 131 N 7.10 -0.18 0.09 5.45 1.04 -1.26 -4.88 113.70 121.05 1whr s SER 131 Ca 0.60 0.29 0.01 0.00 0.48 0.00 0.00 55.95 57.32 1whr s SER 131 Cb -0.11 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.24 1whr s SER 131 CO 0.17 -0.11 0.23 -0.83 0.98 0.00 0.00 173.24 173.68 1whr s GLY 132 N -0.47 2.04 0.70 7.32 0.00 -1.26 -5.07 107.32 110.58 1whr s GLY 132 Ca 0.05 -0.90 -0.16 0.00 0.00 0.00 0.00 44.72 43.71 1whr s GLY 132 CO -0.08 -0.89 0.57 -1.30 0.00 0.00 0.00 173.10 171.40 1whr n THR 133 N 0.02 1.95 -4.09 0.90 -2.24 -1.26 -5.00 114.28 104.56 1whr n THR 133 Ca -0.06 -0.41 -0.22 0.00 -2.27 0.00 0.00 64.05 61.09 1whr n THR 133 Cb 0.52 -0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 67.94 1whr n THR 133 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1whr s ASP 134 N -1.44 5.65 0.32 3.42 2.15 -1.26 -5.13 116.67 120.38 1whr s ASP 134 Ca 0.67 -0.18 -0.14 0.00 0.43 0.00 0.00 52.55 53.33 1whr s ASP 134 Cb -0.36 -1.48 0.02 0.00 -0.30 0.00 0.00 42.92 40.80 1whr s ASP 134 CO 0.57 -0.03 0.64 -0.94 -0.17 0.00 0.00 175.17 175.24 1whr s SER 135 N -3.76 0.10 -0.03 -0.34 1.04 -1.26 -5.17 113.70 104.28 1whr s SER 135 Ca 0.33 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.72 1whr s SER 135 Cb -0.08 0.73 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 1whr s SER 135 CO 0.25 -1.42 0.02 0.42 0.98 0.00 0.00 173.24 173.50 1whr s THR 136 N -3.21 4.33 0.27 2.02 -4.23 -1.26 -5.10 115.64 108.46 1whr s THR 136 Ca 0.19 -0.45 -0.19 0.00 -1.18 0.00 0.00 61.69 60.06 1whr s THR 136 Cb -0.03 -2.91 0.07 0.00 1.34 0.00 0.00 72.50 70.97 1whr s THR 136 CO 0.12 0.44 0.94 -0.83 -0.54 0.00 0.00 174.62 174.75 1whr s GLY 137 N -1.39 0.26 -0.40 3.99 0.00 -1.26 -5.10 107.32 103.42 1whr s GLY 137 Ca 0.18 -0.56 -0.36 0.00 0.00 0.00 0.00 44.72 43.98 1whr s GLY 137 CO 0.09 1.52 1.60 1.39 0.00 0.00 0.00 173.10 177.70 1whr n ILE 138 N -0.65 0.00 -1.64 0.90 5.41 -1.26 -4.66 119.36 117.45 1whr n ILE 138 Ca -0.05 0.00 -0.15 0.00 1.00 0.00 0.00 62.75 63.55 1whr n ILE 138 Cb 0.60 -0.40 -0.07 0.00 -0.71 0.00 0.00 39.64 39.05 1whr n ILE 138 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 1whr s ASP 139 N 4.17 3.99 0.33 4.38 1.47 -1.26 -4.77 116.67 124.98 1whr s ASP 139 Ca 0.93 -0.23 0.10 0.00 1.18 0.00 0.00 52.55 54.53 1whr s ASP 139 Cb -1.20 -2.56 0.99 0.00 -0.34 0.00 0.00 42.92 39.81 1whr s ASP 139 CO 0.56 -3.87 1.59 -0.07 0.68 0.00 0.00 175.17 174.07 1whr h LEU 140 N 21.89 -0.05 0.19 2.11 3.38 -2.00 0.81 115.31 141.64 1whr h LEU 140 Ca 0.02 0.26 0.01 0.00 0.09 0.00 0.00 57.88 58.25 1whr h LEU 140 Cb 1.00 0.35 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 1whr h LEU 140 CO 1.04 -0.35 -0.51 -0.74 0.09 0.00 0.00 178.44 177.97 1whr h HIS 141 N 0.05 -1.47 -0.80 1.13 2.76 -1.99 -0.78 115.15 114.07 1whr h HIS 141 Ca 0.70 0.03 0.13 0.00 -2.20 0.00 0.00 60.37 59.03 1whr h HIS 141 Cb 1.62 0.62 -0.13 0.00 1.55 0.00 0.00 27.41 31.07 1whr h HIS 141 CO -0.25 -0.60 -0.30 -1.91 -1.30 0.00 0.00 177.93 173.56 1whr n GLU 142 N -5.50 -0.18 0.39 5.26 0.00 0.27 -0.37 120.64 120.51 1whr n GLU 142 Ca -0.09 1.23 -0.15 0.00 0.00 0.00 0.00 57.16 58.14 1whr n GLU 142 Cb 0.42 -1.82 -0.07 0.00 0.00 0.00 0.00 31.44 29.97 1whr n GLU 142 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 1whr h PHE 143 N 0.00 -0.93 -0.99 4.31 3.57 -1.42 -1.48 116.94 120.01 1whr h PHE 143 Ca 0.29 -0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.95 1whr h PHE 143 Cb 0.48 0.31 -0.18 0.00 2.79 0.00 0.00 35.95 39.35 1whr h PHE 143 CO -0.69 -0.58 -0.30 -0.07 -2.23 0.00 0.00 178.31 174.45 1whr h LEU 144 N -1.17 -1.10 0.18 0.59 3.38 0.46 0.25 115.31 117.90 1whr h LEU 144 Ca -0.10 0.30 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1whr h LEU 144 Cb 0.77 0.66 0.00 0.00 0.09 0.00 0.00 40.66 42.18 1whr h LEU 144 CO 0.17 -0.31 -0.08 0.58 0.09 0.00 0.00 178.44 178.88 1whr h VAL 145 N -0.00 0.85 -0.77 1.22 2.07 -0.69 0.41 116.25 119.34 1whr h VAL 145 Ca 0.43 -0.10 0.14 0.00 0.82 0.00 0.00 66.70 67.98 1whr h VAL 145 Cb 0.68 0.91 -0.09 0.00 -1.52 0.00 0.00 31.29 31.27 1whr h VAL 145 CO -1.01 0.02 0.34 -1.13 0.02 0.00 0.00 177.57 175.82 1whr h ASN 146 N -0.28 0.36 0.13 0.57 -0.73 0.45 -1.72 115.58 114.35 1whr h ASN 146 Ca -0.02 0.10 -0.01 0.00 1.87 0.00 0.00 56.30 58.24 1whr h ASN 146 Cb 0.22 0.05 0.00 0.00 0.27 0.00 0.00 38.32 38.87 1whr h ASN 146 CO 0.04 0.15 -0.06 0.74 -0.37 0.00 0.00 177.43 177.93 1whr h THR 147 N 0.51 1.03 -1.14 -3.57 2.02 -0.46 0.27 112.91 111.57 1whr h THR 147 Ca 0.42 -0.79 0.32 0.00 0.77 0.00 0.00 66.41 67.13 1whr h THR 147 Cb 0.60 1.52 -0.07 0.00 -1.74 0.00 0.00 68.15 68.45 1whr h THR 147 CO -0.37 0.18 0.78 -0.07 0.37 0.00 0.00 175.52 176.41 1whr h LEU 148 N -0.56 0.20 0.00 2.58 3.38 -0.37 0.88 115.31 121.43 1whr h LEU 148 Ca -0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1whr h LEU 148 Cb 0.44 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1whr h LEU 148 CO 0.03 0.02 0.00 0.29 0.09 0.00 0.00 178.44 178.87 1whr n LYS 149 N -4.40 0.00 0.09 1.13 5.02 -0.70 -3.90 118.16 115.40 1whr n LYS 149 Ca 0.26 0.19 0.18 0.00 -2.02 0.00 0.00 58.31 56.92 1whr n LYS 149 Cb 1.11 -0.64 0.52 0.00 -0.02 0.00 0.00 35.03 36.00 1whr n LYS 149 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1whr h LYS 150 N 0.00 0.00 -2.81 1.97 1.57 -0.40 -2.78 116.57 114.11 1whr h LYS 150 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 1whr h LYS 150 Cb 0.00 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 31.91 1whr h LYS 150 CO 0.00 0.00 -0.74 -0.80 -0.57 0.00 0.00 179.45 177.34 1whr s ASN 151 N -4.08 3.44 0.36 0.86 -0.87 0.30 -4.93 114.94 110.02 1whr s ASN 151 Ca -0.03 -3.42 0.27 0.00 -1.57 0.00 0.00 52.86 48.11 1whr s ASN 151 Cb 0.11 -1.13 1.12 0.00 -0.02 0.00 0.00 41.25 41.33 1whr s ASN 151 CO 0.36 -0.14 1.80 1.55 -2.57 0.00 0.00 177.10 178.11 1whr h PRO 152 N 5.64 0.00 0.00 -0.60 0.13 -1.61 -2.49 132.00 133.08 1whr h PRO 152 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1whr h PRO 152 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1whr h PRO 152 CO 0.56 0.00 -1.07 -2.13 -0.23 0.00 0.00 178.00 175.14 1whr n ARG 153 N -2.51 0.55 0.00 0.86 3.00 -1.26 -4.22 116.66 113.09 1whr n ARG 153 Ca 0.02 0.08 -0.20 0.00 -0.00 0.00 0.00 57.85 57.75 1whr n ARG 153 Cb 0.25 -1.76 -0.14 0.00 0.00 0.00 0.00 32.46 30.81 1whr n ARG 153 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1whr h ASP 154 N 0.00 0.33 -1.54 6.15 5.19 -1.79 -3.32 116.42 121.43 1whr h ASP 154 Ca 0.00 -0.88 0.45 0.00 -0.62 0.00 0.00 57.03 55.97 1whr h ASP 154 Cb 0.95 -0.11 -0.06 0.00 0.18 0.00 0.00 39.33 40.29 1whr h ASP 154 CO 0.00 1.43 1.19 -2.11 -3.12 0.00 0.00 179.24 176.63 1whr n ARG 155 N -4.15 0.00 -0.11 3.56 1.85 -1.08 -0.08 116.66 116.65 1whr n ARG 155 Ca -0.19 0.92 -0.09 0.00 -1.00 0.00 0.00 57.85 57.48 1whr n ARG 155 Cb 0.79 -2.15 -0.04 0.00 -1.05 0.00 0.00 32.46 30.01 1whr n ARG 155 CO 0.00 0.00 0.00 0.52 -0.01 0.00 0.00 177.63 178.14 1whr h MET 156 N 0.00 -0.31 0.22 2.89 2.86 -1.79 0.21 114.93 119.00 1whr h MET 156 Ca 0.73 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 58.38 1whr h MET 156 Cb 3.11 0.07 0.00 0.00 0.06 0.00 0.00 31.60 34.84 1whr h MET 156 CO -0.01 -0.21 -0.10 1.98 1.06 0.00 0.00 176.91 179.63 1whr h MET 157 N -0.32 -0.28 -0.73 1.72 1.85 -0.76 -2.32 114.93 114.08 1whr h MET 157 Ca 0.14 0.02 0.11 0.00 -0.61 0.00 0.00 59.70 59.36 1whr h MET 157 Cb 0.57 0.06 -0.12 0.00 0.43 0.00 0.00 31.60 32.54 1whr h MET 157 CO -0.54 0.08 -0.42 -0.07 -0.40 0.00 0.00 176.91 175.56 1whr h LEU 158 N -0.71 -1.49 -0.04 3.39 3.38 -1.45 0.14 115.31 118.54 1whr h LEU 158 Ca -0.03 0.27 0.01 0.00 0.09 0.00 0.00 57.88 58.22 1whr h LEU 158 Cb 0.49 0.71 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1whr h LEU 158 CO 0.05 -0.31 -0.04 -0.07 0.09 0.00 0.00 178.44 178.16 1whr h LEU 159 N -0.13 -0.13 -0.33 1.67 3.38 -0.66 -2.00 115.31 117.10 1whr h LEU 159 Ca 0.23 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.30 1whr h LEU 159 Cb 0.56 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.29 1whr h LEU 159 CO -0.79 -0.06 -0.28 0.11 0.09 0.00 0.00 178.44 177.50 1whr h LYS 160 N -0.06 -0.24 -0.16 1.13 1.57 -0.47 -0.87 116.57 117.48 1whr h LYS 160 Ca 0.03 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.87 1whr h LYS 160 Cb 0.10 