#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i5c h MET 143 N 0.00 0.00 -0.14 -0.14 4.05 -2.05 -1.59 114.93 115.06 3i5c h MET 143 Ca 0.00 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.34 3i5c h MET 143 Cb 0.00 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.80 3i5c h MET 143 CO 0.00 0.18 -0.22 -0.22 0.23 0.00 0.00 176.91 176.87 3i5c h LYS 144 N 0.00 0.39 -0.61 0.39 1.63 -2.05 -2.31 116.57 114.02 3i5c h LYS 144 Ca -0.00 -0.24 0.13 0.00 -0.85 0.00 0.00 60.65 59.68 3i5c h LYS 144 Cb 1.08 0.02 -0.10 0.00 -0.60 0.00 0.00 32.23 32.63 3i5c h LYS 144 CO 0.02 0.83 0.03 1.96 -3.45 0.00 0.00 179.45 178.84 3i5c h GLN 145 N -0.00 0.14 0.21 1.90 1.08 -1.92 0.87 115.11 117.38 3i5c h GLN 145 Ca 0.01 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3i5c h GLN 145 Cb 0.80 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.20 3i5c h GLN 145 CO 0.05 0.09 -0.10 -0.07 -0.95 0.00 0.00 178.83 177.85 3i5c h LEU 146 N 0.14 -0.24 -1.00 1.46 3.38 -1.33 -2.06 115.31 115.66 3i5c h LEU 146 Ca 0.32 -0.27 0.11 0.00 0.09 0.00 0.00 57.88 58.14 3i5c h LEU 146 Cb 0.52 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.25 3i5c h LEU 146 CO -0.51 0.18 0.63 -0.33 0.09 0.00 0.00 178.44 178.50 3i5c h GLU 147 N -0.71 0.98 -0.77 1.13 5.08 -1.18 -0.04 114.58 119.07 3i5c h GLU 147 Ca -0.03 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3i5c h GLU 147 Cb 0.49 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 3i5c h GLU 147 CO 0.05 0.65 0.43 -0.44 -1.00 0.00 0.00 179.01 178.70 3i5c h ASP 148 N 1.01 0.95 -0.50 1.42 5.19 -0.82 -2.33 116.42 121.34 3i5c h ASP 148 Ca 0.48 -0.09 -0.08 0.00 -0.62 0.00 0.00 57.03 56.72 3i5c h ASP 148 Cb 0.44 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.69 3i5c h ASP 148 CO -0.25 0.77 -0.01 0.50 -3.12 0.00 0.00 179.24 177.13 3i5c h LYS 149 N 1.06 0.89 -0.85 3.56 3.64 -0.32 -0.47 116.57 124.08 3i5c h LYS 149 Ca 0.27 -0.29 0.12 0.00 -1.27 0.00 0.00 60.65 59.48 3i5c h LYS 149 Cb 0.02 -0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 31.68 3i5c h LYS 149 CO -0.05 0.93 0.47 0.28 -2.27 0.00 0.00 179.45 178.82 3i5c h VAL 150 N 0.76 0.83 -0.39 2.00 2.07 -1.00 0.24 116.25 120.76 3i5c h VAL 150 Ca 0.14 -0.25 -0.09 0.00 0.82 0.00 0.00 66.70 67.32 3i5c h VAL 150 Cb 0.53 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 3i5c h VAL 150 CO 0.03 0.13 -0.11 -0.33 0.02 0.00 0.00 177.57 177.31 3i5c h GLU 151 N 0.74 0.75 -0.50 1.57 4.39 -0.87 -0.92 114.58 119.74 3i5c h GLU 151 Ca 0.44 -0.30 0.01 0.00 0.34 0.00 0.00 59.36 59.85 3i5c h GLU 151 Cb 0.51 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 3i5c h GLU 151 CO -0.30 0.90 0.33 1.49 -1.16 0.00 0.00 179.01 180.27 3i5c h GLU 152 N 0.56 0.65 -0.14 2.33 4.81 -0.47 -2.23 114.58 120.08 3i5c h GLU 152 Ca 0.10 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 59.12 3i5c h GLU 152 Cb 0.63 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3i5c h GLU 152 CO 0.04 0.43 -0.61 -0.07 -0.73 0.00 0.00 179.01 178.07 3i5c h LEU 153 N 0.67 0.54 -0.64 1.64 3.38 -0.85 -1.89 115.31 118.16 3i5c h LEU 153 Ca 0.19 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3i5c h LEU 153 Cb -0.06 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 3i5c h LEU 153 CO -0.05 1.02 0.35 -0.07 0.09 0.00 0.00 178.44 179.78 3i5c h LEU 154 N 0.36 0.79 -0.01 1.67 3.38 -0.98 0.40 115.31 120.92 3i5c h LEU 154 Ca -0.01 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3i5c h LEU 154 Cb 1.15 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 3i5c h LEU 154 CO 0.11 0.65 0.00 0.28 0.09 0.00 0.00 178.44 179.57 3i5c h SER 155 N 0.87 0.02 -0.73 -0.43 0.02 -1.20 -1.34 113.55 110.76 3i5c h SER 155 Ca 0.22 -0.29 0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3i5c h SER 155 Cb 0.03 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.52 3i5c h SER 155 CO -0.04 0.30 0.44 0.11 -1.14 0.00 0.00 176.83 176.51 3i5c h LYS 156 N -0.26 0.81 -0.52 3.45 1.57 -1.24 -2.10 116.57 118.28 3i5c h LYS 156 Ca 0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3i5c h LYS 156 Cb 0.29 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 3i5c h LYS 156 CO 0.00 0.54 0.24 -0.91 -0.57 0.00 0.00 179.45 178.74 3i5c h ASN 157 N 0.84 0.69 -0.67 0.86 2.35 -0.83 -2.21 115.58 116.61 3i5c h ASN 157 Ca 0.31 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3i5c h ASN 157 Cb 0.10 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 3i5c h ASN 157 CO -0.14 0.64 0.43 0.22 -1.65 0.00 0.00 177.43 176.93 3i5c h TYR 158 N 0.69 0.85 -0.49 1.19 3.20 -0.81 0.61 116.97 122.21 3i5c h TYR 158 Ca 0.18 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.12 3i5c h TYR 158 Cb 0.14 -0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.07 3i5c h TYR 158 CO -0.00 0.55 0.18 0.45 -1.64 0.00 0.00 178.16 177.70 3i5c h HIS 159 N 0.91 0.31 -0.70 -3.82 3.86 -1.23 -2.03 115.15 112.46 3i5c h HIS 159 Ca 0.24 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.42 3i5c h HIS 159 Cb -0.08 -0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.29 3i5c h HIS 159 CO -0.02 0.11 0.19 -0.07 0.86 0.00 0.00 177.93 179.00 3i5c h LEU 160 N 0.36 1.04 -1.01 2.43 3.38 -0.64 -0.13 115.31 120.73 3i5c h LEU 160 Ca 0.23 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3i5c h LEU 160 Cb 0.24 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 3i5c h LEU 160 CO -0.23 0.99 0.52 -0.33 0.09 0.00 0.00 178.44 179.48 3i5c h GLU 161 N 1.04 1.21 -0.28 1.13 5.08 -0.58 0.18 114.58 122.36 3i5c h GLU 161 Ca 0.22 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.39 3i5c h GLU 161 Cb 0.34 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3i5c h GLU 161 CO -0.00 0.85 -0.12 -0.91 -1.00 0.00 0.00 179.01 177.83 3i5c h ASN 162 N 1.22 0.58 -0.41 1.42 2.35 -0.88 -1.73 115.58 118.14 3i5c h ASN 162 Ca 0.32 -0.40 0.04 0.00 -0.55 0.00 0.00 56.30 55.71 3i5c h ASN 162 Cb -0.04 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.13 3i5c h ASN 162 CO -0.06 0.85 0.17 -0.08 -1.65 0.00 0.00 177.43 176.67 3i5c h GLU 163 N 0.31 0.34 -0.31 0.81 4.57 -0.56 -1.10 114.58 118.64 3i5c h GLU 163 Ca 0.06 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.27 3i5c h GLU 163 Cb 0.63 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 29.10 3i5c h GLU 163 CO 0.04 0.23 0.06 0.28 -1.18 0.00 0.00 179.01 178.43 3i5c h VAL 164 N 0.35 0.85 -0.71 0.32 2.07 -0.54 -0.61 116.25 117.98 3i5c h VAL 164 Ca 0.18 -0.06 0.09 0.00 0.82 0.00 0.00 66.70 67.73 3i5c h VAL 164 Cb 0.13 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 30.50 3i5c h VAL 164 CO -0.16 0.03 0.36 0.00 0.02 0.00 0.00 177.57 177.82 3i5c h ALA 165 N 1.23 0.97 -0.22 1.67 0.00 -0.75 -1.00 119.26 121.17 3i5c h ALA 165 Ca 0.15 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 3i5c h ALA 165 Cb 0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3i5c h ALA 165 CO -0.19 -0.03 -0.07 0.00 0.00 0.00 0.00 179.25 