#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 3.48 0.29 1.61 0.01 -1.26 -5.12 113.70 112.71 1whr s SER 127 Ca 0.00 -0.49 0.04 0.00 1.31 0.00 0.00 55.95 56.82 1whr s SER 127 Cb 0.00 -1.51 -0.03 0.00 0.21 0.00 0.00 66.02 64.69 1whr s SER 127 CO 0.00 0.13 0.21 -0.44 0.41 0.00 0.00 173.24 173.55 1whr s SER 128 N 0.56 1.23 0.00 2.44 0.01 -1.26 -5.09 113.70 111.59 1whr s SER 128 Ca -0.11 -1.62 0.00 0.00 1.31 0.00 0.00 55.95 55.53 1whr s SER 128 Cb -0.16 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.55 1whr s SER 128 CO 0.04 -0.97 0.00 0.61 0.41 0.00 0.00 173.24 173.33 1whr n GLY 129 N -0.52 -0.08 3.45 3.44 0.00 -1.26 -5.17 105.19 105.05 1whr n GLY 129 Ca 0.05 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 -0.50 0.30 1.61 0.15 -1.26 -5.19 113.70 108.82 1whr s SER 130 Ca 0.00 0.01 0.02 0.00 0.70 0.00 0.00 55.95 56.68 1whr s SER 130 Cb 0.00 0.52 -0.02 0.00 -1.71 0.00 0.00 66.02 64.81 1whr s SER 130 CO 0.00 -0.84 0.32 -0.44 1.20 0.00 0.00 173.24 173.48 1whr s SER 131 N -2.63 1.07 0.00 5.45 0.01 -1.26 -5.10 113.70 111.24 1whr s SER 131 Ca 0.02 -1.56 0.00 0.00 1.31 0.00 0.00 55.95 55.72 1whr s SER 131 Cb -0.01 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.78 1whr s SER 131 CO -0.11 -1.09 0.00 0.61 0.41 0.00 0.00 173.24 173.06 1whr n GLY 132 N -0.52 -1.28 4.13 3.44 0.00 -1.26 -5.01 105.19 104.69 1whr n GLY 132 Ca 0.04 0.48 -0.37 0.00 0.00 0.00 0.00 46.02 46.17 1whr n GLY 132 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1whr n THR 133 N 0.00 -0.01 -1.64 2.61 -2.24 -1.26 -4.75 114.28 106.99 1whr n THR 133 Ca 0.00 -0.01 -0.47 0.00 -2.27 0.00 0.00 64.05 61.30 1whr n THR 133 Cb 0.00 -0.44 -0.04 0.00 -2.10 0.00 0.00 70.33 67.76 1whr n THR 133 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1whr n ASP 134 N -2.02 2.30 -4.13 3.42 2.03 -1.26 -4.94 116.55 111.95 1whr n ASP 134 Ca 0.10 1.13 -0.38 0.00 0.52 0.00 0.00 54.79 56.16 1whr n ASP 134 Cb 0.39 -1.34 -0.09 0.00 -0.72 0.00 0.00 41.12 39.36 1whr n ASP 134 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1whr s SER 135 N 0.34 5.45 0.06 1.67 0.15 -1.26 -4.95 113.70 115.15 1whr s SER 135 Ca 0.73 -2.79 -0.36 0.00 0.70 0.00 0.00 55.95 54.22 1whr s SER 135 Cb -0.74 -1.90 -0.20 0.00 -1.71 0.00 0.00 66.02 61.46 1whr s SER 135 CO 0.48 -0.41 1.54 0.74 1.20 0.00 0.00 173.24 176.79 1whr h THR 136 N 5.25 0.05 0.00 6.45 2.02 -2.02 -3.48 112.91 121.18 1whr h THR 136 Ca -0.01 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1whr h THR 136 Cb 0.97 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1whr h THR 136 CO 0.72 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.22 1whr n GLY 137 N -1.57 0.64 3.44 2.16 0.00 -1.26 -5.10 105.19 103.50 1whr n GLY 137 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1whr n GLY 137 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1whr s ILE 138 N -0.55 4.40 -1.02 -0.61 -1.09 -1.26 -4.97 121.20 116.10 1whr s ILE 138 Ca 0.00 -0.47 -0.23 0.00 -2.23 0.00 0.00 60.65 57.72 1whr s ILE 138 Cb 0.00 -4.66 -0.04 0.00 -1.58 0.00 0.00 42.46 36.18 1whr s ILE 138 CO 0.00 -1.41 1.87 -1.81 -1.23 0.00 0.00 174.94 172.36 1whr s ASP 139 N 3.68 5.37 0.01 3.58 1.11 -1.26 -4.83 116.67 124.33 1whr s ASP 139 Ca 0.21 -1.14 -0.06 0.00 0.18 0.00 0.00 52.55 51.74 1whr s ASP 139 Cb -0.18 -2.57 -0.03 0.00 1.07 0.00 0.00 42.92 41.21 1whr s ASP 139 CO 0.09 -2.60 1.09 -0.07 1.18 0.00 0.00 175.17 174.86 1whr h LEU 140 N 16.94 -0.19 -0.81 1.23 3.38 -1.99 -3.01 115.31 130.85 1whr h LEU 140 Ca 0.16 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.25 1whr h LEU 140 Cb 0.98 0.06 -0.12 0.00 0.09 0.00 0.00 40.66 41.67 1whr h LEU 140 CO 1.25 -0.12 -0.37 1.57 0.09 0.00 0.00 178.44 180.87 1whr n HIS 141 N -2.64 -0.10 -0.32 1.13 -0.00 -1.26 -0.47 115.22 111.56 1whr n HIS 141 Ca -0.02 1.01 -0.09 0.00 0.46 0.00 0.00 57.72 59.07 1whr n HIS 141 Cb 0.08 -0.73 -0.08 0.00 -0.12 0.00 0.00 29.99 29.14 1whr n HIS 141 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 1whr h GLU 142 N 0.00 -0.03 -0.12 1.57 4.39 -1.95 -0.45 114.58 117.99 1whr h GLU 142 Ca 0.23 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.98 1whr h GLU 142 Cb 0.44 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.03 1whr h GLU 142 CO -0.79 -0.02 -0.40 0.35 -1.16 0.00 0.00 