#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iqa n GLN 162 N 0.00 1.97 -1.73 0.00 3.00 -1.26 -4.85 117.38 114.50 1iqa n GLN 162 Ca 0.00 0.69 -0.34 0.00 -0.01 0.00 0.00 57.00 57.35 1iqa n GLN 162 Cb 0.00 -2.26 0.05 0.00 0.00 0.00 0.00 30.24 28.03 1iqa n GLN 162 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.06 174.92 1iqa s PRO 163 N -1.90 2.69 0.09 -1.09 0.02 -1.26 -4.90 135.00 128.66 1iqa s PRO 163 Ca 0.57 1.52 -0.27 0.00 0.02 0.00 0.00 61.00 62.84 1iqa s PRO 163 Cb -0.57 -1.93 0.08 0.00 0.02 0.00 0.00 34.50 32.10 1iqa s PRO 163 CO 0.61 -1.36 0.99 -0.59 -0.33 0.00 0.00 177.00 176.33 1iqa s PHE 164 N -2.17 -0.17 -0.11 6.54 -0.12 -0.54 -2.01 117.98 119.40 1iqa s PHE 164 Ca 0.70 -0.07 -0.30 0.00 -0.05 0.00 0.00 56.93 57.21 1iqa s PHE 164 Cb -0.23 0.60 0.08 0.00 -0.63 0.00 0.00 43.02 42.84 1iqa s PHE 164 CO 0.41 -0.68 0.76 0.00 -0.05 0.00 0.00 175.22 175.65 1iqa s ALA 165 N -3.12 -1.81 -0.20 1.99 0.00 -0.01 -0.22 121.76 118.39 1iqa s ALA 165 Ca 0.11 1.50 -0.04 0.00 0.00 0.00 0.00 51.96 53.53 1iqa s ALA 165 Cb -0.01 -0.37 0.10 0.00 0.00 0.00 0.00 23.12 22.84 1iqa s ALA 165 CO -0.01 -0.35 0.27 -1.58 0.00 0.00 0.00 175.76 174.09 1iqa s HIS 166 N -0.86 -0.44 0.00 0.00 5.04 0.17 -1.64 115.29 117.56 1iqa s HIS 166 Ca -0.07 0.52 0.07 0.00 -1.54 0.00 0.00 55.06 54.04 1iqa s HIS 166 Cb -0.01 -0.21 -0.03 0.00 0.04 0.00 0.00 32.58 32.38 1iqa s HIS 166 CO 0.06 -0.59 -0.21 -0.51 -2.34 0.00 0.00 174.74 171.15 1iqa s LEU 167 N 2.40 2.37 0.09 8.88 1.43 -0.04 -1.14 118.68 132.68 1iqa s LEU 167 Ca 0.07 -0.42 0.10 0.00 -1.03 0.00 0.00 54.13 52.85 1iqa s LEU 167 Cb -0.15 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 1iqa s LEU 167 CO -0.12 0.30 -0.26 0.42 0.23 0.00 0.00 176.35 176.91 1iqa s THR 168 N -0.76 2.24 0.27 5.49 -4.23 -1.09 -1.70 115.64 115.86 1iqa s THR 168 Ca 0.12 -1.59 -0.30 0.00 -1.18 0.00 0.00 61.69 58.74 1iqa s THR 168 Cb -0.10 -1.94 -0.11 0.00 1.34 0.00 0.00 72.50 71.68 1iqa s THR 168 CO 0.02 0.21 1.59 -0.51 -0.54 0.00 0.00 174.62 175.39 1iqa s ILE 169 N -0.95 2.15 -0.37 2.99 1.10 -1.02 0.04 121.20 125.14 1iqa s ILE 169 Ca 0.13 0.13 -0.13 0.00 -0.51 0.00 0.00 60.65 60.27 1iqa s ILE 169 Cb -0.10 -3.08 0.00 0.00 0.15 0.00 0.00 42.46 39.43 1iqa s ILE 169 CO 0.04 0.02 0.25 0.21 -2.11 0.00 0.00 174.94 173.35 1iqa s ASN 170 N 0.58 6.00 0.00 4.50 3.04 -0.23 -4.72 114.94 124.11 1iqa s ASN 170 Ca 0.64 -0.65 0.00 0.00 0.04 0.00 0.00 52.86 52.89 1iqa s ASN 170 Cb -0.47 -2.12 0.00 0.00 -1.54 0.00 0.00 41.25 37.11 1iqa s ASN 170 CO 0.45 -0.32 0.55 0.00 -3.04 0.00 0.00 177.10 174.74 1iqa n ALA 171 N 5.10 0.57 0.03 1.71 0.00 -1.26 -1.68 120.51 124.98 1iqa n ALA 171 Ca -0.12 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.19 1iqa n ALA 171 Cb 0.48 -0.48 -0.09 0.00 0.00 0.00 0.00 19.45 19.37 1iqa n ALA 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iqa h ALA 