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 1whr h LYS 160 CO -0.07 -0.16 -0.17 -0.07 -0.57 0.00 0.00 179.45 178.41 1whr h LEU 161 N -0.24 -0.53 -1.11 2.94 3.38 -0.60 -1.00 115.31 118.14 1whr h LEU 161 Ca 0.16 0.10 0.18 0.00 0.09 0.00 0.00 57.88 58.41 1whr h LEU 161 Cb 0.50 0.26 -0.09 0.00 0.09 0.00 0.00 40.66 41.41 1whr h LEU 161 CO -0.47 -0.22 0.61 -0.08 0.09 0.00 0.00 178.44 178.38 1whr h GLU 162 N -0.20 0.72 0.44 1.13 4.81 -0.59 0.58 114.58 121.46 1whr h GLU 162 Ca 0.11 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1whr h GLU 162 Cb 0.36 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1whr h GLU 162 CO -0.28 0.47 -0.21 1.96 -0.73 0.00 0.00 179.01 180.22 1whr h GLN 163 N 0.74 -0.57 -0.32 1.92 4.20 0.04 -1.39 115.11 119.72 1whr h GLN 163 Ca 0.54 0.04 0.06 0.00 0.06 0.00 0.00 58.65 59.35 1whr h GLN 163 Cb 0.88 0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.73 1whr h GLN 163 CO -0.32 -0.27 -0.02 0.93 -0.67 0.00 0.00 178.83 178.48 1whr h GLU 164 N -0.87 0.06 -0.99 1.46 5.08 -0.60 -1.48 114.58 117.24 1whr h GLU 164 Ca -0.06 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.36 1whr h GLU 164 Cb 0.57 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 1whr h GLU 164 CO 0.10 0.04 0.64 0.82 -1.00 0.00 0.00 179.01 179.61 1whr h ILE 165 N 0.06 1.10 0.47 3.13 2.04 -0.93 -1.11 117.51 122.27 1whr h ILE 165 Ca 0.16 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1whr h ILE 165 Cb 0.22 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.12 1whr h ILE 165 CO -0.28 0.21 -0.24 -0.07 0.00 0.00 0.00 178.15 177.77 1whr h LEU 166 N 1.17 -0.59 -1.06 1.44 3.38 -0.26 -0.66 115.31 118.73 1whr h LEU 166 Ca 0.42 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.48 1whr h LEU 166 Cb 0.14 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 1whr h LEU 166 CO -0.16 -0.40 0.63 -0.33 0.09 0.00 0.00 178.44 178.26 1whr h GLU 167 N -0.66 1.10 -0.32 1.13 3.07 -1.04 -0.48 114.58 117.39 1whr h GLU 167 Ca -0.06 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 1whr h GLU 167 Cb 0.52 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.16 1whr h GLU 167 CO 0.09 0.73 0.16 0.35 -1.40 0.00 0.00 179.01 178.94 1whr h PHE 168 N 1.13 0.45 -0.45 4.33 3.57 -0.91 -0.49 116.94 124.57 1whr h PHE 168 Ca 0.42 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.82 1whr h PHE 168 Cb 0.17 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1whr h PHE 168 CO -0.00 0.38 -0.03 0.82 -2.23 0.00 0.00 178.31 177.25 1whr h ILE 169 N 0.39 1.24 -0.04 1.41 2.04 -0.50 -2.62 117.51 119.43 1whr h ILE 169 Ca 0.11 -1.02 -0.11 0.00 1.00 0.00 0.00 64.86 64.84 1whr h ILE 169 Cb 0.09 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1whr h ILE 169 CO -0.02 0.36 -0.47 -1.13 0.00 0.00 0.00 178.15 176.89 1whr h ASN 170 N 0.71 0.10 -3.36 1.72 -0.73 -0.81 -3.42 115.58 109.79 1whr h ASN 170 Ca 0.14 -0.05 -0.56 0.00 1.87 0.00 0.00 56.30 57.70 1whr h ASN 170 Cb 0.47 -0.03 -0.05 0.00 0.27 0.00 0.00 38.32 38.98 1whr h ASN 170 CO 0.02 0.56 0.21 -0.62 -0.37 0.00 0.00 177.43 177.22 1whr s ASP 171 N -6.89 7.02 -0.09 1.15 -1.08 -0.22 -4.96 116.67 111.60 1whr s ASP 171 Ca -0.03 1.24 -0.09 0.00 -0.52 0.00 0.00 52.55 53.16 1whr s ASP 171 Cb 0.13 -2.44 -0.28 0.00 -1.46 0.00 0.00 42.92 38.87 1whr s ASP 171 CO 0.76 -0.21 0.47 0.78 0.52 0.00 0.00 175.17 177.49 1whr h ASN 172 N 6.94 0.49 -0.98 -0.34 2.35 -1.83 -3.36 115.58 118.84 1whr h ASN 172 Ca -0.38 -0.95 0.32 0.00 -0.55 0.00 0.00 56.30 54.74 1whr h ASN 172 Cb 1.18 -0.16 -0.18 0.00 0.05 0.00 0.00 38.32 39.22 1whr h ASN 172 CO 0.77 1.83 0.25 -1.13 -1.65 0.00 0.00 177.43 177.50 1whr h ASN 173 N 0.07 -0.11 -3.37 5.81 -1.24 -1.94 -3.35 115.58 111.44 1whr h ASN 173 Ca -0.39 0.26 -0.58 0.00 0.71 0.00 0.00 56.30 56.30 1whr h ASN 173 Cb 2.05 0.37 -0.08 0.00 0.73 0.00 0.00 38.32 41.40 1whr h ASN 173 CO 0.12 -0.35 0.14 0.20 -1.29 0.00 0.00 177.43 176.24 1whr s ASN 174 N -4.85 6.82 -0.12 1.15 0.01 -1.26 -4.93 114.94 111.76 1whr s ASN 174 Ca -0.11 1.00 0.13 0.00 -0.71 0.00 0.00 52.86 53.17 1whr s ASN 174 Cb 0.30 -2.38 -0.19 0.00 0.41 0.00 0.00 41.25 39.39 1whr s ASN 174 CO 0.78 -0.23 0.10 1.67 -1.51 0.00 0.00 177.10 177.91 1whr n GLN 175 N 4.60 1.42 -4.38 -0.60 0.00 -1.26 -4.93 117.38 112.23 1whr n GLN 175 Ca -0.01 -0.03 -0.20 0.00 -0.00 0.00 0.00 57.00 56.76 1whr n GLN 175 Cb 0.50 -1.37 -0.10 0.00 0.00 0.00 0.00 30.24 29.27 1whr n GLN 175 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 1whr s PHE 176 N -2.48 1.87 -0.07 3.69 0.08 -1.26 -2.71 117.98 117.09 1whr s PHE 176 Ca -0.07 -0.51 -0.03 0.00 0.12 0.00 0.00 56.93 56.44 1whr s PHE 176 Cb 0.05 -0.85 0.04 0.00 -0.57 0.00 0.00 43.02 41.69 1whr s PHE 176 CO 0.61 0.46 0.14 0.21 -0.10 0.00 0.00 175.22 176.53 1whr s LYS 177 N -3.61 0.02 -0.11 0.44 2.20 0.04 -5.01 119.74 113.72 1whr s LYS 177 Ca 0.25 0.50 0.00 0.00 -0.36 0.00 0.00 55.97 56.35 1whr s LYS 177 Cb -0.02 -0.29 -0.02 0.00 -1.51 0.00 0.00 37.83 35.99 1whr s LYS 177 CO 0.09 -0.28 -0.11 0.21 -0.36 0.00 0.00 175.35 174.90 1whr s LYS 178 N 2.06 3.13 0.08 4.03 2.20 -1.26 -0.87 119.74 129.12 1whr s LYS 178 Ca 0.01 -0.63 0.03 0.00 -0.36 0.00 0.00 55.97 55.02 1whr s LYS 178 Cb -0.12 -2.62 -0.04 0.00 -1.51 0.00 0.00 37.83 33.54 1whr s LYS 178 CO -0.05 0.39 0.05 -0.06 -0.36 0.00 0.00 175.35 175.31 1whr s PHE 179 N -0.09 3.12 0.87 4.03 0.08 -0.85 -5.03 117.98 120.11 1whr s PHE 179 Ca -0.01 0.05 -0.11 0.00 0.12 0.00 0.00 56.93 56.97 1whr s PHE 179 Cb -0.14 -1.60 0.11 0.00 -0.57 0.00 0.00 43.02 40.83 1whr s PHE 179 CO 0.03 0.50 1.09 -1.25 -0.10 0.00 0.00 175.22 175.50 1whr s PRO 180 N -2.29 1.46 -0.16 0.24 0.04 -1.26 -4.08 135.00 128.94 1whr s PRO 180 Ca 0.27 0.88 -0.41 0.00 0.04 0.00 0.00 61.00 61.79 1whr s PRO 180 Cb -0.12 -1.83 -0.18 0.00 0.04 0.00 0.00 34.50 32.42 1whr s PRO 180 CO 0.20 -2.12 1.46 1.04 0.04 0.00 0.00 177.00 177.62 1whr n GLN 181 N -3.81 0.68 -4.29 4.56 6.02 -1.26 -4.79 117.38 114.49 1whr n GLN 181 Ca 0.07 0.25 -0.24 0.00 -0.01 0.00 0.00 57.00 57.07 1whr n GLN 181 Cb 0.55 -1.85 -0.08 0.00 1.02 0.00 0.00 30.24 29.88 1whr n GLN 181 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1whr s MET 182 N 1.85 2.14 0.55 -1.09 -1.94 -1.26 -5.09 119.30 114.45 1whr s MET 182 Ca 0.94 -1.69 0.05 0.00 -1.71 0.00 0.00 55.69 53.29 1whr s MET 182 Cb -1.17 -1.99 0.06 0.00 2.01 0.00 0.00 34.83 33.74 1whr s MET 182 CO 0.62 0.15 0.75 0.95 -0.01 0.00 0.00 175.02 177.49 1whr s THR 183 N -2.49 2.54 0.00 2.05 -4.23 -1.26 -4.80 115.64 107.45 1whr s THR 183 Ca 0.35 -0.84 0.00 0.00 -1.18 0.00 0.00 61.69 60.01 1whr s THR 183 Cb -0.01 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 71.13 1whr s THR 183 CO 0.20 0.00 0.81 -1.20 -0.54 0.00 0.00 174.62 173.89 1whr n SER 184 N -2.25 0.00 -0.03 3.99 7.64 -1.26 -0.23 113.62 121.48 1whr n SER 184 Ca 0.11 0.81 -0.03 0.00 1.01 0.00 0.00 58.87 60.78 1whr n SER 184 Cb 0.60 -0.31 -0.02 0.00 -1.01 0.00 0.00 64.21 63.47 1whr n SER 184 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1whr h TYR 185 N 0.00 -0.37 -0.33 1.43 3.20 -1.99 -2.06 116.97 116.85 1whr h TYR 185 Ca 0.00 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.92 1whr h TYR 185 Cb 0.00 0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 1whr h TYR 185 CO -0.48 -0.10 -0.20 0.72 -1.64 0.00 0.00 178.16 176.46 1whr n HIS 186 N -3.29 -0.15 -0.33 -3.82 8.25 -1.13 0.11 115.22 114.87 1whr n HIS 186 Ca -0.01 0.41 0.23 0.00 -0.26 0.00 0.00 57.72 58.10 1whr n HIS 186 Cb 0.07 -0.47 0.44 0.00 1.12 0.00 0.00 29.99 31.15 1whr n HIS 186 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1whr h ARG 187 N 0.00 0.03 0.40 -0.41 2.43 -0.26 -0.76 114.38 115.81 1whr h ARG 187 Ca 0.05 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1whr h ARG 187 Cb 0.14 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1whr h ARG 187 CO -0.31 0.02 -0.19 1.98 -1.51 0.00 0.00 179.97 179.96 1whr h MET 188 N 0.03 -0.51 -0.87 0.20 4.05 0.15 -2.28 114.93 115.69 1whr h MET 188 Ca 0.72 0.04 0.19 0.00 -0.28 0.00 0.00 59.70 60.37 1whr h MET 188 Cb 1.73 0.12 -0.17 0.00 -0.80 0.00 0.00 31.60 32.48 1whr h MET 188 CO -0.82 -0.34 -0.16 1.28 0.23 0.00 0.00 176.91 177.10 1whr n LEU 189 N -3.90 -0.26 0.37 3.39 4.77 -0.17 -0.77 117.00 120.44 1whr n LEU 189 Ca -0.07 1.50 -0.15 0.00 -0.03 0.00 0.00 56.01 57.26 1whr n LEU 189 Cb 