179.01 176.99 1whr h PHE 143 N -0.03 -1.13 -0.47 4.33 3.57 -0.64 -1.13 116.94 121.43 1whr h PHE 143 Ca 0.12 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.71 1whr h PHE 143 Cb 0.34 0.51 -0.07 0.00 2.79 0.00 0.00 35.95 39.53 1whr h PHE 143 CO -0.98 -0.46 -0.39 -0.07 -2.23 0.00 0.00 178.31 174.17 1whr h LEU 144 N -0.48 -1.38 -0.30 0.59 3.38 -0.50 -1.23 115.31 115.38 1whr h LEU 144 Ca 0.08 0.20 0.07 0.00 0.09 0.00 0.00 57.88 58.31 1whr h LEU 144 Cb 0.61 0.59 -0.08 0.00 0.09 0.00 0.00 40.66 41.87 1whr h LEU 144 CO -0.38 -0.22 -0.35 0.58 0.09 0.00 0.00 178.44 178.16 1whr h VAL 145 N -0.14 0.22 -0.97 1.22 2.07 -0.85 -0.15 116.25 117.65 1whr h VAL 145 Ca 0.08 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.92 1whr h VAL 145 Cb 0.35 0.22 -0.17 0.00 -1.52 0.00 0.00 31.29 30.18 1whr h VAL 145 CO -0.52 0.00 0.35 0.78 0.02 0.00 0.00 177.57 178.20 1whr h ASN 146 N -0.32 0.08 -0.13 0.57 2.35 -0.09 0.35 115.58 118.39 1whr h ASN 146 Ca 0.14 0.24 -0.04 0.00 -0.55 0.00 0.00 56.30 56.08 1whr h ASN 146 Cb 0.55 0.30 -0.00 0.00 0.05 0.00 0.00 38.32 39.22 1whr h ASN 146 CO -0.48 -0.30 -0.09 0.74 -1.65 0.00 0.00 177.43 175.66 1whr h THR 147 N 0.11 1.33 -0.98 2.81 2.02 -0.14 0.14 112.91 118.20 1whr h THR 147 Ca 0.70 -1.18 0.22 0.00 0.77 0.00 0.00 66.41 66.91 1whr h THR 147 Cb 1.63 1.82 -0.09 0.00 -1.74 0.00 0.00 68.15 69.77 1whr h THR 147 CO -0.75 0.34 0.62 -0.07 0.37 0.00 0.00 175.52 176.03 1whr h LEU 148 N -0.06 0.55 0.00 2.58 3.38 0.56 0.59 115.31 122.91 1whr h LEU 148 Ca 0.03 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1whr h LEU 148 Cb 0.58 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1whr h LEU 148 CO 0.02 0.18 -0.00 0.11 0.09 0.00 0.00 178.44 178.85 1whr h LYS 149 N 0.53 0.00 -0.65 1.13 1.57 -1.20 -3.33 116.57 114.63 1whr h LYS 149 Ca 0.54 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 59.45 1whr h LYS 149 Cb 1.17 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.36 1whr h LYS 149 CO -0.28 0.00 -0.26 0.87 -0.57 0.00 0.00 179.45 179.20 1whr h LYS 150 N -0.00 -0.08 -3.47 3.15 1.79 -0.72 -3.09 116.57 114.15 1whr h LYS 150 Ca 0.00 0.01 -0.73 0.00 -2.18 0.00 0.00 60.65 57.74 1whr h LYS 150 Cb 0.00 0.02 -0.33 0.00 -1.58 0.00 0.00 32.23 30.34 1whr h LYS 150 CO 0.00 -0.06 0.01 -0.80 -1.08 0.00 0.00 179.45 177.52 1whr s ASN 151 N -5.20 6.26 0.24 0.86 -0.87 0.20 -4.88 114.94 111.56 1whr s ASN 151 Ca -0.14 -3.44 0.01 0.00 -1.57 0.00 0.00 52.86 47.71 1whr s ASN 151 Cb 0.18 -2.00 0.28 0.00 -0.02 0.00 0.00 41.25 39.69 1whr s ASN 151 CO 0.72 -0.28 1.61 1.55 -2.57 0.00 0.00 177.10 178.13 1whr h PRO 152 N 6.52 0.44 0.10 -0.60 0.13 -1.64 -2.96 132.00 133.97 1whr h PRO 152 Ca 0.13 -0.23 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1whr h PRO 152 Cb 0.87 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.01 1whr h PRO 152 CO 0.86 0.80 -0.07 0.00 -0.23 0.00 0.00 178.00 179.35 1whr h ARG 153 N 0.36 -0.16 0.00 0.86 -0.00 -1.89 -1.88 114.38 111.66 1whr h ARG 153 Ca 0.03 0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.50 1whr h ARG 153 Cb 0.92 0.04 -0.00 0.00 0.00 0.00 0.00 29.97 30.93 1whr h ARG 153 CO 0.08 -0.11 -0.07 -0.44 0.00 0.00 0.00 179.97 179.43 1whr h ASP 154 N -0.17 0.00 -0.86 7.04 3.32 -1.92 -3.17 116.42 120.67 1whr h ASP 154 Ca -0.00 0.00 0.11 0.00 0.02 0.00 0.00 57.03 57.15 1whr h ASP 154 Cb 0.15 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.57 1whr h ASP 154 CO -0.00 0.07 -0.48 -0.09 -1.72 0.00 0.00 179.24 177.02 1whr h ARG 155 N 0.00 -0.08 -0.85 3.56 2.43 -1.16 0.12 114.38 118.41 1whr h ARG 155 Ca -0.00 0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.32 1whr h ARG 155 Cb 0.28 0.02 -0.15 0.00 -0.42 0.00 0.00 29.97 29.70 1whr h ARG 155 CO 0.01 -0.05 -0.34 0.52 -1.51 0.00 0.00 179.97 178.59 1whr h MET 156 N -0.08 -0.05 0.54 0.20 2.86 -1.67 0.27 114.93 116.99 1whr h MET 156 Ca 0.22 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.85 1whr h MET 156 Cb 0.52 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1whr h MET 156 CO -0.87 -0.03 -0.36 1.98 1.06 0.00 0.00 176.91 178.68 1whr h MET 157 N -0.05 -0.84 -0.06 1.72 1.85 -1.03 -0.42 114.93 116.10 1whr h MET 157 Ca 0.32 0.06 0.03 0.00 -0.61 0.00 0.00 59.70 59.50 1whr h MET 157 Cb 0.59 0.19 -0.06 0.00 0.43 0.00 0.00 31.60 32.75 