178.95 3i5c h ARG 166 N 0.62 0.43 -0.60 0.00 3.08 -0.61 -3.13 114.38 114.17 3i5c h ARG 166 Ca 0.35 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 3i5c h ARG 166 Cb 0.35 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 3i5c h ARG 166 CO -0.26 0.69 0.26 -0.07 -1.07 0.00 0.00 179.97 179.52 3i5c h LEU 167 N 0.16 0.78 -1.82 3.04 3.38 -0.85 -2.44 115.31 117.56 3i5c h LEU 167 Ca 0.05 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3i5c h LEU 167 Cb 0.54 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3i5c h LEU 167 CO 0.03 0.69 0.04 0.11 0.09 0.00 0.00 178.44 179.39 3i5c h LYS 168 N 0.86 0.15 0.00 1.13 1.57 -1.13 -0.35 116.57 118.79 3i5c h LYS 168 Ca 0.21 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3i5c h LYS 168 Cb 0.13 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.41 3i5c h LYS 168 CO -0.02 0.13 0.00 1.63 -0.57 0.00 0.00 179.45 180.62 3i5c n LYS 169 N -4.48 0.16 0.00 3.15 5.02 -0.92 -3.29 118.16 117.79 3i5c n LYS 169 Ca -0.01 0.15 0.08 0.00 -2.02 0.00 0.00 58.31 56.51 3i5c n LYS 169 Cb 0.11 -1.69 -0.03 0.00 -0.02 0.00 0.00 35.03 33.40 3i5c n LYS 169 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3i5c n LEU 170 N -1.97 1.40 -4.87 -0.35 4.77 -0.20 -4.96 117.00 110.83 3i5c n LEU 170 Ca 0.06 -0.67 -0.35 0.00 -0.03 0.00 0.00 56.01 55.01 3i5c n LEU 170 Cb 0.38 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 3i5c n LEU 170 CO 0.28 0.28 -0.18 -0.69 -1.33 0.00 0.00 177.39 175.75 3i5c s VAL 171 N -2.22 5.32 -0.63 4.08 1.01 -0.83 -5.01 120.40 122.13 3i5c s VAL 171 Ca 0.12 -0.02 0.25 0.00 0.00 0.00 0.00 61.98 62.32 3i5c s VAL 171 Cb 0.14 -3.39 0.17 0.00 0.00 0.00 0.00 36.38 33.29 3i5c s VAL 171 CO 0.53 0.48 1.52 0.78 0.00 0.00 0.00 175.10 178.40 3i5c h ASN 172 N 4.45 0.00 -2.31 3.32 2.35 -1.93 -3.48 115.58 117.99 3i5c h ASN 172 Ca -0.52 -0.09 -0.49 0.00 -0.55 0.00 0.00 56.30 54.65 3i5c h ASN 172 Cb 1.21 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.55 3i5c h ASN 172 CO 0.62 0.05 -0.47 -0.94 -1.65 0.00 0.00 177.43 175.04 3i5c s SER 173 N -4.62 6.12 -0.23 5.81 1.04 -1.26 -0.50 113.70 120.05 3i5c s SER 173 Ca 0.08 0.02 -0.18 0.00 0.48 0.00 0.00 55.95 56.34 3i5c s SER 173 Cb 0.12 -1.76 -0.03 0.00 0.10 0.00 0.00 66.02 64.45 3i5c s SER 173 CO 0.67 -0.03 0.52 -0.62 0.98 0.00 0.00 173.24 174.77 3i5c s ASP 174 N -3.72 6.50 0.19 7.02 2.15 0.95 -4.49 116.67 125.27 3i5c s ASP 174 Ca 0.34 0.60 -0.18 0.00 0.43 0.00 0.00 52.55 53.74 3i5c s ASP 174 Cb -0.09 -2.29 0.14 0.00 -0.30 0.00 0.00 42.92 40.38 3i5c s ASP 174 CO 0.28 -0.24 1.62 1.23 -0.17 0.00 0.00 175.17 177.88 3i5c h GLY 175 N 8.41 0.11 0.99 2.66 0.00 -1.96 0.29 103.07 113.57 3i5c h GLY 175 Ca -0.31 0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3i5c h GLY 175 CO 0.73 -0.22 -0.17 -2.00 0.00 0.00 0.00 176.54 174.88 3i5c h LEU 176 N -0.12 -0.41 0.00 3.11 6.46 -1.97 -3.34 115.31 119.04 3i5c h LEU 176 Ca 0.23 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 58.01 3i5c h LEU 176 Cb 0.48 0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.52 3i5c h LEU 176 CO -0.58 -0.29 -1.85 0.35 -0.62 0.00 0.00 178.44 175.45 3i5c n THR 177 N -5.30 0.00 -0.79 1.05 -2.24 -1.16 -4.87 114.28 100.98 3i5c n THR 177 Ca -0.10 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 3i5c n THR 177 Cb 0.21 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 3i5c n THR 177 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i5c n GLY 178 N 1.40 1.36 3.86 3.38 0.00 0.10 -4.89 105.19 110.39 3i5c n GLY 178 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 3i5c n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i5c s LEU 179 N 0.00 2.26 0.38 0.99 1.43 -1.26 -4.62 118.68 117.86 3i5c s LEU 179 Ca 0.00 0.31 -0.26 0.00 -1.03 0.00 0.00 54.13 53.14 3i5c s LEU 179 Cb 0.00 -2.24 -0.09 0.00 0.03 0.00 0.00 46.19 43.89 3i5c s LEU 179 CO 0.00 -3.12 1.25 -0.44 0.23 0.00 0.00 176.35 174.28 3i5c s SER 180 N -4.70 6.51 0.91 2.29 0.01 -1.00 -0.03 113.70 117.69 3i5c s SER 180 Ca 0.74 2.55 -0.14 0.00 1.31 0.00 0.00 55.95 60.41 3i5c s SER 180 Cb -0.04 -2.63 0.17 0.00 0.21 0.00 0.00 66.02 63.72 3i5c s SER 180 CO 0.54 -0.70 1.27 0.54 0.41 0.00 0.00 173.24 175.30 3i5c s ASN 181 N -0.81 3.52 0.21 2.44 2.20 0.34 -0.58 114.94 122.27 3i5c s ASN 181 Ca 0.55 0.36 -0.07 0.00 -0.94 0.00 0.00 52.86 52.76 3i5c s ASN 181 Cb -0.36 -0.53 0.17 0.00 -2.00 0.00 0.00 41.25 38.52 3i5c s ASN 181 CO 0.46 -2.49 1.72 -0.09 -2.94 0.00 0.00 177.10 173.77 3i5c h ARG 182 N -1.44 1.07 -0.37 3.55 2.43 -1.81 -1.10 114.38 116.71 3i5c h ARG 182 Ca -0.44 -0.27 0.03 0.00 -0.81 0.00 0.00 59.98 58.49 3i5c h ARG 182 Cb 1.26 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 3i5c h ARG 182 CO 0.45 0.96 0.18 -0.09 -1.51 0.00 0.00 179.97 179.96 3i5c h ARG 183 N 1.01 0.35 -0.30 0.20 2.43 -1.93 -1.16 114.38 114.98 3i5c h ARG 183 Ca 0.21 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.21 3i5c h ARG 183 Cb 0.40 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 3i5c h ARG 183 CO 0.01 0.23 -0.39 1.25 -1.51 0.00 0.00 179.97 179.56 3i5c h HIS 184 N 0.36 0.83 -0.19 2.20 2.76 -1.77 -2.22 115.15 117.12 3i5c h HIS 184 Ca 0.16 -0.24 0.05 0.00 -2.20 0.00 0.00 60.37 58.14 3i5c h HIS 184 Cb 0.08 -0.18 -0.06 0.00 1.55 0.00 0.00 27.41 28.80 3i5c h HIS 184 CO -0.11 0.98 -0.17 0.35 -1.30 0.00 0.00 177.93 177.69 3i5c h PHE 185 N 0.58 -0.42 -0.41 5.26 3.57 -0.90 0.21 116.94 124.82 3i5c h PHE 185 Ca 0.05 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.58 3i5c h PHE 185 Cb 0.92 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.86 3i5c h PHE 185 CO 0.05 -0.24 0.27 -0.44 -2.23 0.00 0.00 178.31 175.72 3i5c h ASP 186 N -0.18 0.47 0.03 0.41 3.32 -1.07 0.15 116.42 119.55 3i5c h ASP 186 Ca 0.12 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3i5c h ASP 186 Cb 0.35 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3i5c h ASP 186 CO -0.30 0.34 -0.01 -0.08 -1.72 0.00 0.00 179.24 177.47 3i5c h GLU 187 N 0.56 -0.03 -0.62 3.56 4.81 -1.16 -0.90 114.58 120.80 3i5c h GLU 187 Ca 0.15 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 3i5c h GLU 187 Cb -0.06 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 3i5c h GLU 187 CO -0.03 0.05 0.41 -0.92 -0.73 0.00 0.00 179.01 177.78 3i5c h TYR 188 N -0.11 0.78 -0.43 0.92 3.20 -0.35 -1.80 116.97 119.18 3i5c h TYR 188 Ca -0.00 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.78 3i5c h TYR 188 Cb 0.10 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 3i5c h TYR 188 CO -0.05 0.50 -0.15 1.25 -1.64 0.00 0.00 178.16 178.06 3i5c h LEU 189 N 0.84 0.87 -0.84 2.82 5.85 -0.60 -0.18 115.31 124.08 3i5c h LEU 189 Ca 0.23 -0.38 0.01 0.00 0.84 0.00 0.00 57.88 58.58 3i5c h LEU 189 Cb -0.09 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.66 3i5c h LEU 189 CO -0.05 1.06 0.55 -0.08 -0.34 0.00 0.00 178.44 179.58 3i5c h GLU 190 N 0.68 1.09 -0.64 1.25 4.22 -1.01 0.18 