0.21 -0.48 -0.07 0.00 -2.33 0.00 0.00 43.42 40.75 1whr n LEU 189 CO 0.16 -1.46 0.53 0.25 -1.33 0.00 0.00 177.39 175.54 1whr h LEU 190 N 0.00 -0.83 -0.89 2.23 5.85 -1.29 -1.87 115.31 118.52 1whr h LEU 190 Ca 0.45 0.03 0.36 0.00 0.84 0.00 0.00 57.88 59.56 1whr h LEU 190 Cb 0.75 0.22 -0.15 0.00 0.37 0.00 0.00 40.66 41.85 1whr h LEU 190 CO -0.88 -0.57 0.50 1.41 -0.34 0.00 0.00 178.44 178.55 1whr n HIS 191 N -4.58 0.93 -0.06 1.25 8.25 0.05 0.22 115.22 121.29 1whr n HIS 191 Ca -0.12 0.94 -0.15 0.00 -0.26 0.00 0.00 57.72 58.14 1whr n HIS 191 Cb 0.38 -1.36 -0.07 0.00 1.12 0.00 0.00 29.99 30.06 1whr n HIS 191 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1whr h ARG 192 N 0.00 0.61 -0.25 -0.41 2.47 -1.04 -2.33 114.38 113.43 1whr h ARG 192 Ca 0.72 -0.41 -0.00 0.00 -1.26 0.00 0.00 59.98 59.03 1whr h ARG 192 Cb 1.97 0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 30.33 1whr h ARG 192 CO -0.61 1.02 0.16 0.28 0.56 0.00 0.00 179.97 181.38 1whr h VAL 193 N 0.28 1.09 -0.01 2.04 2.07 0.34 -1.34 116.25 120.72 1whr h VAL 193 Ca 0.00 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1whr h VAL 193 Cb 1.02 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1whr h VAL 193 CO 0.09 0.09 0.01 0.00 0.02 0.00 0.00 177.57 177.77 1whr h ALA 194 N 1.06 0.01 -0.90 1.67 0.00 -1.07 -1.98 119.26 118.06 1whr h ALA 194 Ca 0.09 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.07 1whr h ALA 194 Cb 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 1whr h ALA 194 CO -0.02 -0.46 0.54 0.00 0.00 0.00 0.00 179.25 179.31 1whr h ALA 195 N 0.94 1.29 -0.72 0.00 0.00 -1.29 0.15 119.26 119.64 1whr h ALA 195 Ca 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1whr h ALA 195 Cb 0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1whr h ALA 195 CO -0.00 0.19 0.24 -0.92 0.00 0.00 0.00 179.25 178.76 1whr h TYR 196 N 0.91 1.12 -0.09 0.00 5.03 -0.97 -1.47 116.97 121.51 1whr h TYR 196 Ca 0.43 -0.10 0.00 0.00 2.58 0.00 0.00 58.73 61.64 1whr h TYR 196 Cb 0.36 -0.33 0.00 0.00 1.55 0.00 0.00 36.73 38.31 1whr h TYR 196 CO -0.04 0.88 0.00 1.19 -1.32 0.00 0.00 178.16 178.87 1whr n PHE 197 N -4.27 0.11 -3.14 -3.82 3.01 -0.53 -4.83 117.46 104.00 1whr n PHE 197 Ca 0.06 -0.06 -0.14 0.00 1.01 0.00 0.00 57.45 58.32 1whr n PHE 197 Cb 0.21 0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.75 1whr n PHE 197 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1whr n GLY 198 N 0.76 -0.16 3.73 1.37 0.00 -0.55 -3.87 105.19 106.47 1whr n GLY 198 Ca 0.08 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 1whr n GLY 198 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1whr s MET 199 N -5.32 2.60 -0.30 1.61 -1.94 0.43 -3.73 119.30 112.65 1whr s MET 199 Ca 0.14 -1.23 0.03 0.00 -1.71 0.00 0.00 55.69 52.92 1whr s MET 199 Cb -0.06 -2.36 0.08 0.00 2.01 0.00 0.00 34.83 34.50 1whr s MET 199 CO 0.54 0.39 -0.03 -0.51 -0.01 0.00 0.00 175.02 175.40 1whr s ASP 200 N -3.71 4.62 0.37 3.03 1.11 -1.26 -4.33 116.67 116.49 1whr s ASP 200 Ca 0.32 -1.74 -0.01 0.00 0.18 0.00 0.00 52.55 51.30 1whr s ASP 200 Cb -0.07 -1.59 -0.03 0.00 1.07 0.00 0.00 42.92 42.29 1whr s ASP 200 CO 0.22 -0.28 0.60 -1.38 1.18 0.00 0.00 175.17 175.51 1whr s HIS 201 N 1.02 3.51 0.03 4.23 -3.43 -1.26 -3.81 115.29 115.58 1whr s HIS 201 Ca 0.00 0.47 -0.08 0.00 -0.80 0.00 0.00 55.06 54.65 1whr s HIS 201 Cb -0.20 -2.00 0.00 0.00 -1.43 0.00 0.00 32.58 28.96 1whr s HIS 201 CO -0.06 0.03 0.16 -0.80 -2.00 0.00 0.00 174.74 172.07 1whr s ASN 202 N -4.01 0.05 0.28 7.38 -0.87 -0.56 -5.00 114.94 112.21 1whr s ASN 202 Ca 0.42 -0.33 -0.06 0.00 -1.57 0.00 0.00 52.86 51.31 1whr s ASN 202 Cb -0.10 0.25 -0.06 0.00 -0.02 0.00 0.00 41.25 41.33 1whr s ASN 202 CO 0.38 -0.49 0.56 0.68 -2.57 0.00 0.00 177.10 175.66 1whr s VAL 203 N -2.16 4.99 0.56 1.60 -7.23 -1.26 -2.05 120.40 114.85 1whr s VAL 203 Ca -0.08 0.20 -0.08 0.00 -1.81 0.00 0.00 61.98 60.20 1whr s VAL 203 Cb -0.03 -3.70 -0.03 0.00 0.56 0.00 0.00 36.38 33.17 1whr s VAL 203 CO -0.02 -0.27 0.92 -0.62 -0.31 0.00 0.00 175.10 174.81 1whr s ASP 204 N -2.95 6.19 0.63 4.85 -1.08 -1.25 -4.84 116.67 118.22 1whr s ASP 204 Ca 0.45 1.17 0.18 0.00 -0.52 