1whr h MET 157 CO -0.88 -0.56 -0.52 -0.07 -0.40 0.00 0.00 176.91 174.49 1whr h LEU 158 N -0.87 -1.61 -0.71 3.39 3.38 0.04 -1.30 115.31 117.63 1whr h LEU 158 Ca -0.06 0.19 0.14 0.00 0.09 0.00 0.00 57.88 58.24 1whr h LEU 158 Cb 0.72 0.62 -0.10 0.00 0.09 0.00 0.00 40.66 41.99 1whr h LEU 158 CO 0.04 -0.50 0.20 -0.07 0.09 0.00 0.00 178.44 178.20 1whr h LEU 159 N -0.62 0.08 0.17 1.67 3.38 -0.49 -2.20 115.31 117.31 1whr h LEU 159 Ca 0.03 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1whr h LEU 159 Cb 0.70 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1whr h LEU 159 CO -0.39 0.01 -0.35 0.11 0.09 0.00 0.00 178.44 177.91 1whr h LYS 160 N 0.31 -0.54 -0.80 1.13 1.57 -0.00 -1.53 116.57 116.71 1whr h LYS 160 Ca 0.39 0.04 0.17 0.00 -1.87 0.00 0.00 60.65 59.37 1whr h LYS 160 Cb 0.63 0.12 -0.15 0.00 0.08 0.00 0.00 32.23 32.91 1whr h LYS 160 CO -0.46 -0.36 -0.16 -0.07 -0.57 0.00 0.00 179.45 177.83 1whr h LEU 161 N -0.56 -0.67 -0.87 2.94 3.38 -0.83 0.47 115.31 119.16 1whr h LEU 161 Ca -0.02 0.23 0.13 0.00 0.09 0.00 0.00 57.88 58.31 1whr h LEU 161 Cb 0.53 0.47 -0.09 0.00 0.09 0.00 0.00 40.66 41.67 1whr h LEU 161 CO -0.14 -0.25 0.49 -0.08 0.09 0.00 0.00 178.44 178.55 1whr h GLU 162 N 0.01 0.73 0.01 1.13 4.22 -0.95 0.10 114.58 119.83 1whr h GLU 162 Ca 0.39 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.79 1whr h GLU 162 Cb 0.63 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1whr h GLU 162 CO -0.80 0.48 -0.00 1.96 -2.18 0.00 0.00 179.01 178.47 1whr h GLN 163 N 0.75 -0.01 -0.71 1.92 4.20 0.88 -2.42 115.11 119.72 1whr h GLN 163 Ca 0.45 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.24 1whr h GLN 163 Cb 0.54 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.25 1whr h GLN 163 CO -0.31 0.31 0.38 0.93 -0.67 0.00 0.00 178.83 179.47 1whr h GLU 164 N -0.33 0.64 0.24 1.46 5.08 -0.45 -2.32 114.58 118.90 1whr h GLU 164 Ca -0.00 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1whr h GLU 164 Cb 0.33 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1whr h GLU 164 CO 0.00 0.43 -0.17 0.82 -1.00 0.00 0.00 179.01 179.09 1whr h ILE 165 N 0.66 0.64 -0.56 3.13 2.04 -0.94 -1.47 117.51 121.01 1whr h ILE 165 Ca 0.34 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.31 1whr h ILE 165 Cb 0.29 0.64 -0.10 0.00 -0.74 0.00 0.00 36.82 36.91 1whr h ILE 165 CO -0.23 0.00 -0.11 -0.07 0.00 0.00 0.00 178.15 177.74 1whr h LEU 166 N -0.41 -0.46 -0.80 1.44 3.38 -1.01 0.66 115.31 118.11 1whr h LEU 166 Ca -0.02 0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1whr h LEU 166 Cb 0.35 0.33 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1whr h LEU 166 CO 0.00 -0.17 0.52 -0.33 0.09 0.00 0.00 178.44 178.56 1whr h GLU 167 N 0.02 1.01 -0.40 1.13 5.08 -1.20 -2.31 114.58 117.91 1whr h GLU 167 Ca 0.27 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1whr h GLU 167 Cb 0.42 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1whr h GLU 167 CO -0.56 0.67 0.23 0.35 -1.00 0.00 0.00 179.01 178.70 1whr h PHE 168 N 1.04 0.53 -0.30 4.33 3.57 0.09 -1.53 116.94 124.67 1whr h PHE 168 Ca 0.30 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.84 1whr h PHE 168 Cb -0.07 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.46 1whr h PHE 168 CO -0.02 0.39 0.04 0.82 -2.23 0.00 0.00 178.31 177.31 1whr h ILE 169 N 0.52 0.82 -0.79 1.41 2.04 -0.56 -2.23 117.51 118.72 1whr h ILE 169 Ca 0.14 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.95 1whr h ILE 169 Cb 0.03 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 1whr h ILE 169 CO -0.02 0.02 0.47 -1.13 0.00 0.00 0.00 178.15 177.49 1whr h ASN 170 N 0.14 0.96 -2.61 1.72 -0.73 -1.23 -3.42 115.58 110.41 1whr h ASN 170 Ca 0.14 -0.07 -0.52 0.00 1.87 0.00 0.00 56.30 57.72 1whr h ASN 170 Cb 0.17 -0.24 0.05 0.00 0.27 0.00 0.00 38.32 38.57 1whr h ASN 170 CO -0.21 0.75 1.06 -0.62 -0.37 0.00 0.00 177.43 178.04 1whr s ASP 171 N -6.04 6.40 -0.19 1.15 -1.08 -0.59 -4.92 116.67 111.40 1whr s ASP 171 Ca -0.13 2.82 -0.20 0.00 -0.52 0.00 0.00 52.55 54.52 1whr s ASP 171 Cb 0.15 -2.59 -0.21 0.00 -1.46 0.00 0.00 42.92 38.82 1whr s ASP 171 CO 0.80 -0.99 0.27 -0.55 0.52 0.00 0.00 175.17 175.22 1whr h ASN 172 N 7.59 0.06 -0.95 -0.34 7.08 -1.82 -3.38 115.58 123.83 1whr h ASN 172 Ca -0.44 -0.59 0.27 0.00 -3.08 