114.58 120.35 3i5c h GLU 190 Ca 0.10 -0.07 -0.05 0.00 0.08 0.00 0.00 59.36 59.43 3i5c h GLU 190 Cb 0.70 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 3i5c h GLU 190 CO 0.05 0.72 0.20 0.52 -2.18 0.00 0.00 179.01 178.32 3i5c h MET 191 N 1.12 0.99 -0.07 1.92 2.86 -1.01 -2.45 114.93 118.29 3i5c h MET 191 Ca 0.31 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.66 3i5c h MET 191 Cb -0.11 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.40 3i5c h MET 191 CO -0.07 0.87 -0.32 0.93 1.06 0.00 0.00 176.91 179.38 3i5c h GLU 192 N 0.92 0.13 -0.42 1.72 4.39 -0.46 -2.12 114.58 118.75 3i5c h GLU 192 Ca 0.21 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.87 3i5c h GLU 192 Cb 0.29 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 3i5c h GLU 192 CO -0.01 0.44 0.26 2.35 -1.16 0.00 0.00 179.01 180.89 3i5c h TRP 193 N 0.11 0.49 -0.55 4.33 2.91 -0.21 -0.07 115.95 122.96 3i5c h TRP 193 Ca 0.02 0.01 -0.11 0.00 1.13 0.00 0.00 58.89 59.94 3i5c h TRP 193 Cb 0.62 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 29.09 3i5c h TRP 193 CO 0.01 0.30 -0.08 0.00 -1.03 0.00 0.00 178.44 177.64 3i5c h ARG 194 N 0.53 1.02 -0.36 2.65 3.08 -1.03 0.14 114.38 120.40 3i5c h ARG 194 Ca 0.16 -0.36 0.02 0.00 0.07 0.00 0.00 59.98 59.87 3i5c h ARG 194 Cb -0.03 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 3i5c h ARG 194 CO -0.05 1.04 0.19 0.00 -1.07 0.00 0.00 179.97 180.08 3i5c h ARG 195 N 0.91 0.38 -0.39 0.04 3.08 -1.10 -0.64 114.38 116.65 3i5c h ARG 195 Ca 0.15 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.08 3i5c h ARG 195 Cb 0.63 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 3i5c h ARG 195 CO 0.04 0.25 -0.15 0.77 -1.07 0.00 0.00 179.97 179.81 3i5c h SER 196 N 0.39 0.72 -0.05 7.04 0.02 -0.85 -0.74 113.55 120.08 3i5c h SER 196 Ca 0.15 -0.23 0.03 0.00 -0.84 0.00 0.00 61.79 60.90 3i5c h SER 196 Cb 0.04 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 3i5c h SER 196 CO -0.09 0.88 -0.12 0.25 -1.14 0.00 0.00 176.83 176.61 3i5c h LEU 197 N 0.65 -0.36 -0.57 5.07 5.85 -0.74 0.35 115.31 125.56 3i5c h LEU 197 Ca 0.10 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.95 3i5c h LEU 197 Cb 0.63 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.76 3i5c h LEU 197 CO 0.04 -0.17 0.26 -0.09 -0.34 0.00 0.00 178.44 178.15 3i5c h ARG 198 N -0.18 0.48 -0.01 1.25 2.43 -0.69 -2.79 114.38 114.86 3i5c h ARG 198 Ca 0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3i5c h ARG 198 Cb 0.26 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3i5c h ARG 198 CO -0.16 0.31 -0.28 0.39 -1.51 0.00 0.00 179.97 178.73 3i5c n GLU 199 N -4.91 1.15 -3.92 0.20 -0.58 -0.32 -4.94 120.64 107.32 3i5c n GLU 199 Ca 0.07 -0.80 -0.28 0.00 -0.42 0.00 0.00 57.16 55.73 3i5c n GLU 199 Cb 0.19 -1.48 0.01 0.00 -0.57 0.00 0.00 31.44 29.59 3i5c n GLU 199 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 3i5c n GLN 200 N -0.23 -4.37 -3.55 3.49 1.13 0.12 -4.98 117.38 108.99 3i5c n GLN 200 Ca 0.12 0.51 -0.19 0.00 -1.94 0.00 0.00 57.00 55.50 3i5c n GLN 200 Cb 0.40 -5.08 -0.01 0.00 0.11 0.00 0.00 30.24 25.67 3i5c n GLN 200 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 3i5c s SER 201 N -3.87 6.03 -0.08 1.08 1.04 -0.74 -5.02 113.70 112.14 3i5c s SER 201 Ca 0.32 -0.14 -0.26 0.00 0.48 0.00 0.00 55.95 56.35 3i5c s SER 201 Cb -0.17 -1.34 -0.03 0.00 0.10 0.00 0.00 66.02 64.59 3i5c s SER 201 CO 0.86 -0.37 0.84 -1.10 0.98 0.00 0.00 173.24 174.44 3i5c s GLN 202 N -4.14 4.43 -0.31 4.02 -0.21 -1.26 -4.45 119.66 117.74 3i5c s GLN 202 Ca 0.43 1.10 -0.07 0.00 0.02 0.00 0.00 55.36 56.84 3i5c s GLN 202 Cb -0.09 -3.50 0.01 0.00 1.00 0.00 0.00 33.01 30.43 3i5c s GLN 202 CO 0.31 -0.11 0.09 -1.17 -2.12 0.00 0.00 175.29 172.29 3i5c s LEU 203 N 1.35 3.96 0.21 2.90 2.96 -0.43 -0.35 118.68 129.29 3i5c s LEU 203 Ca 0.42 -0.78 0.06 0.00 -0.22 0.00 0.00 54.13 53.61 3i5c s LEU 203 Cb -0.18 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.58 3i5c s LEU 203 CO 0.19 -0.22 0.20 -0.44 -1.32 0.00 0.00 176.35 174.76 3i5c s SER 204 N 1.49 5.69 -0.12 3.68 0.01 -0.79 -2.06 113.70 121.61 3i5c s SER 204 Ca 0.02 -0.13 -0.06 0.00 1.31 0.00 0.00 55.95 57.09 3i5c s SER 204 Cb -0.18 -1.52 0.05 0.00 0.21 0.00 0.00 66.02 64.58 3i5c s SER 204 CO 0.03 0.01 0.28 -0.22 0.41 0.00 0.00 173.24 173.74 3i5c s LEU 205 N -3.51 0.37 -0.15 2.44 2.96 -0.28 -0.80 118.68 119.71 3i5c s LEU 205 Ca 0.32 0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 54.78 3i5c s LEU 205 Cb -0.09 0.86 -0.03 0.00 0.50 0.00 0.00 46.19 47.43 3i5c s LEU 205 CO 0.25 -0.16 0.00 -0.76 -1.32 0.00 0.00 176.35 174.36 3i5c s LEU 206 N 1.19 3.50 -0.23 -0.68 1.02 -0.31 -1.95 118.68 121.23 3i5c s LEU 206 Ca -0.09 -0.01 -0.05 0.00 0.02 0.00 0.00 54.13 54.00 3i5c s LEU 206 Cb -0.09 -1.85 -0.02 0.00 0.02 0.00 0.00 46.19 44.25 3i5c s LEU 206 CO -0.09 0.21 0.01 -0.04 0.02 0.00 0.00 176.35 176.46 3i5c s MET 207 N 0.15 3.53 -0.13 1.70 -1.94 -0.14 -0.81 119.30 121.67 3i5c s MET 207 Ca 0.01 -0.55 0.02 0.00 -1.71 0.00 0.00 55.69 53.47 3i5c s MET 207 Cb -0.13 -3.13 0.00 0.00 2.01 0.00 0.00 34.83 33.58 3i5c s MET 207 CO 0.02 -0.14 -0.20 0.42 -0.01 0.00 0.00 175.02 175.10 3i5c s ILE 208 N 1.41 2.31 -0.03 2.53 1.01 0.58 -0.73 121.20 128.27 3i5c s ILE 208 Ca 0.05 -0.91 0.07 0.00 0.00 0.00 0.00 60.65 59.85 3i5c s ILE 208 Cb -0.15 -1.92 -0.02 0.00 0.01 0.00 0.00 42.46 40.39 3i5c s ILE 208 CO 0.00 0.54 -0.24 -1.81 0.00 0.00 0.00 174.94 173.44 3i5c s ASP 209 N 0.56 2.80 -0.00 3.58 1.11 -0.05 0.38 116.67 125.06 3i5c s ASP 209 Ca -0.12 -0.44 -0.30 0.00 0.18 0.00 0.00 52.55 51.87 3i5c s ASP 209 Cb -0.17 -0.43 -0.04 0.00 1.07 0.00 0.00 42.92 43.35 3i5c s ASP 209 CO 0.04 0.28 1.17 -0.69 1.18 0.00 0.00 175.17 177.14 3i5c s VAL 210 N -0.45 4.24 0.24 -1.27 1.01 -1.01 -0.59 120.40 122.57 3i5c s VAL 210 Ca 0.06 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.34 3i5c s VAL 210 Cb -0.10 -4.02 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 3i5c s VAL 210 CO 0.00 0.07 1.02 -1.81 0.00 0.00 0.00 175.10 174.38 3i5c s ASP 211 N 1.24 7.46 -1.41 3.32 1.01 0.22 -3.92 116.67 124.59 3i5c s ASP 211 Ca 0.56 2.07 -0.09 0.00 0.71 0.00 0.00 52.55 55.81 3i5c s ASP 211 Cb -0.26 -2.61 0.06 0.00 1.01 0.00 0.00 42.92 41.11 3i5c s ASP 211 CO 0.26 -0.01 0.62 -1.22 0.21 0.00 0.00 175.17 175.03 3i5c n TYR 212 N 1.58 -1.94 0.08 4.23 4.02 -1.26 -4.68 117.16 119.19 3i5c n TYR 212 Ca -0.01 0.57 -0.10 0.00 -0.01 0.00 0.00 57.90 58.35 3i5c n TYR 212 Cb 0.46 -3.56 -0.02 0.00 -0.02 0.00 0.00 39.34 36.20 3i5c n TYR 212 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 3i5c h PHE 213 N -1.30 0.40 -0.73 -0.72 3.57 -1.96 -2.97 116.94 113.22 3i5c h PHE 213 Ca -0.49 -0.22 0.06 0.00 3.53 0.00 0.00 57.97 60.85 3i5c h PHE 213 Cb 1.33 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.96 3i5c h PHE 213 CO 0.61 1.04 0.42 -0.22 -2.23 0.00 0.00 178.31 177.94 3i5c h LYS 214 N 