0.00 0.00 52.55 53.83 1whr s ASP 204 Cb -0.11 -2.32 0.79 0.00 -1.46 0.00 0.00 42.92 39.82 1whr s ASP 204 CO 0.28 -0.77 1.38 0.06 0.52 0.00 0.00 175.17 176.63 1whr h GLN 205 N -0.10 0.00 0.01 4.34 3.07 -1.98 0.77 115.11 121.22 1whr h GLN 205 Ca -0.45 0.00 -0.38 0.00 0.09 0.00 0.00 58.65 57.91 1whr h GLN 205 Cb 1.20 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 28.70 1whr h GLN 205 CO 0.62 0.00 -2.37 0.25 0.09 0.00 0.00 178.83 177.42 1whr n THR 206 N -3.00 1.48 -1.65 1.86 -2.24 -1.26 -5.02 114.28 104.44 1whr n THR 206 Ca 0.09 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1whr n THR 206 Cb 1.05 -1.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1whr n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1whr n GLY 207 N 2.01 0.87 0.23 3.38 0.00 0.27 -5.00 105.19 106.94 1whr n GLY 207 Ca -0.38 -0.59 -0.25 0.00 0.00 0.00 0.00 46.02 44.80 1whr n GLY 207 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1whr n LYS 208 N -0.71 0.52 -3.32 1.61 4.81 -1.26 -4.90 118.16 114.91 1whr n LYS 208 Ca 0.00 0.23 -0.22 0.00 -0.87 0.00 0.00 58.31 57.44 1whr n LYS 208 Cb 0.37 -1.38 0.05 0.00 0.02 0.00 0.00 35.03 34.09 1whr n LYS 208 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1whr n ALA 209 N -4.14 1.12 -3.11 3.14 0.00 -1.26 -4.39 120.51 111.87 1whr n ALA 209 Ca -0.45 -2.18 -0.23 0.00 0.00 0.00 0.00 53.44 50.58 1whr n ALA 209 Cb 0.81 0.71 -0.16 0.00 0.00 0.00 0.00 19.45 20.80 1whr n ALA 209 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1whr s VAL 210 N -2.72 1.04 -0.08 0.00 1.01 -1.26 -3.89 120.40 114.51 1whr s VAL 210 Ca 0.51 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 62.05 1whr s VAL 210 Cb -0.04 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.41 1whr s VAL 210 CO 0.33 0.32 -0.22 -0.63 0.00 0.00 0.00 175.10 174.90 1whr s ILE 211 N 0.28 1.86 0.19 2.22 1.09 -0.87 -2.00 121.20 123.97 1whr s ILE 211 Ca -0.06 -0.92 0.11 0.00 -1.10 0.00 0.00 60.65 58.68 1whr s ILE 211 Cb -0.11 -1.61 -0.04 0.00 -1.06 0.00 0.00 42.46 39.63 1whr s ILE 211 CO 0.02 0.52 -0.21 0.27 -0.10 0.00 0.00 174.94 175.44 1whr s ILE 212 N 0.28 2.56 0.16 2.92 -4.36 -0.05 -1.49 121.20 121.23 1whr s ILE 212 Ca -0.15 -1.92 0.07 0.00 -0.26 0.00 0.00 60.65 58.39 1whr s ILE 212 Cb -0.16 -2.23 -0.04 0.00 1.25 0.00 0.00 42.46 41.27 1whr s ILE 212 CO 0.07 -0.10 -0.15 0.54 0.24 0.00 0.00 174.94 175.53 1whr s ASN 213 N -2.68 2.39 -0.19 4.36 4.22 -1.25 -0.78 114.94 121.01 1whr s ASN 213 Ca 0.21 -0.90 -0.16 0.00 -2.14 0.00 0.00 52.86 49.88 1whr s ASN 213 Cb -0.08 -0.12 -0.04 0.00 1.28 0.00 0.00 41.25 42.29 1whr s ASN 213 CO 0.11 -0.12 0.40 -0.75 -2.04 0.00 0.00 177.10 174.70 1whr s LYS 214 N -3.03 4.19 0.23 3.55 2.20 -1.10 -4.53 119.74 121.24 1whr s LYS 214 Ca 0.15 0.22 0.02 0.00 -0.36 0.00 0.00 55.97 56.00 1whr s LYS 214 Cb -0.04 -3.52 -0.05 0.00 -1.51 0.00 0.00 37.83 32.71 1whr s LYS 214 CO 0.05 -0.01 0.05 0.95 -0.36 0.00 0.00 175.35 176.04 1whr s THR 215 N 1.21 0.64 0.10 3.43 -4.23 -1.26 -5.04 115.64 110.50 1whr s THR 215 Ca 0.20 -2.00 -0.33 0.00 -1.18 0.00 0.00 61.69 58.38 1whr s THR 215 Cb -0.15 -2.43 -0.13 0.00 1.34 0.00 0.00 72.50 71.13 1whr s THR 215 CO 0.08 -0.20 1.59 0.28 -0.54 0.00 0.00 174.62 175.83 1whr h SER 216 N 2.50 -1.22 -1.32 3.99 0.02 -1.98 -1.55 113.55 113.99 1whr h SER 216 Ca -0.38 0.12 0.47 0.00 -0.84 0.00 0.00 61.79 61.16 1whr h SER 216 Cb 1.23 0.43 -0.15 0.00 0.14 0.00 0.00 62.40 64.05 1whr h SER 216 CO 0.62 -0.55 0.83 0.78 -1.14 0.00 0.00 176.83 177.37 1whr h ASN 217 N -0.79 0.22 -2.00 3.07 2.35 -1.91 -3.37 115.58 113.15 1whr h ASN 217 Ca -0.02 0.18 -0.58 0.00 -0.55 0.00 0.00 56.30 55.33 1whr h ASN 217 Cb 0.74 0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.29 1whr h ASN 217 CO -0.14 -0.30 1.49 -0.89 -1.65 0.00 0.00 177.43 175.95 1whr s THR 218 N -5.31 3.04 0.24 2.81 2.01 -0.58 -4.94 115.64 112.90 1whr s THR 218 Ca -0.08 0.04 0.03 0.00 0.31 0.00 0.00 61.69 61.99 1whr s THR 218 Cb 0.32 -3.05 -0.05 0.00 0.01 0.00 0.00 72.50 69.73 1whr s THR 218 CO 0.82 -0.03 0.03 0.00 -0.69 0.00 0.00 174.62 174.74 1whr s ARG 219 N 6.48 1.34 0.23 4.92 1.70 -1.25 -4.87 118.95 127.50 1whr s ARG 219 