0.00 0.00 56.30 52.45 1whr h ASN 172 Cb 1.21 -0.02 -0.17 0.00 -2.08 0.00 0.00 38.32 37.26 1whr h ASN 172 CO 0.95 1.52 0.13 -1.13 -2.08 0.00 0.00 177.43 176.82 1whr h ASN 173 N -0.85 -0.28 -3.52 6.14 -1.24 -1.95 -3.35 115.58 110.54 1whr h ASN 173 Ca -0.34 0.25 -0.61 0.00 0.71 0.00 0.00 56.30 56.32 1whr h ASN 173 Cb 1.39 0.40 -0.12 0.00 0.73 0.00 0.00 38.32 40.73 1whr h ASN 173 CO -0.16 -0.31 -0.04 0.20 -1.29 0.00 0.00 177.43 175.84 1whr s ASN 174 N -4.99 6.50 -0.14 1.15 -0.87 -1.26 -4.92 114.94 110.41 1whr s ASN 174 Ca -0.12 0.60 0.11 0.00 -1.57 0.00 0.00 52.86 51.87 1whr s ASN 174 Cb 0.28 -2.28 -0.16 0.00 -0.02 0.00 0.00 41.25 39.07 1whr s ASN 174 CO 0.78 -0.22 0.03 1.67 -2.57 0.00 0.00 177.10 176.78 1whr n GLN 175 N 5.09 1.67 -4.44 -0.60 7.27 -1.26 -4.85 117.38 120.27 1whr n GLN 175 Ca -0.05 0.00 -0.24 0.00 0.07 0.00 0.00 57.00 56.78 1whr n GLN 175 Cb 0.50 -1.34 -0.09 0.00 2.41 0.00 0.00 30.24 31.71 1whr n GLN 175 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1whr s PHE 176 N -2.33 2.43 -0.02 3.69 0.08 -1.26 -2.72 117.98 117.85 1whr s PHE 176 Ca -0.08 -0.38 -0.01 0.00 0.12 0.00 0.00 56.93 56.57 1whr s PHE 176 Cb 0.04 -1.22 0.01 0.00 -0.57 0.00 0.00 43.02 41.28 1whr s PHE 176 CO 0.53 0.62 0.05 0.21 -0.10 0.00 0.00 175.22 176.54 1whr s LYS 177 N -3.60 0.04 -0.29 0.44 2.47 0.75 -4.99 119.74 114.57 1whr s LYS 177 Ca 0.32 0.10 0.01 0.00 -1.56 0.00 0.00 55.97 54.85 1whr s LYS 177 Cb -0.02 -0.03 0.08 0.00 -1.46 0.00 0.00 37.83 36.40 1whr s LYS 177 CO 0.17 -0.04 0.02 0.21 0.16 0.00 0.00 175.35 175.87 1whr s LYS 178 N 0.26 1.32 0.36 4.03 2.47 -1.26 -1.05 119.74 125.86 1whr s LYS 178 Ca -0.02 -1.29 -0.25 0.00 -1.56 0.00 0.00 55.97 52.85 1whr s LYS 178 Cb -0.03 -2.61 -0.09 0.00 -1.46 0.00 0.00 37.83 33.64 1whr s LYS 178 CO -0.01 -0.82 1.01 -0.06 0.16 0.00 0.00 175.35 175.64 1whr s PHE 179 N 1.30 3.45 0.62 4.03 0.08 -1.06 -5.03 117.98 121.37 1whr s PHE 179 Ca 0.04 1.70 -0.17 0.00 0.12 0.00 0.00 56.93 58.62 1whr s PHE 179 Cb -0.18 -3.05 -0.02 0.00 -0.57 0.00 0.00 43.02 39.19 1whr s PHE 179 CO -0.12 -0.30 1.12 -1.25 -0.10 0.00 0.00 175.22 174.57 1whr s PRO 180 N -2.28 3.00 0.44 0.24 0.04 -1.26 -4.23 135.00 130.95 1whr s PRO 180 Ca 0.54 1.47 -0.20 0.00 0.04 0.00 0.00 61.00 62.86 1whr s PRO 180 Cb -0.21 -1.97 -0.15 0.00 0.04 0.00 0.00 34.50 32.21 1whr s PRO 180 CO 0.27 -1.10 0.00 1.04 0.04 0.00 0.00 177.00 177.25 1whr n GLN 181 N -2.01 0.00 -4.03 4.56 6.02 -1.26 -4.92 117.38 115.74 1whr n GLN 181 Ca 0.11 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 57.00 1whr n GLN 181 Cb 0.52 -1.00 -0.07 0.00 1.02 0.00 0.00 30.24 30.71 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 -1.00 1.35 0.80 -1.09 -1.94 -1.26 -5.15 119.30 111.01 1whr s MET 182 Ca 0.58 -1.31 -0.11 0.00 -1.71 0.00 0.00 55.69 53.14 1whr s MET 182 Cb -0.58 0.40 0.08 0.00 2.01 0.00 0.00 34.83 36.74 1whr s MET 182 CO 0.64 -0.52 1.15 0.95 -0.01 0.00 0.00 175.02 177.23 1whr s THR 183 N -4.03 2.06 0.02 2.05 -4.23 -1.26 -4.82 115.64 105.43 1whr s THR 183 Ca 0.25 -0.07 -0.06 0.00 -1.18 0.00 0.00 61.69 60.64 1whr s THR 183 Cb 0.02 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.85 1whr s THR 183 CO 0.07 0.00 1.09 -1.28 -0.54 0.00 0.00 174.62 173.96 1whr h SER 184 N -1.00 -0.28 -0.87 3.99 0.87 -2.02 -1.36 113.55 112.88 1whr h SER 184 Ca -0.45 0.03 0.15 0.00 -1.23 0.00 0.00 61.79 60.29 1whr h SER 184 Cb 1.32 0.11 -0.15 0.00 -0.44 0.00 0.00 62.40 63.24 1whr h SER 184 CO 0.63 -0.08 -0.30 0.00 -0.53 0.00 0.00 176.83 176.55 1whr n TYR 185 N -3.03 0.13 0.14 2.24 9.36 -1.26 -0.30 117.16 124.44 1whr n TYR 185 Ca -0.01 1.07 -0.16 0.00 3.32 0.00 0.00 57.90 62.12 1whr n TYR 185 Cb 0.06 -0.89 -0.09 0.00 -0.63 0.00 0.00 39.34 37.79 1whr n TYR 185 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1whr h HIS 186 N 0.00 -1.44 -0.86 2.98 3.86 -1.78 -1.43 115.15 116.49 1whr h HIS 186 Ca 0.34 0.03 0.23 0.00 -1.16 0.00 0.00 60.37 59.82 1whr h HIS 186 Cb 0.56 0.60 -0.16 0.00 1.06 0.00 0.00 27.41 29.47 1whr h HIS 186 CO -0.73 -0.59 -0.01 0.54 0.86 0.00 0.00 177.93 178.00 1whr n ARG 187 N -5.49 -0.07 0.33 2.45 5.12 0.59 -0.47 116.66 119.12 1whr n ARG 187 Ca -0.09 1.30 -0.14 0.00 -1.93 0.00 0.00 57.85 56.99 1whr n ARG 187 Cb 0.41 -2.04 -0.07 0.00 -1.16 0.00 0.00 32.46 29.60 1whr n ARG 