0.15 0.75 0.00 1.11 3.64 -1.91 -1.60 116.57 118.71 3i5c h LYS 214 Ca -0.06 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.18 3i5c h LYS 214 Cb 1.54 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 33.18 3i5c h LYS 214 CO 0.14 0.50 -0.46 0.66 -2.27 0.00 0.00 179.45 178.02 3i5c h SER 215 N 0.77 0.00 0.19 4.20 4.64 -1.94 -1.84 113.55 119.56 3i5c h SER 215 Ca 0.33 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 3i5c h SER 215 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3i5c h SER 215 CO -0.18 0.46 -0.09 0.22 -0.87 0.00 0.00 176.83 176.37 3i5c h TYR 216 N 0.00 -0.24 -0.96 4.77 3.20 -1.16 0.16 116.97 122.74 3i5c h TYR 216 Ca -0.00 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.00 3i5c h TYR 216 Cb 0.89 0.08 -0.09 0.00 1.54 0.00 0.00 36.73 39.14 3i5c h TYR 216 CO 0.00 -0.09 0.58 -0.91 -1.64 0.00 0.00 178.16 176.10 3i5c h ASN 217 N -0.32 0.79 0.20 -2.11 -0.26 -1.16 0.24 115.58 112.97 3i5c h ASN 217 Ca -0.03 0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.77 3i5c h ASN 217 Cb 0.25 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 3i5c h ASN 217 CO 0.04 0.37 -0.10 0.44 -1.06 0.00 0.00 177.43 177.13 3i5c h ASP 218 N 0.84 -0.23 0.92 5.81 3.45 -0.89 0.17 116.42 126.49 3i5c h ASP 218 Ca 0.51 -0.23 0.00 0.00 0.43 0.00 0.00 57.03 57.73 3i5c h ASP 218 Cb 0.62 0.06 0.00 0.00 -0.56 0.00 0.00 39.33 39.45 3i5c h ASP 218 CO -0.31 0.12 -0.45 0.35 -1.57 0.00 0.00 179.24 177.38 3i5c n THR 219 N -5.06 0.31 0.00 0.35 -2.24 0.51 -4.12 114.28 104.03 3i5c n THR 219 Ca -0.09 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 3i5c n THR 219 Cb 0.24 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 3i5c n THR 219 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3i5c n PHE 220 N -1.99 0.00 0.00 4.78 3.72 0.83 -5.07 117.46 119.74 3i5c n PHE 220 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 3i5c n PHE 220 Cb 0.41 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 3i5c n PHE 220 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3i5c n GLY 221 N 1.54 1.45 0.28 1.37 0.00 0.05 -4.41 105.19 105.46 3i5c n GLY 221 Ca 0.00 -1.71 -0.05 0.00 0.00 0.00 0.00 46.02 44.25 3i5c n GLY 221 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3i5c h HIS 222 N 0.00 0.92 -0.33 1.61 -0.00 -1.90 -0.58 115.15 114.86 3i5c h HIS 222 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.41 3i5c h HIS 222 Cb 0.00 -0.30 -0.04 0.00 -0.00 0.00 0.00 27.41 27.07 3i5c h HIS 222 CO 0.00 0.61 0.11 0.28 -0.00 0.00 0.00 177.93 178.93 3i5c h VAL 223 N 0.96 0.90 -0.56 5.26 2.07 -1.94 0.29 116.25 123.24 3i5c h VAL 223 Ca 0.26 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.67 3i5c h VAL 223 Cb -0.05 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 3i5c h VAL 223 CO -0.05 0.05 0.30 0.00 0.02 0.00 0.00 177.57 177.89 3i5c h ALA 224 N 1.21 0.72 -0.22 1.67 0.00 -1.70 -2.27 119.26 118.66 3i5c h ALA 224 Ca 0.15 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.02 3i5c h ALA 224 Cb 0.12 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.62 3i5c h ALA 224 CO -0.16 0.25 -0.23 0.78 0.00 0.00 0.00 179.25 179.89 3i5c h GLY 225 N 0.75 -0.16 0.07 0.00 0.00 -0.24 0.99 103.07 104.49 3i5c h GLY 225 Ca 0.20 0.29 0.16 0.00 0.00 0.00 0.00 47.33 47.98 3i5c h GLY 225 CO -0.03 -0.20 0.36 -0.55 0.00 0.00 0.00 176.54 176.12 3i5c h ASP 226 N -0.25 0.36 -0.07 0.19 5.19 -0.20 -0.12 116.42 121.51 3i5c h ASP 226 Ca 0.13 0.12 -0.15 0.00 -0.62 0.00 0.00 57.03 56.51 3i5c h ASP 226 Cb 0.45 0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.03 3i5c h ASP 226 CO -0.37 0.11 -0.46 -0.08 -3.12 0.00 0.00 179.24 175.32 3i5c h GLU 227 N 0.48 0.62 -0.81 3.56 4.57 -0.75 -1.61 114.58 120.64 3i5c h GLU 227 Ca 0.47 -0.35 0.02 0.00 -1.18 0.00 0.00 59.36 58.32 3i5c h GLU 227 Cb 0.75 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.31 3i5c h GLU 227 CO -0.43 0.95 0.54 0.00 -1.18 0.00 0.00 179.01 178.89 3i5c h ALA 228 N 0.99 1.46 -0.47 2.92 0.00 0.24 -1.16 119.26 123.24 3i5c h ALA 228 Ca 0.03 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3i5c h ALA 228 Cb 0.99 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3i5c h ALA 228 CO 0.09 0.49 -0.19 -0.07 0.00 0.00 0.00 179.25 179.56 3i5c h LEU 229 N 1.06 0.98 -0.85 0.00 3.38 -0.62 -0.72 115.31 118.54 3i5c h LEU 229 Ca 0.31 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3i5c h LEU 229 Cb -0.06 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.38 3i5c h LEU 229 CO -0.08 1.15 0.42 0.03 0.09 0.00 0.00 178.44 180.05 3i5c h ARG 230 N 0.80 1.22 -0.32 1.13 3.08 -0.90 -0.23 114.38 119.15 3i5c h ARG 230 Ca 0.11 -0.17 -0.09 0.00 0.07 0.00 0.00 59.98 59.90 3i5c h ARG 230 Cb 0.76 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 3i5c h ARG 230 CO 0.06 0.92 -0.14 1.96 -1.07 0.00 0.00 179.97 181.71 3i5c h GLN 231 N 1.21 0.66 -0.33 0.04 4.20 -0.95 -0.20 115.11 119.74 3i5c h GLN 231 Ca 0.29 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 3i5c h GLN 231 Cb 0.10 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3i5c h GLN 231 CO -0.04 0.87 0.21 0.28 -0.67 0.00 0.00 178.83 179.48 3i5c h VAL 232 N 0.43 1.11 -0.46 -0.54 2.07 -0.98 -1.71 116.25 116.18 3i5c h VAL 232 Ca 0.07 -0.24 0.07 0.00 0.82 0.00 0.00 66.70 67.42 3i5c h VAL 232 Cb 0.66 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 3i5c h VAL 232 CO 0.04 0.11 0.11 0.00 0.02 0.00 0.00 177.57 177.85 3i5c h ALA 233 N 1.09 0.53 -0.93 1.67 0.00 -0.90 0.88 119.26 121.60 3i5c h ALA 233 Ca 0.12 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.19 3i5c h ALA 233 Cb -0.01 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 3i5c h ALA 233 CO -0.02 -0.29 0.59 0.78 0.00 0.00 0.00 179.25 180.30 3i5c h GLY 234 N 0.26 1.43 1.07 0.00 0.00 -0.73 0.22 103.07 105.31 3i5c h GLY 234 Ca 0.23 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 47.04 3i5c h GLY 234 CO -0.28 0.27 -0.02 0.00 0.00 0.00 0.00 176.54 176.51 3i5c h ALA 235 N 1.44 0.77 0.04 3.60 0.00 -0.25 -1.04 119.26 123.82 3i5c h ALA 235 Ca 0.41 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3i5c h ALA 235 Cb 0.22 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3i5c h ALA 235 CO -0.19 0.62 -0.02 0.82 0.00 0.00 0.00 179.25 180.48 3i5c h ILE 236 N 0.91 1.08 -0.43 0.00 2.04 0.09 -1.25 117.51 119.96 3i5c h ILE 236 Ca 0.16 -0.37 0.09 0.00 1.00 0.00 0.00 64.86 65.73 3i5c h ILE 236 Cb 0.57 1.33 -0.09 0.00 -0.74 0.00 0.00 36.82 37.90 3i5c h ILE 236 CO 0.03 0.10 -0.15 -0.09 0.00 0.00 0.00 178.15 178.04 3i5c h ARG 237 N -0.21 -0.06 0.00 2.37 2.43 -0.53 0.27 114.38 118.65 3i5c h ARG 237 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3i5c h ARG 237 Cb 0.19 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3i5c h ARG 237 CO 0.01 -0.04 0.00 0.39 -1.51 0.00 0.00 179.97 178.82 3i5c n GLU 238 N -5.35 0.19 0.19 0.20 1.02 -0.40 -2.74 120.64 113.75 3i5c n GLU 238 Ca 0.03 0.45 0.08 