Ca 0.99 -1.69 -0.30 0.00 -0.47 0.00 0.00 55.73 54.26 1whr s ARG 219 Cb -0.31 -0.49 -0.09 0.00 -0.57 0.00 0.00 34.95 33.49 1whr s ARG 219 CO 0.34 -0.16 1.11 0.42 -1.08 0.00 0.00 175.30 175.93 1whr s ILE 220 N -3.53 3.65 0.78 4.99 1.01 -1.26 -4.66 121.20 122.18 1whr s ILE 220 Ca 0.31 1.54 -0.11 0.00 0.00 0.00 0.00 60.65 62.39 1whr s ILE 220 Cb 0.07 -3.98 0.06 0.00 0.01 0.00 0.00 42.46 38.62 1whr s ILE 220 CO 0.10 0.32 1.09 -2.16 0.00 0.00 0.00 174.94 174.28 1whr s PRO 221 N -0.91 2.20 0.37 2.79 0.04 -1.26 -4.94 135.00 133.29 1whr s PRO 221 Ca 0.47 1.15 0.06 0.00 0.04 0.00 0.00 61.00 62.72 1whr s PRO 221 Cb -0.31 -1.89 0.73 0.00 0.04 0.00 0.00 34.50 33.07 1whr s PRO 221 CO 0.38 -1.68 1.95 1.05 0.04 0.00 0.00 177.00 178.74 1whr h GLU 222 N -1.15 0.46 -3.37 4.56 4.11 -1.96 -3.43 114.58 113.80 1whr h GLU 222 Ca -0.44 -0.07 -0.17 0.00 0.07 0.00 0.00 59.36 58.74 1whr h GLU 222 Cb 1.23 -0.08 -0.25 0.00 0.50 0.00 0.00 28.75 30.16 1whr h GLU 222 CO 0.51 0.44 -0.51 -0.65 0.07 0.00 0.00 179.01 178.88 1whr s GLN 223 N -5.09 0.28 0.49 1.06 -0.21 -1.26 -5.17 119.66 109.76 1whr s GLN 223 Ca -0.07 0.06 0.03 0.00 0.02 0.00 0.00 55.36 55.40 1whr s GLN 223 Cb 0.16 0.13 -0.02 0.00 1.00 0.00 0.00 33.01 34.28 1whr s GLN 223 CO 0.75 -0.05 0.05 -0.98 -2.12 0.00 0.00 175.29 172.94 1whr s ARG 224 N -0.31 2.17 0.23 2.91 1.70 -1.26 -5.04 118.95 119.34 1whr s ARG 224 Ca -0.04 -2.29 -0.04 0.00 -0.47 0.00 0.00 55.73 52.89 1whr s ARG 224 Cb -0.03 -1.63 0.23 0.00 -0.57 0.00 0.00 34.95 32.95 1whr s ARG 224 CO 0.01 -0.33 1.68 0.74 -1.08 0.00 0.00 175.30 176.32 1whr h PHE 225 N 1.36 0.89 -0.01 5.89 0.04 -2.00 -2.43 116.94 120.67 1whr h PHE 225 Ca -0.43 -0.17 0.00 0.00 2.80 0.00 0.00 57.97 60.17 1whr h PHE 225 Cb 1.30 -0.22 -0.00 0.00 2.20 0.00 0.00 35.95 39.22 1whr h PHE 225 CO 1.30 0.88 0.08 1.03 -0.60 0.00 0.00 178.31 181.00 1whr h SER 226 N 0.72 0.00 1.14 2.17 0.87 -1.96 0.30 113.55 116.79 1whr h SER 226 Ca 0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1whr h SER 226 Cb 0.62 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 1whr h SER 226 CO 0.04 0.00 0.00 -0.62 -0.53 0.00 0.00 176.83 175.72 1whr n GLU 227 N -3.16 0.09 -0.00 2.24 1.02 -0.91 -1.98 120.64 117.94 1whr n GLU 227 Ca -0.02 0.08 0.11 0.00 -0.02 0.00 0.00 57.16 57.31 1whr n GLU 227 Cb 0.15 -1.61 -0.13 0.00 -0.02 0.00 0.00 31.44 29.83 1whr n GLU 227 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1whr n HIS 228 N -1.76 0.04 -0.88 -0.32 8.25 0.10 -4.27 115.22 116.38 1whr n HIS 228 Ca 0.06 0.01 0.08 0.00 -0.26 0.00 0.00 57.72 57.62 1whr n HIS 228 Cb 0.36 -0.32 0.12 0.00 1.12 0.00 0.00 29.99 31.28 1whr n HIS 228 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1whr n ILE 229 N -1.96 1.76 -2.96 1.59 -5.35 -1.12 -5.01 119.36 106.31 1whr n ILE 229 Ca -0.00 -2.03 -0.41 0.00 -0.27 0.00 0.00 62.75 60.03 1whr n ILE 229 Cb 0.47 -0.11 -0.05 0.00 -1.74 0.00 0.00 39.64 38.21 1whr n ILE 229 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1whr s LYS 230 N -2.55 4.17 -0.00 6.28 2.47 -0.84 -5.04 119.74 124.22 1whr s LYS 230 Ca 0.27 0.82 0.04 0.00 -1.56 0.00 0.00 55.97 55.55 1whr s LYS 230 Cb 0.24 -3.64 -0.01 0.00 -1.46 0.00 0.00 37.83 32.95 1whr s LYS 230 CO 0.03 -0.47 -0.14 0.34 0.16 0.00 0.00 175.35 175.27 1whr s ASP 231 N 1.37 1.63 0.11 1.43 -1.08 -1.26 -5.04 116.67 113.82 1whr s ASP 231 Ca 0.32 -0.28 -0.22 0.00 -0.52 0.00 0.00 52.55 51.85 1whr s ASP 231 Cb -0.15 -0.17 -0.05 0.00 -1.46 0.00 0.00 42.92 41.09 1whr s ASP 231 CO 0.08 0.15 1.24 1.21 0.52 0.00 0.00 175.17 178.37 1whr n GLU 232 N 2.59 -0.32 -3.78 4.34 4.07 -1.26 -3.70 120.64 122.59 1whr n GLU 232 Ca -0.15 1.22 -0.37 0.00 -0.06 0.00 0.00 57.16 57.80 1whr n GLU 232 Cb 0.55 -1.80 -0.12 0.00 -0.06 0.00 0.00 31.44 30.01 1whr n GLU 232 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 1whr s LYS 233 N -5.03 2.49 0.09 5.31 2.20 -1.26 -5.08 119.74 118.45 1whr s LYS 233 Ca -0.09 -1.32 0.03 0.00 -0.36 0.00 0.00 55.97 54.24 1whr s LYS 233 Cb 0.08 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 1whr s LYS 233 CO 0.44 -0.74 -0.09 0.54 -0.36 0.00 0.00 175.35 175.14 1whr s ASN 234 N 1.51 1.35 -0.19 