187 CO 0.00 0.00 0.00 1.98 -1.93 0.00 0.00 177.63 177.68 1whr h MET 188 N 0.00 -0.83 -0.82 5.56 4.05 -1.05 -2.20 114.93 119.64 1whr h MET 188 Ca 0.51 0.06 0.08 0.00 -0.28 0.00 0.00 59.70 60.06 1whr h MET 188 Cb 1.03 0.19 -0.11 0.00 -0.80 0.00 0.00 31.60 31.91 1whr h MET 188 CO -0.82 -0.53 -0.57 -0.07 0.23 0.00 0.00 176.91 175.15 1whr h LEU 189 N -1.17 -2.05 0.00 3.39 3.38 0.25 -0.66 115.31 118.45 1whr h LEU 189 Ca -0.09 0.30 0.03 0.00 0.09 0.00 0.00 57.88 58.21 1whr h LEU 189 Cb 0.69 0.89 -0.05 0.00 0.09 0.00 0.00 40.66 42.27 1whr h LEU 189 CO 0.14 -0.27 -0.38 0.25 0.09 0.00 0.00 178.44 178.27 1whr h LEU 190 N -0.11 -1.14 -1.28 1.67 5.85 -1.21 -0.58 115.31 118.52 1whr h LEU 190 Ca 0.13 0.14 0.37 0.00 0.84 0.00 0.00 57.88 59.37 1whr h LEU 190 Cb 0.45 0.45 -0.13 0.00 0.37 0.00 0.00 40.66 41.80 1whr h LEU 190 CO -0.83 -0.43 0.73 0.45 -0.34 0.00 0.00 178.44 178.02 1whr h HIS 191 N -0.54 0.66 0.32 1.25 3.86 -0.51 0.10 115.15 120.30 1whr h HIS 191 Ca 0.05 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1whr h HIS 191 Cb 0.62 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.92 1whr h HIS 191 CO -0.39 -0.16 -0.15 -0.09 0.86 0.00 0.00 177.93 178.00 1whr h ARG 192 N 0.20 -0.41 0.18 2.45 9.65 0.27 -1.94 114.38 124.78 1whr h ARG 192 Ca 0.75 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.67 1whr h ARG 192 Cb 2.12 0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 30.76 1whr h ARG 192 CO -0.46 -0.09 -0.41 0.28 2.80 0.00 0.00 179.97 182.09 1whr h VAL 193 N -0.79 0.00 -0.35 0.20 2.07 -0.28 0.24 116.25 117.35 1whr h VAL 193 Ca -0.04 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.55 1whr h VAL 193 Cb 0.51 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.20 1whr h VAL 193 CO 0.07 0.00 -0.35 0.00 0.02 0.00 0.00 177.57 177.31 1whr h ALA 194 N -0.86 -0.28 -0.27 1.67 0.00 -1.35 0.27 119.26 118.44 1whr h ALA 194 Ca -0.02 0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.05 1whr h ALA 194 Cb 0.62 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1whr h ALA 194 CO -0.18 -0.78 0.20 0.00 0.00 0.00 0.00 179.25 178.49 1whr h ALA 195 N 0.60 2.22 0.00 0.00 0.00 -1.10 0.80 119.26 121.79 1whr h ALA 195 Ca 0.15 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1whr h ALA 195 Cb 0.56 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1whr h ALA 195 CO -0.51 -0.34 -0.54 -0.92 0.00 0.00 0.00 179.25 176.94 1whr h TYR 196 N 0.00 0.00 -0.48 0.00 3.20 0.29 -3.04 116.97 116.94 1whr h TYR 196 Ca 0.13 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.92 1whr h TYR 196 Cb 0.52 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 1whr h TYR 196 CO 0.00 0.54 0.10 1.19 -1.64 0.00 0.00 178.16 178.34 1whr n PHE 197 N -3.44 1.65 -3.51 -3.82 3.01 0.19 -4.89 117.46 106.65 1whr n PHE 197 Ca 0.00 -0.71 -0.26 0.00 1.01 0.00 0.00 57.45 57.49 1whr n PHE 197 Cb 0.65 -0.47 0.02 0.00 -0.01 0.00 0.00 39.48 39.67 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 0.22 -0.50 3.96 1.37 0.00 -1.11 -4.42 105.19 104.71 1whr n GLY 198 Ca 0.25 0.14 -0.22 0.00 0.00 0.00 0.00 46.02 46.19 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 -6.19 3.44 -0.32 1.61 -1.94 -0.69 -4.48 119.30 110.72 1whr s MET 199 Ca 0.49 -0.71 0.02 0.00 -1.71 0.00 0.00 55.69 53.78 1whr s MET 199 Cb -0.24 -2.91 0.08 0.00 2.01 0.00 0.00 34.83 33.77 1whr s MET 199 CO 0.60 0.45 0.02 0.34 -0.01 0.00 0.00 175.02 176.42 1whr s ASP 200 N -3.77 4.76 0.51 3.03 2.15 -1.26 -4.45 116.67 117.64 1whr s ASP 200 Ca 0.34 -1.78 0.01 0.00 0.43 0.00 0.00 52.55 51.55 1whr s ASP 200 Cb -0.10 -1.65 0.02 0.00 -0.30 0.00 0.00 42.92 40.90 1whr s ASP 200 CO 0.29 -0.33 0.73 -1.38 -0.17 0.00 0.00 175.17 174.31 1whr s HIS 201 N 1.05 3.00 0.05 -5.34 -3.43 -1.26 -3.67 115.29 105.68 1whr s HIS 201 Ca 0.02 0.07 -0.24 0.00 -0.80 0.00 0.00 55.06 54.11 1whr s HIS 201 Cb -0.20 -2.58 0.06 0.00 -1.43 0.00 0.00 32.58 28.43 1whr s HIS 201 CO -0.06 -0.67 0.56 0.54 -2.00 0.00 0.00 174.74 173.12 1whr s ASN 202 N -4.34 -0.50 0.41 7.38 4.22 -0.27 -4.99 114.94 116.85 1whr s ASN 202 Ca 0.54 0.24 -0.07 0.00 -2.14 0.00 0.00 52.86 51.43 1whr s ASN 202 Cb -0.10 0.52 -0.05 0.00 1.28 0.00 0.00 41.25 42.90 1whr s ASN 202 CO 0.38 -0.74 0.73 0.68 -2.04 0.00 0.00 177.10 176.10 1whr s VAL 203 N -2.44 4.89 0.68 3.54 -7.23 -1.26 -1.09 120.40 117.48 1whr s VAL 203 Ca -0.05 0.30 -0.08 0.00 -1.81 0.00 0.00 61.98 60.34 1whr s VAL 203 Cb -0.01 -3.79 0.04 0.00 0.56 0.00 0.00 36.38 33.18 1whr s VAL 203 CO -0.02 -0.61 1.01 -0.62 -0.31 0.00 0.00 175.10 174.55 1whr s ASP 204 N -3.56 5.12 0.38 4.85 2.15 -1.24 -4.80 116.67 119.57 1whr s ASP 204 Ca 0.48 0.67 0.23 0.00 0.43 0.00 0.00 52.55 54.36 1whr s ASP 204 Cb -0.10 -1.44 1.36 0.00 -0.30 0.00 0.00 42.92 42.44 1whr s ASP 204 CO 0.36 -1.42 1.59 0.06 -0.17 0.00 0.00 175.17 175.59 1whr h GLN 205 N -0.52 0.03 0.00 4.34 3.07 -1.98 0.97 115.11 121.01 1whr h GLN 205 Ca -0.45 -0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.29 1whr h GLN 205 Cb 1.29 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.84 1whr h GLN 205 CO 0.62 0.02 -1.19 -2.37 0.09 0.00 0.00 178.83 175.99 1whr n THR 206 N -5.14 0.00 -2.26 1.86 5.66 -1.26 -4.99 114.28 108.15 1whr n THR 206 Ca 0.38 -0.20 -0.13 0.00 -3.05 0.00 0.00 64.05 61.05 1whr n THR 206 Cb 1.32 0.68 -0.00 0.00 -1.55 0.00 0.00 70.33 70.77 1whr n THR 206 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1whr n GLY 207 N 1.43 -0.15 0.00 1.09 0.00 0.33 -4.89 105.19 103.02 1whr n GLY 207 Ca 0.01 -0.35 0.14 0.00 0.00 0.00 0.00 46.02 45.82 1whr n GLY 207 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1whr n LYS 208 N -2.23 0.24 -3.85 1.61 2.85 -1.26 -4.80 118.16 110.72 1whr n LYS 208 Ca -0.15 -0.01 -0.08 0.00 -1.05 0.00 0.00 58.31 57.03 1whr n LYS 208 Cb 0.61 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 33.49 1whr n LYS 208 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1whr s ALA 209 N -2.77 -0.94 -0.18 0.58 0.00 -1.26 -4.56 121.76 112.63 1whr s ALA 209 Ca 0.22 -0.53 -0.04 0.00 0.00 0.00 0.00 51.96 51.61 1whr s ALA 209 Cb 0.20 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 24.10 1whr s ALA 209 CO 0.50 -1.00 -0.04 0.08 0.00 0.00 0.00 175.76 175.29 1whr s VAL 210 N -3.30 3.71 -0.22 0.00 1.01 -1.26 -3.59 120.40 116.75 1whr s VAL 210 Ca 0.14 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 1whr s VAL 210 Cb -0.05 -2.65 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 1whr s VAL 210 CO 0.09 0.46 -0.04 -0.63 0.00 0.00 0.00 175.10 174.98 1whr s ILE 211 N 0.79 3.39 0.19 2.22 1.01 -0.25 -2.56 121.20 125.99 1whr s ILE 211 Ca -0.01 -0.49 0.07 0.00 0.00 0.00 0.00 60.65 60.22 1whr s ILE 211 Cb -0.15 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 1whr s ILE 211 CO 0.02 0.42 0.07 0.27 0.00 0.00 0.00 174.94 175.72 1whr s ILE 212 N 1.46 4.01 0.44 2.92 -4.36 -0.22 -1.11 121.20 124.34 1whr s ILE 212 Ca 0.06 -1.39 0.04 0.00 -0.26 0.00 0.00 60.65 59.10 1whr s ILE 212 Cb -0.14 -3.07 -0.02 0.00 1.25 0.00 0.00 42.46 40.49 1whr s ILE 212 CO -0.03 -0.18 0.13 0.54 0.24 0.00 0.00 174.94 175.64 1whr s ASN 213 N -3.21 3.06 -0.02 4.36 4.22 -1.24 -0.18 114.94 121.92 1whr s ASN 213 Ca 0.30 -1.73 0.07 0.00 -2.14 0.00 0.00 52.86 49.35 1whr s ASN 213 Cb -0.09 0.62 -0.02 0.00 1.28 0.00 0.00 41.25 43.04 1whr s ASN 213 CO 0.21 -0.99 -0.22 -0.75 -2.04 0.00 0.00 177.10 173.31 1whr s LYS 214 N -3.68 1.88 0.21 3.55 2.36 -1.10 -4.56 119.74 118.40 1whr s LYS 214 Ca 0.19 -0.80 -0.01 0.00 -2.55 0.00 0.00 55.97 52.81 1whr s LYS 214 Cb 0.01 -1.78 -0.04 0.00 -1.05 0.00 0.00 37.83 34.97 1whr s LYS 214 CO 0.13 0.46 0.12 0.95 1.55 0.00 0.00 175.35 178.57 1whr s THR 215 N -0.45 0.09 0.47 3.43 -4.23 -1.26 -5.04 115.64 108.65 1whr s THR 215 Ca 0.07 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.72 1whr s THR 215 Cb -0.09 -2.52 0.22 0.00 1.34 0.00 0.00 72.50 71.45 1whr s THR 215 CO -0.00 0.00 2.06 -1.28 -0.54 0.00 0.00 174.62 174.86 1whr h SER 216 N 2.58 0.04 0.47 3.99 0.87 -2.00 -0.73 113.55 118.77 1whr h SER 216 Ca -0.36 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1whr h SER 216 Cb 1.25 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1whr h SER 216 CO 0.54 0.12 0.00 -1.13 -0.53 0.00 0.00 176.83 175.83 1whr h ASN 217 N 0.04 0.00 -2.64 6.23 -1.24 -1.96 -3.41 115.58 112.59 1whr h ASN 217 Ca 0.01 0.00 -0.58 0.00 0.71 0.00 0.00 56.30 56.44 1whr h ASN 217 Cb 0.16 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.18 1whr h ASN 217 CO 0.01 0.00 1.28 -0.89 -1.29 0.00 0.00 177.43 176.54 1whr s THR 218 N -3.65 3.46 0.08 -3.57 2.01 -0.28 -4.92 115.64 108.78 