0.00 -0.02 0.00 0.00 57.16 57.70 3i5c n GLU 238 Cb 0.26 -1.89 0.15 0.00 -0.02 0.00 0.00 31.44 29.94 3i5c n GLU 238 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 3i5c h GLY 239 N 2.00 0.00 -5.66 0.62 0.00 0.30 -3.43 103.07 96.91 3i5c h GLY 239 Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.69 3i5c h GLY 239 CO 0.00 0.00 -0.86 0.00 0.00 0.00 0.00 176.54 175.68 3i5c n SER 241 N 3.87 1.96 -4.81 0.00 7.64 -1.26 -4.93 113.62 116.08 3i5c n SER 241 Ca -0.20 -0.32 -0.34 0.00 1.01 0.00 0.00 58.87 59.03 3i5c n SER 241 Cb 0.52 1.04 -0.05 0.00 -1.01 0.00 0.00 64.21 64.72 3i5c n SER 241 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3i5c s ARG 242 N -1.61 3.93 0.54 1.43 0.52 -1.26 -4.92 118.95 117.59 3i5c s ARG 242 Ca 0.00 1.27 0.25 0.00 -0.52 0.00 0.00 55.73 56.74 3i5c s ARG 242 Cb 0.02 -2.12 1.44 0.00 0.52 0.00 0.00 34.95 34.80 3i5c s ARG 242 CO 0.09 -0.31 2.03 0.66 0.02 0.00 0.00 175.30 177.79 3i5c h SER 243 N 1.64 0.00 0.38 0.23 4.64 -2.02 -1.61 113.55 116.81 3i5c h SER 243 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3i5c h SER 243 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3i5c h SER 243 CO 0.60 0.00 -0.68 -1.54 -0.87 0.00 0.00 176.83 174.34 3i5c n SER 244 N -4.24 0.64 -4.77 4.97 3.41 -1.26 -4.89 113.62 107.48 3i5c n SER 244 Ca 0.07 -0.42 -0.38 0.00 -0.26 0.00 0.00 58.87 57.87 3i5c n SER 244 Cb 0.50 0.49 -0.00 0.00 -0.26 0.00 0.00 64.21 64.93 3i5c n SER 244 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3i5c s ASP 245 N -3.12 6.17 -0.07 4.04 1.01 -0.61 -4.51 116.67 119.58 3i5c s ASP 245 Ca 0.09 2.49 0.00 0.00 0.71 0.00 0.00 52.55 55.84 3i5c s ASP 245 Cb 0.17 -2.62 0.02 0.00 1.01 0.00 0.00 42.92 41.50 3i5c s ASP 245 CO 0.75 -0.93 -0.04 -0.22 0.21 0.00 0.00 175.17 174.94 3i5c s LEU 246 N -2.78 1.09 -0.15 1.23 2.96 -0.59 -4.93 118.68 115.51 3i5c s LEU 246 Ca 0.61 -0.16 -0.09 0.00 -0.22 0.00 0.00 54.13 54.26 3i5c s LEU 246 Cb -0.34 -0.56 -0.05 0.00 0.50 0.00 0.00 46.19 45.75 3i5c s LEU 246 CO 0.42 -0.10 0.16 0.00 -1.32 0.00 0.00 176.35 175.51 3i5c s ALA 247 N 1.38 3.77 0.05 5.97 0.00 -1.26 -0.48 121.76 131.18 3i5c s ALA 247 Ca -0.03 -0.62 0.02 0.00 0.00 0.00 0.00 51.96 51.33 3i5c s ALA 247 Cb -0.13 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.85 3i5c s ALA 247 CO -0.03 0.38 -0.08 0.00 0.00 0.00 0.00 175.76 176.03 3i5c s ALA 248 N -0.33 0.64 -0.47 0.00 0.00 0.15 -2.38 121.76 119.39 3i5c s ALA 248 Ca 0.13 -0.83 -0.22 0.00 0.00 0.00 0.00 51.96 51.04 3i5c s ALA 248 Cb -0.12 0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.08 3i5c s ALA 248 CO 0.02 -0.03 0.74 0.50 0.00 0.00 0.00 175.76 176.99 3i5c s ARG 249 N -1.79 3.32 0.04 0.00 3.52 0.26 -1.49 118.95 122.81 3i5c s ARG 249 Ca -0.08 -0.30 0.02 0.00 -0.13 0.00 0.00 55.73 55.24 3i5c s ARG 249 Cb -0.09 -3.97 -0.25 0.00 -1.56 0.00 0.00 34.95 29.08 3i5c s ARG 249 CO 0.00 -1.14 1.00 -0.92 -0.81 0.00 0.00 175.30 173.43 3i5c h TYR 250 N 8.99 0.27 -1.21 5.12 3.20 -0.39 -3.09 116.97 129.85 3i5c h TYR 250 Ca -0.25 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.42 3i5c h TYR 250 Cb 1.09 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.35 3i5c h TYR 250 CO 0.78 1.20 0.00 0.41 -1.64 0.00 0.00 178.16 178.91 3i5c n GLY 251 N 1.54 2.37 0.41 1.82 0.00 -0.40 -4.66 105.19 106.26 3i5c n GLY 251 Ca -0.10 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.98 3i5c n GLY 251 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3i5c h GLY 252 N 0.00 -0.96 -1.09 -0.02 0.00 -2.03 -2.96 103.07 96.01 3i5c h GLY 252 Ca 0.00 0.79 -0.03 0.00 0.00 0.00 0.00 47.33 48.09 3i5c h GLY 252 CO 0.00 -0.04 -0.45 -1.84 0.00 0.00 0.00 176.54 174.20 3i5c n GLU 253 N -5.18 0.94 -4.99 4.80 0.00 -1.26 -5.05 120.64 109.90 3i5c n GLU 253 Ca 0.00 -2.47 -0.32 0.00 0.00 0.00 0.00 57.16 54.37 3i5c n GLU 253 Cb 0.27 -1.09 -0.14 0.00 0.00 0.00 0.00 31.44 30.47 3i5c n GLU 253 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 3i5c s GLU 254 N -1.99 2.70 0.31 3.44 2.02 -1.12 -2.41 118.70 121.64 3i5c s GLU 254 Ca 0.29 -0.76 0.06 0.00 0.02 0.00 0.00 54.97 54.58 3i5c s GLU 254 Cb 0.29 -2.36 -0.06 0.00 0.10 0.00 0.00 34.13 32.10 3i5c s GLU 254 CO -0.05 0.46 -0.02 -0.06 0.02 0.00 0.00 175.26 175.61 3i5c s PHE 255 N -0.32 2.02 0.01 1.61 0.08 0.16 0.35 117.98 121.89 3i5c s PHE 255 Ca 0.02 -0.76 -0.10 0.00 0.12 0.00 0.00 56.93 56.22 3i5c s PHE 255 Cb -0.13 -1.23 0.01 0.00 -0.57 0.00 0.00 43.02 41.10 3i5c s PHE 255 CO 0.02 0.24 0.20 0.00 -0.10 0.00 0.00 175.22 175.58 3i5c s ALA 256 N -3.04 -0.46 -0.12 5.36 0.00 -0.56 -0.31 121.76 122.62 3i5c s ALA 256 Ca 0.32 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.25 3i5c s ALA 256 Cb 0.06 0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.34 3i5c s ALA 256 CO 0.14 -0.26 -0.14 -1.64 0.00 0.00 0.00 175.76 173.86 3i5c s MET 257 N -1.64 2.13 -0.16 0.00 -1.94 0.01 -0.67 119.30 117.04 3i5c s MET 257 Ca -0.12 -0.51 -0.19 0.00 -1.71 0.00 0.00 55.69 53.16 3i5c s MET 257 Cb -0.05 -1.92 -0.04 0.00 2.01 0.00 0.00 34.83 34.83 3i5c s MET 257 CO 0.01 -0.16 0.54 0.08 -0.01 0.00 0.00 175.02 175.47 3i5c s VAL 258 N 1.29 5.12 -0.61 -6.03 1.01 0.37 -1.16 120.40 120.39 3i5c s VAL 258 Ca -0.00 1.03 0.05 0.00 0.00 0.00 0.00 61.98 63.06 3i5c s VAL 258 Cb -0.14 -3.87 0.17 0.00 0.00 0.00 0.00 36.38 32.54 3i5c s VAL 258 CO -0.06 0.23 0.43 -0.76 0.00 0.00 0.00 175.10 174.94 3i5c s LEU 259 N 1.21 3.78 0.46 3.92 1.43 0.02 -1.54 118.68 127.96 3i5c s LEU 259 Ca 0.27 -3.56 -0.24 0.00 -1.03 0.00 0.00 54.13 49.57 3i5c s LEU 259 Cb -0.16 -1.28 -0.08 0.00 0.03 0.00 0.00 46.19 44.70 3i5c s LEU 259 CO 0.11 -0.12 1.33 -2.65 0.23 0.00 0.00 176.35 175.25 3i5c n PRO 260 N 2.32 1.95 -3.22 1.29 -0.02 -1.26 -1.88 135.00 134.18 3i5c n PRO 260 Ca 0.21 0.70 -0.23 0.00 -2.02 0.00 0.00 63.50 62.16 3i5c n PRO 260 Cb 0.38 -2.50 0.05 0.00 -0.02 0.00 0.00 33.50 31.42 3i5c n PRO 260 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i5c n GLY 261 N 0.74 -0.53 3.05 -1.23 0.00 0.53 -4.90 105.19 102.84 3i5c n GLY 261 Ca 0.07 0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 3i5c n GLY 261 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i5c s THR 262 N -3.23 1.53 0.87 2.61 2.01 -0.65 -4.86 115.64 113.92 3i5c s THR 262 Ca 0.40 -0.64 -0.11 0.00 0.31 0.00 0.00 61.69 61.65 3i5c s THR 262 Cb -0.18 -1.41 0.12 0.00 0.01 0.00 0.00 72.50 71.03 3i5c s THR 262 CO 0.50 0.45 1.10 -0.94 -0.69 0.00 0.00 174.62 175.03 3i5c s SER 263 N 1.15 3.60 0.29 3.53 1.04 -1.26 -4.03 113.70 118.02 3i5c s SER 263 Ca -0.03 1.72 -0.01 0.00 0.48 0.00 0.00 55.95 58.11 3i5c s SER 263 Cb -0.14 -2.37 0.46 0.00 0.10 0.00 0.00 66.02 64.07 3i5c s SER 263 CO -0.05 -2.60 1.92 -0.65 0.98 0.00 0.00 173.24 172.85 3i5c h PRO 264 N -1.52 1.07 -0.10 4.02 0.11 -1.96 0.19 132.00 133.82 3i5c h PRO 264 Ca -0.47 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.59 3i5c h PRO 264 Cb 1.27 