1.43 4.22 -1.24 -5.14 114.94 116.88 1whr s ASN 234 Ca -0.01 -0.82 -0.05 0.00 -2.14 0.00 0.00 52.86 49.85 1whr s ASN 234 Cb -0.20 0.02 0.07 0.00 1.28 0.00 0.00 41.25 42.42 1whr s ASN 234 CO 0.01 -0.29 0.10 0.42 -2.04 0.00 0.00 177.10 175.30 1whr s THR 235 N -2.53 -0.09 0.16 0.54 -4.23 -1.26 -5.12 115.64 103.11 1whr s THR 235 Ca 0.05 -0.28 0.10 0.00 -1.18 0.00 0.00 61.69 60.39 1whr s THR 235 Cb -0.02 -0.65 -0.04 0.00 1.34 0.00 0.00 72.50 73.12 1whr s THR 235 CO -0.01 -0.36 -0.19 -1.61 -0.54 0.00 0.00 174.62 171.91 1whr s GLU 236 N 2.14 1.72 0.23 3.99 2.02 -1.26 -5.15 118.70 122.40 1whr s GLU 236 Ca 0.04 -1.34 0.09 0.00 0.02 0.00 0.00 54.97 53.78 1whr s GLU 236 Cb -0.16 -2.01 -0.04 0.00 0.10 0.00 0.00 34.13 32.02 1whr s GLU 236 CO -0.15 0.44 -0.05 -0.59 0.02 0.00 0.00 175.26 174.93 1whr s PHE 237 N -1.47 2.66 0.17 1.61 -0.12 -1.26 -5.15 117.98 114.43 1whr s PHE 237 Ca 0.20 -0.22 -0.01 0.00 -0.05 0.00 0.00 56.93 56.85 1whr s PHE 237 Cb -0.09 -1.22 -0.04 0.00 -0.63 0.00 0.00 43.02 41.03 1whr s PHE 237 CO 0.11 0.58 0.09 1.14 -0.05 0.00 0.00 175.22 177.10 1whr s GLN 238 N -3.33 1.10 0.33 1.99 -2.07 -1.26 -5.18 119.66 111.24 1whr s GLN 238 Ca 0.29 -1.56 -0.19 0.00 -1.82 0.00 0.00 55.36 52.09 1whr s GLN 238 Cb -0.07 0.21 0.04 0.00 -1.09 0.00 0.00 33.01 32.09 1whr s GLN 238 CO 0.18 -0.32 0.75 1.14 -1.32 0.00 0.00 175.29 175.72 1whr s GLN 239 N -4.10 1.99 0.39 9.60 -2.07 -1.26 -5.19 119.66 119.03 1whr s GLN 239 Ca 0.32 -1.19 0.05 0.00 -1.82 0.00 0.00 55.36 52.72 1whr s GLN 239 Cb 0.07 0.62 -0.07 0.00 -1.09 0.00 0.00 33.01 32.54 1whr s GLN 239 CO 0.08 -0.92 0.03 -0.98 -1.32 0.00 0.00 175.29 172.17 1whr s ARG 240 N -3.19 1.89 0.28 9.60 1.70 -1.26 -5.17 118.95 122.80 1whr s ARG 240 Ca 0.13 -2.08 -0.02 0.00 -0.47 0.00 0.00 55.73 53.28 1whr s ARG 240 Cb -0.06 -1.34 -0.02 0.00 -0.57 0.00 0.00 34.95 32.97 1whr s ARG 240 CO 0.09 -0.14 0.35 0.12 -1.08 0.00 0.00 175.30 174.63 1whr s PHE 241 N -2.93 1.08 -0.28 5.89 5.36 -1.26 -5.14 117.98 120.69 1whr s PHE 241 Ca 0.32 -1.27 -0.08 0.00 -0.96 0.00 0.00 56.93 54.94 1whr s PHE 241 Cb 0.08 -0.27 -0.01 0.00 -0.34 0.00 0.00 43.02 42.48 1whr s PHE 241 CO 0.16 -0.93 0.09 -1.50 -1.46 0.00 0.00 175.22 171.58 1whr s ILE 242 N -3.62 4.22 -0.19 3.12 1.10 -1.26 -4.98 121.20 119.60 1whr s ILE 242 Ca 0.33 -0.42 -0.22 0.00 -0.51 0.00 0.00 60.65 59.83 1whr s ILE 242 Cb 0.02 -3.08 -0.19 0.00 0.15 0.00 0.00 42.46 39.36 1whr s ILE 242 CO 0.17 0.19 0.31 0.25 -2.11 0.00 0.00 174.94 173.76 1whr h LEU 243 N 8.26 0.00 -9.05 8.50 6.46 -2.08 -3.47 115.31 123.92 1whr h LEU 243 Ca -0.35 -0.58 -0.59 0.00 -0.12 0.00 0.00 57.88 56.24 1whr h LEU 243 Cb 1.15 0.00 0.18 0.00 -0.73 0.00 0.00 40.66 41.27 1whr h LEU 243 CO 0.60 1.33 -1.13 -0.24 -0.62 0.00 0.00 178.44 178.37 1whr n SER 244 N -4.49 -3.58 -3.62 1.25 2.88 -1.26 -4.99 113.62 99.81 1whr n SER 244 Ca -0.25 0.63 -0.07 0.00 -1.33 0.00 0.00 58.87 57.85 1whr n SER 244 Cb 0.60 -0.88 -0.05 0.00 -0.75 0.00 0.00 64.21 63.13 1whr n SER 244 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1whr s GLY 245 N -1.02 -0.06 0.00 0.46 0.00 -1.26 -5.18 107.32 100.26 1whr s GLY 245 Ca 0.57 2.58 0.00 0.00 0.00 0.00 0.00 44.72 47.86 1whr s GLY 245 CO 0.66 1.32 0.00 -1.55 0.00 0.00 0.00 173.10 173.53 1whr n PRO 246 N 1.05 -0.93 -3.53 2.90 -0.04 -1.26 -4.54 135.00 128.65 1whr n PRO 246 Ca -0.08 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.18 1whr n PRO 246 Cb 0.58 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.09 1whr n PRO 246 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1whr n SER 247 N -2.87 -3.02 -0.09 3.54 2.88 -1.26 -4.90 113.62 107.91 1whr n SER 247 Ca 0.00 -0.77 -0.13 0.00 -1.33 0.00 0.00 58.87 56.64 1whr n SER 247 Cb 0.00 -4.50 -0.08 0.00 -0.75 0.00 0.00 64.21 58.88 1whr n SER 247 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1whr h SER 248 N -1.72 -1.65 0.00 -3.46 4.64 -2.07 -3.57 113.55 105.74 1whr h SER 248 Ca -0.61 0.22 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1whr h SER 248 Cb 1.34 0.68 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 1whr h SER 248 CO 0.51 -0.42 0.00 0.61 -0.87 0.00 0.00 176.83 176.66