1whr s THR 218 Ca -0.00 0.47 0.03 0.00 0.31 0.00 0.00 61.69 62.50 1whr s THR 218 Cb 0.09 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 1whr s THR 218 CO 0.39 -0.40 -0.10 -0.60 -0.69 0.00 0.00 174.62 173.22 1whr s ARG 219 N 5.67 0.79 0.22 4.92 6.06 -1.26 -4.96 118.95 130.38 1whr s ARG 219 Ca 0.80 -1.08 -0.30 0.00 -2.50 0.00 0.00 55.73 52.66 1whr s ARG 219 Cb -0.23 -0.50 -0.09 0.00 0.06 0.00 0.00 34.95 34.20 1whr s ARG 219 CO 0.34 0.08 1.15 0.42 -2.50 0.00 0.00 175.30 174.79 1whr s ILE 220 N -2.20 3.55 0.83 4.11 1.01 -1.26 -4.86 121.20 122.38 1whr s ILE 220 Ca 0.02 1.40 -0.11 0.00 0.00 0.00 0.00 60.65 61.96 1whr s ILE 220 Cb -0.04 -3.89 0.09 0.00 0.01 0.00 0.00 42.46 38.62 1whr s ILE 220 CO -0.00 0.27 1.09 -2.16 0.00 0.00 0.00 174.94 174.14 1whr s PRO 221 N -0.73 1.81 0.32 2.79 0.04 -1.26 -4.95 135.00 133.02 1whr s PRO 221 Ca 0.49 1.01 0.04 0.00 0.04 0.00 0.00 61.00 62.59 1whr s PRO 221 Cb -0.32 -1.86 0.56 0.00 0.04 0.00 0.00 34.50 32.92 1whr s PRO 221 CO 0.39 -1.91 1.83 1.49 0.04 0.00 0.00 177.00 178.83 1whr h GLU 222 N -1.32 0.47 -3.78 4.56 4.57 -2.00 -3.42 114.58 113.65 1whr h GLU 222 Ca -0.46 -0.13 -0.34 0.00 -1.18 0.00 0.00 59.36 57.25 1whr h GLU 222 Cb 1.25 -0.05 -0.33 0.00 -0.16 0.00 0.00 28.75 29.46 1whr h GLU 222 CO 0.53 0.58 -0.75 -1.14 -1.18 0.00 0.00 179.01 177.05 1whr s GLN 223 N -4.77 0.34 0.29 1.92 0.74 -1.26 -5.16 119.66 111.76 1whr s GLN 223 Ca -0.07 0.04 0.11 0.00 0.05 0.00 0.00 55.36 55.48 1whr s GLN 223 Cb 0.15 -0.48 -0.05 0.00 1.10 0.00 0.00 33.01 33.73 1whr s GLN 223 CO 0.77 -0.11 -0.10 -0.98 -0.55 0.00 0.00 175.29 174.33 1whr s ARG 224 N 0.88 1.95 0.30 1.67 1.70 -1.26 -5.02 118.95 119.17 1whr s ARG 224 Ca -0.09 -1.66 0.05 0.00 -0.47 0.00 0.00 55.73 53.56 1whr s ARG 224 Cb -0.12 -1.92 0.80 0.00 -0.57 0.00 0.00 34.95 33.14 1whr s ARG 224 CO -0.01 0.30 1.65 0.74 -1.08 0.00 0.00 175.30 176.90 1whr h PHE 225 N 2.06 0.50 -1.09 5.89 0.04 -2.01 0.12 116.94 122.45 1whr h PHE 225 Ca -0.42 0.05 0.39 0.00 2.80 0.00 0.00 57.97 60.79 1whr h PHE 225 Cb 1.25 -0.07 -0.12 0.00 2.20 0.00 0.00 35.95 39.21 1whr h PHE 225 CO 0.75 -0.20 0.68 0.45 -0.60 0.00 0.00 178.31 179.40 1whr n SER 226 N -5.18 0.20 -0.14 2.17 2.88 -1.26 0.96 113.62 113.26 1whr n SER 226 Ca 0.24 1.21 -0.04 0.00 -1.33 0.00 0.00 58.87 58.94 1whr n SER 226 Cb 0.76 -0.59 0.02 0.00 -0.75 0.00 0.00 64.21 63.64 1whr n SER 226 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1whr h GLU 227 N 0.00 -0.08 0.00 -1.46 5.08 -1.16 0.57 114.58 117.54 1whr h GLU 227 Ca 0.73 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 59.10 1whr h GLU 227 Cb 2.28 0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.54 1whr h GLU 227 CO -0.44 -0.05 0.00 0.72 -1.00 0.00 0.00 179.01 178.24 1whr n HIS 228 N -5.37 0.37 -0.86 4.33 8.25 0.27 -2.18 115.22 120.02 1whr n HIS 228 Ca 0.03 0.14 -0.04 0.00 -0.26 0.00 0.00 57.72 57.60 1whr n HIS 228 Cb 0.28 -0.73 0.30 0.00 1.12 0.00 0.00 29.99 30.96 1whr n HIS 228 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1whr n ILE 229 N -1.83 2.73 -3.32 1.59 5.41 0.20 -4.94 119.36 119.19 1whr n ILE 229 Ca 0.03 -1.46 -0.38 0.00 1.00 0.00 0.00 62.75 61.93 1whr n ILE 229 Cb 0.19 -0.37 -0.06 0.00 -0.71 0.00 0.00 39.64 38.69 1whr n ILE 229 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1whr s LYS 230 N -2.78 4.19 -1.20 0.38 2.20 -0.93 -4.15 119.74 117.46 1whr s LYS 230 Ca 0.51 0.60 -0.04 0.00 -0.36 0.00 0.00 55.97 56.68 1whr s LYS 230 Cb 0.41 -3.30 0.00 0.00 -1.51 0.00 0.00 37.83 33.43 1whr s LYS 230 CO 0.13 0.48 1.03 -3.47 -0.36 0.00 0.00 175.35 173.16 1whr n ASP 231 N 2.41 -4.19 -4.74 1.43 2.03 -1.26 -4.96 116.55 107.28 1whr n ASP 231 Ca -0.10 -0.54 -0.34 0.00 0.52 0.00 0.00 54.79 54.34 1whr n ASP 231 Cb 0.51 -4.79 0.08 0.00 -0.72 0.00 0.00 41.12 36.20 1whr n ASP 231 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 1whr s GLU 232 N -5.78 2.35 -0.57 -0.67 -1.05 -1.26 -4.98 118.70 106.74 1whr s GLU 232 Ca 0.29 1.61 -0.14 0.00 -0.15 0.00 0.00 54.97 56.58 1whr s GLU 232 Cb -0.13 -1.87 0.14 0.00 -0.44 0.00 0.00 34.13 31.83 1whr s GLU 232 CO 0.68 -1.64 0.51 0.21 0.95 0.00 0.00 175.26 175.98 1whr s LYS 233 N -4.00 2.98 -1.74 -4.83 2.20 -1.26 -4.63 119.74 108.46 1whr s LYS 233 Ca 0.71 -1.85 -0.14 0.00 -0.36 0.00 0.00 55.97 54.33 1whr