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3i5c h PRO 264 CO 0.51 0.71 0.00 0.78 -0.21 0.00 0.00 178.00 179.79 3i5c h GLY 265 N 1.11 0.09 1.32 -0.55 0.00 -2.00 -0.67 103.07 102.37 3i5c h GLY 265 Ca 0.37 0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.67 3i5c h GLY 265 CO -0.12 -0.01 0.19 -1.33 0.00 0.00 0.00 176.54 175.26 3i5c h GLY 266 N 0.04 0.93 1.13 4.60 0.00 -1.77 -2.25 103.07 105.74 3i5c h GLY 266 Ca 0.04 -0.50 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 3i5c h GLY 266 CO -0.07 0.48 -0.04 0.00 0.00 0.00 0.00 176.54 176.90 3i5c h ALA 267 N 1.36 0.84 -0.14 3.60 0.00 -0.66 -2.26 119.26 122.00 3i5c h ALA 267 Ca 0.19 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3i5c h ALA 267 Cb 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3i5c h ALA 267 CO -0.01 0.67 0.09 -0.09 0.00 0.00 0.00 179.25 179.91 3i5c h ARG 268 N 0.93 0.19 -0.29 0.00 1.12 -0.78 -0.56 114.38 115.00 3i5c h ARG 268 Ca 0.16 -0.01 0.06 0.00 -1.11 0.00 0.00 59.98 59.07 3i5c h ARG 268 Cb 0.60 -0.04 -0.06 0.00 -0.01 0.00 0.00 29.97 30.46 3i5c h ARG 268 CO 0.04 0.14 -0.07 -0.07 -3.11 0.00 0.00 179.97 176.89 3i5c h LEU 269 N 0.19 -0.27 -1.08 3.80 3.38 -1.22 -1.31 115.31 118.80 3i5c h LEU 269 Ca 0.05 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 3i5c h LEU 269 Cb -0.01 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3i5c h LEU 269 CO -0.01 -0.10 0.14 -0.07 0.09 0.00 0.00 178.44 178.49 3i5c h LEU 270 N 0.00 0.74 -0.16 1.67 4.07 -1.17 0.48 115.31 120.93 3i5c h LEU 270 Ca 0.14 -0.12 0.00 0.00 0.08 0.00 0.00 57.88 57.98 3i5c h LEU 270 Cb 0.21 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.75 3i5c h LEU 270 CO -0.30 0.72 0.10 0.00 -1.08 0.00 0.00 178.44 177.88 3i5c h ALA 271 N 1.38 0.20 -0.40 1.53 0.00 -0.41 0.85 119.26 122.41 3i5c h ALA 271 Ca 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3i5c h ALA 271 Cb 0.26 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3i5c h ALA 271 CO -0.00 -0.32 0.18 0.93 0.00 0.00 0.00 179.25 180.03 3i5c h GLU 272 N 0.21 0.59 -0.56 0.00 4.39 -0.85 -0.93 114.58 117.42 3i5c h GLU 272 Ca 0.06 -0.10 0.08 0.00 0.34 0.00 0.00 59.36 59.75 3i5c h GLU 272 Cb -0.01 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.47 3i5c h GLU 272 CO -0.02 0.54 0.21 -0.22 -1.16 0.00 0.00 179.01 178.35 3i5c h LYS 273 N 0.51 0.38 -0.10 2.33 3.64 -0.58 0.19 116.57 122.93 3i5c h LYS 273 Ca 0.14 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3i5c h LYS 273 Cb 0.15 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3i5c h LYS 273 CO -0.01 0.25 -0.06 0.28 -2.27 0.00 0.00 179.45 177.64 3i5c h VAL 274 N 0.39 1.33 -0.01 2.00 2.07 -0.57 -0.68 116.25 120.76 3i5c h VAL 274 Ca 0.28 -1.10 0.03 0.00 0.82 0.00 0.00 66.70 66.72 3i5c h VAL 274 Cb 0.32 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 3i5c h VAL 274 CO -0.28 0.31 -0.15 -0.09 0.02 0.00 0.00 177.57 177.39 3i5c h ARG 275 N -0.14 -0.23 -1.00 1.57 2.43 -0.90 -0.45 114.38 115.66 3i5c h ARG 275 Ca 0.02 0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.33 3i5c h ARG 275 Cb 0.52 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 30.04 3i5c h ARG 275 CO 0.02 -0.15 0.63 -0.09 -1.51 0.00 0.00 179.97 178.86 3i5c h ARG 276 N -0.24 0.93 -0.14 0.20 2.43 -0.62 -1.17 114.38 115.77 3i5c h ARG 276 Ca 0.05 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 3i5c h ARG 276 Cb 0.31 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 3i5c h ARG 276 CO -0.15 0.62 -0.49 1.15 -1.51 0.00 0.00 179.97 179.58 3i5c h THR 277 N 0.96 1.33 -0.54 0.20 2.02 -0.50 -1.41 112.91 114.97 3i5c h THR 277 Ca 0.50 -1.72 -0.08 0.00 0.77 0.00 0.00 66.41 65.87 3i5c h THR 277 Cb 0.53 1.77 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 3i5c h THR 277 CO -0.27 0.52 0.02 0.58 0.37 0.00 0.00 175.52 176.75 3i5c h VAL 278 N 0.30 1.26 0.03 3.16 2.07 -0.07 -2.97 116.25 120.04 3i5c h VAL 278 Ca 0.01 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 3i5c h VAL 278 Cb 0.98 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 3i5c h VAL 278 CO 0.08 0.38 -0.02 -0.08 0.02 0.00 0.00 177.57 177.96 3i5c h GLU 279 N 0.82 -0.04 0.00 1.57 4.81 -1.07 -2.59 114.58 118.08 3i5c h GLU 279 Ca 0.16 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3i5c h GLU 279 Cb 0.51 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.89 3i5c h GLU 279 CO 0.02 0.17 0.04 -1.13 -0.73 0.00 0.00 179.01 177.38 3i5c n SER 280 N -5.01 0.00 0.23 1.04 3.41 -0.55 0.87 113.62 113.61 3i5c n SER 280 Ca -0.08 0.45 0.11 0.00 -0.26 0.00 0.00 58.87 59.09 3i5c n SER 280 Cb 0.13 -0.45 0.46 0.00 -0.26 0.00 0.00 64.21 64.09 3i5c n SER 280 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3i5c h LEU 281 N 0.00 0.00 -3.88 1.04 3.38 -1.29 -3.48 115.31 111.08 3i5c h LEU 281 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 3i5c h LEU 281 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3i5c h LEU 281 CO 0.00 0.18 -1.03 0.00 0.09 0.00 0.00 178.44 177.69 3i5c n GLN 282 N -3.31 -0.52 -3.13 1.13 6.02 0.25 -4.94 117.38 112.88 3i5c n GLN 282 Ca 0.01 0.22 -0.39 0.00 -0.01 0.00 0.00 57.00 56.83 3i5c n GLN 282 Cb 0.43 -2.52 -0.05 0.00 1.02 0.00 0.00 30.24 29.11 3i5c n GLN 282 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3i5c s ILE 283 N -3.42 4.95 -0.02 5.09 1.01 -1.26 -4.92 121.20 122.62 3i5c s ILE 283 Ca 0.40 1.35 -0.30 0.00 0.00 0.00 0.00 60.65 62.09 3i5c s ILE 283 Cb -0.22 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 3i5c s ILE 283 CO 0.95 0.35 1.18 -0.44 0.00 0.00 0.00 174.94 176.99 3i5c s SER 284 N 0.21 7.08 0.02 3.58 0.01 -1.26 -0.23 113.70 123.11 3i5c s SER 284 Ca 0.34 1.86 0.00 0.00 1.31 0.00 0.00 55.95 59.46 3i5c s SER 284 Cb -0.18 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.47 3i5c s SER 284 CO 0.18 -0.53 -0.03 -2.28 0.41 0.00 0.00 173.24 170.99 3i5c s HIS 285 N 1.80 0.27 -1.68 2.43 2.46 -0.69 -4.83 115.29 115.05 3i5c s HIS 285 Ca 0.56 -0.37 0.17 0.00 0.47 0.00 0.00 55.06 55.90 3i5c s HIS 285 Cb -0.26 -0.18 0.56 0.00 -0.13 0.00 0.00 32.58 32.57 3i5c s HIS 285 CO 0.24 -0.12 1.46 -0.40 -2.47 0.00 0.00 174.74 173.46 3i5c n ASP 286 N 2.03 3.57 -4.29 9.88 3.85 -1.26 -1.93 116.55 128.40 3i5c n ASP 286 Ca -0.20 -2.15 -0.31 0.00 -0.71 0.00 0.00 54.79 51.41 3i5c n ASP 286 Cb 0.56 -0.45 -0.16 0.00 -1.35 0.00 0.00 41.12 39.72 3i5c n ASP 286 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 3i5c s GLN 287 N -1.44 2.38 0.08 0.11 -1.52 -1.26 -2.81 119.66 115.20 3i5c s GLN 287 Ca 0.41 -0.91 -0.11 0.00 -1.95 0.00 0.00 55.36 52.80 3i5c s GLN 287 Cb 0.24 -2.12 -0.22 0.00 -0.22 0.00 0.00 33.01 30.69 3i5c s GLN 287 CO 0.25 0.45 1.19 -1.35 -0.25 0.00 0.00 175.29 175.58 3i5c h PRO 288 N 5.84 0.60 -6.69 2.91 0.11 -1.97 -3.45 132.00 129.34 3i5c h PRO 288 Ca -0.36 -0.69 -0.50 0.00 0.11 0.00 0.00 66.00 64.56 3i5c h PRO 288 Cb 1.15 0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.45 3i5c h PRO 288 CO 0.47 1.29 0.36 1.03 -0.21 0.00 0.00 178.00 180.93 3i5c s ARG 289 N -3.19 4.80 0.49 1.05 0.52 -1.25 -4.95 118.95 116.43 3i5c s ARG 289 Ca -0.08 1.49 0.31 0.00 -0.52 0.00 0.00 55.73 56.93 3i5c s ARG 289 Cb 0.07 -3.31 1.71 0.00 0.52 0.00 0.00 34.95 33.94 3i5c s ARG 289 CO 0.91 0.41 1.96 -1.35 0.02 0.00 0.00 175.30 177.25 3i5c h PRO 290 N 4.59 0.00 -0.81 3.54 0.11 -1.81 -2.32 132.00 135.30 3i5c h PRO 290 Ca -0.44 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.20 3i5c h PRO 290 Cb 1.20 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.05 3i5c h PRO 290 CO 0.69 0.00 0.40 0.41 -0.21 0.00 0.00 178.00 179.29 3i5c n GLY 291 N -1.20 5.03 4.00 -0.55 0.00 -1.26 -4.36 105.19 106.84 3i5c n GLY 291 Ca -0.02 -1.49 -0.20 0.00 0.00 0.00 0.00 46.02 44.31 3i5c n GLY 291 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3i5c s SER 292 N -1.91 5.16 0.19 1.61 0.15 -0.81 -4.99 113.70 113.10 3i5c s SER 292 Ca 0.55 -0.34 0.05 0.00 0.70 0.00 0.00 55.95 56.91 3i5c s SER 292 Cb 0.46 -0.44 -0.05 0.00 -1.71 0.00 0.00 66.02 64.29 3i5c s SER 292 CO 0.05 -1.22 -0.08 -2.28 1.20 0.00 0.00 173.24 170.90 3i5c s HIS 293 N -2.71 1.48 0.48 3.44 5.04 -1.26 -1.70 115.29 120.06 3i5c s HIS 293 Ca 0.59 -0.76 -0.24 0.00 -1.54 0.00 0.00 55.06 53.11 3i5c s HIS 293 Cb -0.08 -0.77 -0.07 0.00 0.04 0.00 0.00 32.58 31.69 3i5c s HIS 293 CO 0.38 0.12 1.42 1.28 -2.34 0.00 0.00 174.74 175.61 3i5c n LEU 294 N -0.32 5.27 -4.07 8.88 4.77 0.68 -4.77 117.00 127.45 3i5c n LEU 294 Ca -0.08 1.09 -0.10 0.00 -0.03 0.00 0.00 56.01 56.89 3i5c n LEU 294 Cb 0.62 -1.60 -0.08 0.00 -2.33 0.00 0.00 43.42 40.02 3i5c n LEU 294 CO 0.34 -0.24 -0.15 0.42 -1.33 0.00 0.00 177.39 176.43 3i5c s THR 295 N -1.21 0.07 0.13 -5.08 -4.23 -1.26 -4.15 115.64 99.90 3i5c s THR 295 Ca 0.64 -1.67 0.09 0.00 -1.18 0.00 0.00 61.69 59.56 3i5c s THR 295 Cb -0.44 -2.00 -0.04 0.00 1.34 0.00 0.00 72.50 71.36 3i5c s THR 295 CO 0.55 -0.33 -0.21 0.68 -0.54 0.00 0.00 174.62 174.77 3i5c s VAL 296 N -4.02 1.85 0.03 2.29 -7.23 -1.26 -0.61 120.40 111.44 3i5c s VAL 296 Ca 0.22 -1.70 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 3i5c s VAL 296 Cb 0.05 -1.72 -0.04 0.00 0.56 0.00 0.00 36.38 35.23 3i5c s VAL 296 CO 0.02 -0.11 0.13 -0.44 -0.31 0.00 0.00 175.10 174.39 3i5c s SER 297 N -2.18 5.92 -0.04 4.85 0.01 0.24 -3.49 113.70 119.02 3i5c s SER 297 Ca 0.11 0.17 -0.00 0.00 1.31 0.00 0.00 55.95 57.54 3i5c s SER 297 Cb -0.09 -1.74 0.03 0.00 0.21 0.00 0.00 66.02 64.43 3i5c s SER 297 CO 0.05 0.23 0.00 -0.63 0.41 0.00 0.00 173.24 173.30 3i5c s ILE 298 N -1.33 0.23 -0.11 1.44 1.01 -0.56 -0.87 121.20 121.00 3i5c s ILE 298 Ca 0.28 0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.99 3i5c s ILE 298 Cb -0.12 -0.35 -0.04 0.00 0.01 0.00 0.00 42.46 41.96 3i5c s ILE 298 CO 0.20 0.18 0.07 -0.83 0.00 0.00 0.00 174.94 174.56 3i5c s GLY 299 N 1.34 1.99 -0.04 6.18 0.00 0.09 -0.29 107.32 116.58 3i5c s GLY 299 Ca -0.05 -0.73 0.07 0.00 0.00 0.00 0.00 44.72 44.01 3i5c s GLY 299 CO -0.02 -0.41 -0.25 0.14 0.00 0.00 0.00 173.10 172.55 3i5c s VAL 300 N -0.78 2.08 0.02 1.40 1.01 -0.61 -0.96 120.40 122.55 3i5c s VAL 300 Ca 0.13 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 60.99 3i5c s VAL 300 Cb -0.12 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 3i5c s VAL 300 CO 0.03 0.58 0.05 -0.94 0.00 0.00 0.00 175.10 174.81 3i5c s SER 301 N -0.40 0.16 -0.02 3.32 1.04 -0.82 -2.18 113.70 114.80 3i5c s SER 301 Ca 0.04 -0.41 -0.10 0.00 0.48 0.00 0.00 55.95 55.96 3i5c s SER 301 Cb -0.12 0.16 0.01 0.00 0.10 0.00 0.00 66.02 66.17 3i5c s SER 301 CO 0.01 -0.36 0.21 0.28 0.98 0.00 0.00 173.24 174.36 3i5c s THR 302 N -1.64 0.06 -0.02 2.02 -1.32 -1.26 -1.12 115.64 112.36 3i5c s THR 302 Ca -0.14 -0.52 -0.13 0.00 -1.21 0.00 0.00 61.69 59.69 3i5c s THR 302 Cb -0.07 -0.48 0.02 0.00 -1.51 0.00 0.00 72.50 70.45 3i5c s THR 302 CO -0.01 -0.29 0.28 -0.76 -2.21 0.00 0.00 174.62 171.64 3i5c s LEU 303 N -1.16 0.97 -0.35 9.08 1.43 -0.87 -4.98 118.68 122.81 3i5c s LEU 303 Ca -0.12 0.07 -0.14 0.00 -1.03 0.00 0.00 54.13 52.91 3i5c s LEU 303 Cb -0.06 1.15 -0.01 0.00 0.03 0.00 0.00 46.19 47.30 3i5c s LEU 303 CO 0.02 -0.41 0.32 -0.69 0.23 0.00 0.00 176.35 175.82 3i5c s VAL 304 N -1.22 5.21 0.82 -1.59 1.01 -1.26 -1.32 120.40 122.05 3i5c s VAL 304 Ca -0.13 -0.08 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 3i5c s VAL 304 Cb -0.05 -3.79 0.09 0.00 0.00 0.00 0.00 36.38 32.62 3i5c s VAL 304 CO 0.03 -0.08 1.21 -2.84 0.00 0.00 0.00 175.10 173.42 3i5c s PRO 305 N 1.91 1.57 0.00 2.72 0.02 -1.26 -4.20 135.00 135.75 3i5c s PRO 305 Ca 0.10 1.76 0.00 0.00 0.02 0.00 0.00 61.00 62.87 3i5c s PRO 305 Cb -0.17 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.58 3i5c s PRO 305 CO 0.11 -2.26 0.00 0.41 -0.33 0.00 0.00 177.00 174.93 3i5c n GLY 306 N 0.50 1.88 3.77 0.52 0.00 -1.26 -4.70 105.19 105.89 3i5c n GLY 306 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 3i5c n GLY 306 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i5c s GLY 307 N -1.54 2.96 0.06 -0.02 0.00 -1.26 -4.92 107.32 102.59 3i5c s GLY 307 Ca 0.00 0.98 -0.36 0.00 0.00 0.00 0.00 44.72 45.34 3i5c s GLY 307 CO 0.00 1.55 1.44 0.61 0.00 0.00 0.00 173.10 176.70 3i5c n GLY 308 N 0.84 0.67 2.57 0.20 0.00 -1.26 -1.91 105.19 106.30 3i5c n GLY 308 Ca 0.02 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.75 3i5c n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i5c n GLY 309 N 2.92 0.37 3.88 -0.02 0.00 -1.26 -5.00 105.19 106.08 3i5c n GLY 309 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3i5c n GLY 309 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i5c s GLN 310 N -0.67 3.40 0.26 1.61 -0.21 -0.80 -4.98 119.66 118.26 3i5c s GLN 310 Ca 0.00 -0.27 -0.01 0.00 0.02 0.00 0.00 55.36 55.11 3i5c s GLN 310 Cb 0.00 -3.10 -0.03 0.00 1.00 0.00 0.00 33.01 30.88 3i5c s GLN 310 CO 0.00 0.71 0.26 0.95 -2.12 0.00 0.00 175.29 175.10 3i5c s THR 311 N -1.19 0.00 0.62 -0.19 -4.23 -1.26 -4.79 115.64 104.60 3i5c s THR 311 Ca 0.22 -1.86 0.35 0.00 -1.18 0.00 0.00 61.69 59.22 3i5c s THR 311 Cb -0.12 -2.48 0.39 0.00 1.34 0.00 0.00 72.50 71.63 3i5c s THR 311 CO 0.12 0.00 2.28 2.19 -0.54 0.00 0.00 174.62 178.68 3i5c h PHE 312 N 2.38 0.00 -0.33 3.99 -5.15 -1.96 -0.86 116.94 115.02 3i5c h PHE 312 Ca -0.31 0.00 -0.14 0.00 -0.20 0.00 0.00 57.97 57.33 3i5c h PHE 312 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.40 3i5c h PHE 312 CO 0.84 0.00 -0.35 -0.09 -2.00 0.00 0.00 178.31 176.71 3i5c h ARG 313 N 0.00 0.73 0.00 6.09 9.65 -1.99 -2.49 114.38 126.37 3i5c h ARG 313 Ca 0.01 -0.35 -0.14 0.00 -1.10 0.00 0.00 59.98 58.40 3i5c h ARG 313 Cb 0.05 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.60 3i5c h ARG 313 CO -0.00 0.97 -0.66 -0.24 2.80 0.00 0.00 179.97 182.84 3i5c h VAL 314 N 0.61 1.45 -0.67 0.20 3.04 -1.55 -1.69 116.25 117.64 3i5c h VAL 314 Ca 0.06 -2.27 -0.00 0.00 -1.01 0.00 0.00 66.70 63.47 3i5c h VAL 314 