s LYS 233 Cb -0.26 -4.24 0.14 0.00 -1.51 0.00 0.00 37.83 31.96 1whr s LYS 233 CO 0.44 -1.30 0.35 0.09 -0.36 0.00 0.00 175.35 174.58 1whr n ASN 234 N 4.96 -0.68 -4.17 1.43 4.13 -1.26 -4.89 115.26 114.77 1whr n ASN 234 Ca -0.08 -1.26 -0.36 0.00 1.68 0.00 0.00 54.58 54.56 1whr n ASN 234 Cb 0.41 -1.62 -0.13 0.00 -1.54 0.00 0.00 39.78 36.90 1whr n ASN 234 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1whr s THR 235 N -3.73 3.26 0.27 3.41 2.01 -1.26 -5.07 115.64 114.54 1whr s THR 235 Ca 0.48 -1.60 -0.15 0.00 0.31 0.00 0.00 61.69 60.73 1whr s THR 235 Cb -0.28 -3.01 0.01 0.00 0.01 0.00 0.00 72.50 69.22 1whr s THR 235 CO 1.02 -0.35 0.59 -1.83 -0.69 0.00 0.00 174.62 173.35 1whr s GLU 236 N 1.24 1.70 0.06 4.92 -1.05 -1.26 -4.99 118.70 119.32 1whr s GLU 236 Ca 0.01 -1.20 0.06 0.00 -0.15 0.00 0.00 54.97 53.69 1whr s GLU 236 Cb -0.21 0.53 -0.03 0.00 -0.44 0.00 0.00 34.13 33.99 1whr s GLU 236 CO -0.02 -0.74 -0.17 -0.59 0.95 0.00 0.00 175.26 174.69 1whr s PHE 237 N -3.81 1.45 -0.13 4.83 -0.71 -1.26 -5.13 117.98 113.22 1whr s PHE 237 Ca 0.18 -0.39 -0.03 0.00 -1.04 0.00 0.00 56.93 55.65 1whr s PHE 237 Cb -0.03 -0.84 0.05 0.00 -1.21 0.00 0.00 43.02 40.99 1whr s PHE 237 CO 0.09 0.08 0.06 -1.14 -1.34 0.00 0.00 175.22 172.97 1whr s GLN 238 N -1.40 0.23 -0.30 1.99 0.74 -1.26 -5.11 119.66 114.55 1whr s GLN 238 Ca 0.03 -0.00 -0.13 0.00 0.05 0.00 0.00 55.36 55.30 1whr s GLN 238 Cb -0.09 -1.41 0.15 0.00 1.10 0.00 0.00 33.01 32.75 1whr s GLN 238 CO 0.02 -0.52 0.85 -1.14 -0.55 0.00 0.00 175.29 173.95 1whr s GLN 239 N 2.06 0.43 0.50 1.67 0.74 -1.26 -5.15 119.66 118.65 1whr s GLN 239 Ca 0.03 1.00 -0.23 0.00 0.05 0.00 0.00 55.36 56.21 1whr s GLN 239 Cb -0.15 0.53 -0.06 0.00 1.10 0.00 0.00 33.01 34.43 1whr s GLN 239 CO -0.07 -0.14 1.35 -0.98 -0.55 0.00 0.00 175.29 174.90 1whr s ARG 240 N 2.42 3.40 -0.38 1.67 1.70 -1.26 -4.96 118.95 121.55 1whr s ARG 240 Ca -0.05 2.21 0.10 0.00 -0.47 0.00 0.00 55.73 57.52 1whr s ARG 240 Cb -0.08 -2.40 0.44 0.00 -0.57 0.00 0.00 34.95 32.34 1whr s ARG 240 CO -0.18 -0.97 1.08 0.34 -1.08 0.00 0.00 175.30 174.49 1whr n PHE 241 N -0.68 2.64 -3.79 5.89 7.35 -1.26 -5.04 117.46 122.57 1whr n PHE 241 Ca 0.08 -2.85 -0.13 0.00 -0.76 0.00 0.00 57.45 53.80 1whr n PHE 241 Cb 0.44 -0.20 -0.10 0.00 0.35 0.00 0.00 39.48 39.98 1whr n PHE 241 CO 0.00 0.00 0.00 -1.50 -0.76 0.00 0.00 176.76 174.50 1whr s ILE 242 N -4.71 0.05 -0.14 -2.13 2.07 -1.26 -5.07 121.20 110.01 1whr s ILE 242 Ca 0.42 -0.39 -0.04 0.00 -1.41 0.00 0.00 60.65 59.22 1whr s ILE 242 Cb 0.41 -0.53 -0.07 0.00 0.13 0.00 0.00 42.46 42.41 1whr s ILE 242 CO -0.09 -0.22 -0.16 0.18 -1.91 0.00 0.00 174.94 172.74 1whr n LEU 243 N 1.74 1.61 -4.68 8.50 4.77 -1.26 -5.03 117.00 122.65 1whr n LEU 243 Ca -0.20 0.09 -0.31 0.00 -0.03 0.00 0.00 56.01 55.57 1whr n LEU 243 Cb 0.56 -0.42 -0.08 0.00 -2.33 0.00 0.00 43.42 41.15 1whr n LEU 243 CO 0.20 0.42 -0.34 -0.55 -1.33 0.00 0.00 177.39 175.80 1whr s SER 244 N -5.93 4.99 0.47 -1.43 0.15 -1.26 -5.13 113.70 105.57 1whr s SER 244 Ca -0.19 -0.15 0.06 0.00 0.70 0.00 0.00 55.95 56.37 1whr s SER 244 Cb 0.06 -1.20 -0.00 0.00 -1.71 0.00 0.00 66.02 63.17 1whr s SER 244 CO 0.26 0.20 0.32 -0.83 1.20 0.00 0.00 173.24 174.39 1whr s GLY 245 N -2.12 2.32 -1.00 9.45 0.00 -1.26 -5.03 107.32 109.69 1whr s GLY 245 Ca 0.24 -1.63 -0.24 0.00 0.00 0.00 0.00 44.72 43.09 1whr s GLY 245 CO 0.16 -1.88 1.94 2.56 0.00 0.00 0.00 173.10 175.89 1whr s PRO 246 N -4.12 2.53 -0.24 2.90 0.04 -1.26 -4.88 135.00 129.97 1whr s PRO 246 Ca 0.39 -0.59 -0.03 0.00 0.04 0.00 0.00 61.00 60.81 1whr s PRO 246 Cb -0.01 -5.12 0.08 0.00 0.04 0.00 0.00 34.50 29.49 1whr s PRO 246 CO 0.23 -3.59 0.08 -1.12 0.04 0.00 0.00 177.00 172.64 1whr s SER 247 N 7.51 3.23 0.15 6.66 0.01 -1.26 -5.13 113.70 124.87 1whr s SER 247 Ca 0.70 -1.09 0.05 0.00 1.31 0.00 0.00 55.95 56.91 1whr s SER 247 Cb -0.05 -0.53 -0.04 0.00 0.21 0.00 0.00 66.02 65.60 1whr s SER 247 CO 0.04 -0.37 -0.10 -0.94 0.41 0.00 0.00 173.24 172.27 1whr s SER 248 N 1.91 1.83 0.00 2.44 1.04 -1.26 -5.26 113.70 114.41 1whr s SER 248 Ca 0.04 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.47 1whr s SER 248 Cb -0.17 -0.02 0.00 0.00 0.10 0.00 0.00 66.02 65.94 1whr s SER 248 CO -0.19 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.32