Cb 0.88 2.23 -0.03 0.00 -2.01 0.00 0.00 31.29 32.36 3i5c h VAL 314 CO 0.08 0.65 0.40 0.25 -1.01 0.00 0.00 177.57 177.93 3i5c h LEU 315 N 0.00 0.80 -0.07 3.16 5.85 -1.12 -0.70 115.31 123.23 3i5c h LEU 315 Ca -0.01 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 3i5c h LEU 315 Cb 1.18 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.01 3i5c h LEU 315 CO 0.09 0.63 0.03 0.40 -0.34 0.00 0.00 178.44 179.24 3i5c h ILE 316 N 0.91 1.13 -0.98 4.05 2.04 -1.25 -2.58 117.51 120.83 3i5c h ILE 316 Ca 0.24 -0.38 0.12 0.00 1.00 0.00 0.00 64.86 65.84 3i5c h ILE 316 Cb -0.03 1.26 -0.08 0.00 -0.74 0.00 0.00 36.82 37.23 3i5c h ILE 316 CO -0.04 0.11 0.60 -0.33 0.00 0.00 0.00 178.15 178.49 3i5c h GLU 317 N -0.03 0.92 -0.44 2.37 5.08 -0.91 0.13 114.58 121.70 3i5c h GLU 317 Ca 0.02 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 3i5c h GLU 317 Cb 0.15 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3i5c h GLU 317 CO -0.00 0.61 0.15 0.52 -1.00 0.00 0.00 179.01 179.28 3i5c h MET 318 N 0.95 0.68 -0.39 2.33 2.86 -1.03 -0.02 114.93 120.30 3i5c h MET 318 Ca 0.49 -0.14 -0.11 0.00 -2.06 0.00 0.00 59.70 57.87 3i5c h MET 318 Cb 0.49 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 3i5c h MET 318 CO -0.27 0.65 -0.21 0.00 1.06 0.00 0.00 176.91 178.14 3i5c h ALA 319 N 1.00 0.89 -0.44 6.32 0.00 -0.87 -0.74 119.26 125.42 3i5c h ALA 319 Ca 0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3i5c h ALA 319 Cb 0.25 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3i5c h ALA 319 CO -0.01 0.63 0.15 -0.44 0.00 0.00 0.00 179.25 179.58 3i5c h ASP 320 N 0.67 0.63 -0.16 0.00 5.19 -0.63 0.52 116.42 122.64 3i5c h ASP 320 Ca 0.10 -0.19 0.05 0.00 -0.62 0.00 0.00 57.03 56.36 3i5c h ASP 320 Cb 0.72 -0.16 -0.06 0.00 0.18 0.00 0.00 39.33 40.00 3i5c h ASP 320 CO 0.06 0.65 -0.25 1.56 -3.12 0.00 0.00 179.24 178.14 3i5c h GLN 321 N 0.56 -0.29 -0.36 3.56 4.20 -0.68 -1.11 115.11 121.00 3i5c h GLN 321 Ca 0.14 0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 3i5c h GLN 321 Cb 0.24 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 3i5c h GLN 321 CO -0.01 -0.19 0.19 0.00 -0.67 0.00 0.00 178.83 178.16 3i5c h ALA 322 N 0.67 1.67 -0.52 3.87 0.00 -0.88 -1.72 119.26 122.35 3i5c h ALA 322 Ca 0.11 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3i5c h ALA 322 Cb 0.46 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3i5c h ALA 322 CO -0.33 0.28 0.15 1.25 0.00 0.00 0.00 179.25 180.60 3i5c h LEU 323 N 0.49 0.77 -0.21 0.00 5.85 -0.03 -2.02 115.31 120.16 3i5c h LEU 323 Ca 0.13 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.68 3i5c h LEU 323 Cb 0.02 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 3i5c h LEU 323 CO -0.02 0.79 -0.13 0.22 -0.34 0.00 0.00 178.44 178.96 3i5c h TYR 324 N 0.72 -0.31 -0.19 1.25 3.20 -0.34 -1.69 116.97 119.62 3i5c h TYR 324 Ca 0.17 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.11 3i5c h TYR 324 Cb 0.30 0.17 -0.07 0.00 1.54 0.00 0.00 36.73 38.67 3i5c h TYR 324 CO 0.02 -0.19 -0.38 1.96 -1.64 0.00 0.00 178.16 177.93 3i5c h GLN 325 N -0.11 -0.40 -0.58 1.82 4.20 -1.02 -0.40 115.11 118.61 3i5c h GLN 325 Ca 0.12 0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.97 3i5c h GLN 325 Cb 0.29 0.09 -0.11 0.00 0.30 0.00 0.00 27.48 28.05 3i5c h GLN 325 CO -0.28 -0.27 -0.17 0.00 -0.67 0.00 0.00 178.83 177.44 3i5c h ALA 326 N 0.31 0.34 -0.64 3.87 0.00 -0.94 0.04 119.26 122.25 3i5c h ALA 326 Ca 0.10 0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 3i5c h ALA 326 Cb 0.59 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3i5c h ALA 326 CO -0.42 -0.46 0.27 0.87 0.00 0.00 0.00 179.25 179.52 3i5c h LYS 327 N -0.02 0.94 -0.00 0.00 1.57 -0.62 -1.48 116.57 116.95 3i5c h LYS 327 Ca 0.28 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3i5c h LYS 327 Cb 0.45 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3i5c h LYS 327 CO -0.61 0.78 -0.04 0.09 -0.57 0.00 0.00 179.45 179.10 3i5c n ASN 328 N -4.45 0.15 -1.63 0.86 4.13 -0.22 -2.12 115.26 111.97 3i5c n ASN 328 Ca 0.04 -0.33 0.08 0.00 1.68 0.00 0.00 54.58 56.06 3i5c n ASN 328 Cb 0.15 -0.20 0.37 0.00 -1.54 0.00 0.00 39.78 38.56 3i5c n ASN 328 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3i5c n ASN 329 N -1.17 5.05 0.00 6.41 5.03 -0.09 -4.89 115.26 125.60 3i5c n ASN 329 Ca 0.15 -2.67 0.00 0.00 0.87 0.00 0.00 54.58 52.93 3i5c n ASN 329 Cb 0.25 -0.61 0.00 0.00 -1.02 0.00 0.00 39.78 38.39 3i5c n ASN 329 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3i5c n GLY 330 N 0.79 1.18 5.00 7.41 0.00 -1.02 -5.04 105.19 113.52 3i5c n GLY 330 Ca 0.26 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.34 3i5c n GLY 330 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i5c n ARG 331 N -1.04 -0.96 -4.19 1.61 1.74 -0.59 -4.90 116.66 108.35 3i5c n ARG 331 Ca 0.00 0.63 -0.34 0.00 -0.77 0.00 0.00 57.85 57.37 3i5c n ARG 331 Cb 0.00 -1.17 -0.05 0.00 -1.02 0.00 0.00 32.46 30.22 3i5c n ARG 331 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3i5c n ASN 332 N -3.14 -0.75 -3.57 0.55 5.15 -1.24 -4.90 115.26 107.36 3i5c n ASN 332 Ca 0.00 -1.24 -0.07 0.00 -0.60 0.00 0.00 54.58 52.68 3i5c n ASN 332 Cb 0.22 -1.87 -0.00 0.00 -0.53 0.00 0.00 39.78 37.59 3i5c n ASN 332 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3i5c s GLN 333 N -7.24 1.76 -0.24 1.20 -2.07 -1.23 -4.98 119.66 106.87 3i5c s GLN 333 Ca 0.15 -1.04 -0.07 0.00 -1.82 0.00 0.00 55.36 52.58 3i5c s GLN 333 Cb -0.08 0.56 -0.03 0.00 -1.09 0.00 0.00 33.01 32.37 3i5c s GLN 333 CO 0.97 -0.81 0.07 0.08 -1.32 0.00 0.00 175.29 174.28 3i5c s VAL 334 N -3.26 4.42 -0.05 3.63 1.01 -1.26 -1.50 120.40 123.39 3i5c s VAL 334 Ca 0.13 -0.14 -0.07 0.00 0.00 0.00 0.00 61.98 61.90 3i5c s VAL 334 Cb -0.05 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 3i5c s VAL 334 CO 0.07 0.36 0.22 -0.83 0.00 0.00 0.00 175.10 174.91 3i5c s GLY 335 N 1.41 2.23 0.04 4.51 0.00 0.60 -4.88 107.32 111.23 3i5c s GLY 335 Ca 0.05 -0.59 0.04 0.00 0.00 0.00 0.00 44.72 44.23 3i5c s GLY 335 CO 0.04 -0.36 -0.06 1.08 0.00 0.00 0.00 173.10 173.79 3i5c s LEU 336 N -1.39 3.19 0.70 0.66 1.43 -1.26 -1.57 118.68 120.43 3i5c s LEU 336 Ca 0.22 -0.21 -0.15 0.00 -1.03 0.00 0.00 54.13 52.96 3i5c s LEU 336 Cb -0.13 -1.88 0.02 0.00 0.03 0.00 0.00 46.19 44.23 3i5c s LEU 336 CO 0.11 0.24 1.18 0.00 0.23 0.00 0.00 176.35 178.11 3i5c s MET 337 N -1.74 2.36 -0.42 1.70 0.00 -0.93 -4.73 119.30 115.54 3i5c s MET 337 Ca 0.19 1.68 -0.24 0.00 0.00 0.00 0.00 55.69 57.32 3i5c s MET 337 Cb -0.11 -1.87 0.02 0.00 0.00 0.00 0.00 34.83 32.87 3i5c s MET 337 CO 0.11 -1.65 0.86 -1.21 0.00 0.00 0.00 175.02 173.13 3i5c s GLU 338 N -3.90 3.62 0.00 3.16 0.41 -1.26 -5.08 118.70 115.64 3i5c s GLU 338 Ca 0.73 0.22 0.15 0.00 -0.41 0.00 0.00 54.97 55.66 3i5c s GLU 338 Cb -0.27 -3.88 0.91 0.00 -1.78 0.00 0.00 34.13 29.11 3i5c s GLU 338 CO 0.43 -1.06 1.33 1.04 -0.49 0.00 0.00 175.26 176.51