172 N 0.95 -0.07 0.00 0.00 0.00 -1.93 -3.35 119.26 114.86 1iqa h ALA 172 Ca 0.00 -0.18 -0.63 0.00 0.00 0.00 0.00 54.91 54.10 1iqa h ALA 172 Cb 0.32 0.03 0.05 0.00 0.00 0.00 0.00 17.79 18.19 1iqa h ALA 172 CO 0.00 -0.36 2.33 -1.13 0.00 0.00 0.00 179.25 180.10 1iqa n SER 173 N -4.95 2.71 -3.21 0.00 3.41 -0.68 -4.65 113.62 106.25 1iqa n SER 173 Ca -0.08 -2.65 -0.01 0.00 -0.26 0.00 0.00 58.87 55.87 1iqa n SER 173 Cb 0.21 -1.12 -0.03 0.00 -0.26 0.00 0.00 64.21 63.01 1iqa n SER 173 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1iqa s ILE 174 N 4.85 -0.86 0.09 -1.33 1.01 -1.26 -4.76 121.20 118.94 1iqa s ILE 174 Ca 0.56 -0.08 -0.02 0.00 0.00 0.00 0.00 60.65 61.11 1iqa s ILE 174 Cb 0.14 -0.97 0.02 0.00 0.01 0.00 0.00 42.46 41.66 1iqa s ILE 174 CO 0.10 -0.08 0.11 -0.81 0.00 0.00 0.00 174.94 174.26 1iqa n PRO 175 N 5.40 -0.29 -0.52 2.79 -0.05 -1.26 -4.94 135.00 136.12 1iqa n PRO 175 Ca 0.01 -0.18 0.04 0.00 -0.05 0.00 0.00 63.50 63.32 1iqa n PRO 175 Cb 0.52 -0.13 0.21 0.00 -0.05 0.00 0.00 33.50 34.05 1iqa n PRO 175 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 1iqa n SER 176 N -3.09 2.77 -4.90 3.54 3.41 -1.26 -4.08 113.62 110.01 1iqa n SER 176 Ca 0.01 -3.43 -0.22 0.00 -0.26 0.00 0.00 58.87 54.97 1iqa n SER 176 Cb 0.05 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 63.43 1iqa n SER 176 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1iqa s GLY 177 N -2.52 2.16 -0.02 5.00 0.00 -1.26 -4.92 107.32 105.76 1iqa s GLY 177 Ca 0.41 -1.74 0.20 0.00 0.00 0.00 0.00 44.72 43.58 1iqa s GLY 177 CO 0.02 -1.77 0.55 -1.26 0.00 0.00 0.00 173.10 170.64 1iqa n SER 178 N -1.69 0.53 -4.66 1.64 2.88 -1.26 -3.70 113.62 107.35 1iqa n SER 178 Ca 0.04 -0.26 -0.42 0.00 -1.33 0.00 0.00 58.87 56.90 1iqa n SER 178 Cb 0.62 1.68 0.00 0.00 -0.75 0.00 0.00 64.21 65.76 1iqa n SER 178 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1iqa n HIS 179 N -2.00 1.76 -2.24 0.66 -0.00 -1.26 -2.41 115.22 109.73 1iqa n HIS 179 Ca -0.02 0.55 -0.41 0.00 -0.00 0.00 0.00 57.72 57.85 1iqa n HIS 179 Cb 0.47 -2.32 -0.03 0.00 -0.00 0.00 0.00 29.99 28.11 1iqa n HIS 179 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.34 176.55 1iqa s LYS 180 N -2.00 4.44 0.13 -0.41 2.20 -1.26 -4.22 119.74 118.62 1iqa s LYS 180 Ca 0.60 2.06 -0.02 0.00 -0.36 0.00 0.00 55.97 58.26 1iqa s LYS 180 Cb -0.56 -3.14 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 1iqa s LYS 180 CO 0.59 -0.10 0.07 0.14 -0.36 0.00 0.00 175.35 175.68 1iqa s VAL 181 N -0.78 0.11 -0.14 4.02 -7.23 -0.70 -4.97 120.40 110.71 1iqa s VAL 181 Ca 0.50 -1.85 -0.21 0.00 -1.81 0.00 0.00 61.98 58.61 1iqa s VAL 181 Cb -0.37 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.56 1iqa s VAL 181 CO 0.46 -0.50 0.61 -0.89 -0.31 0.00 0.00 175.10 174.47 1iqa s THR 182 N -4.03 5.07 -0.11 5.32 2.01 -1.26 -1.10 115.64 121.55 1iqa s THR 182 Ca 0.22 1.21 -0.30 0.00 0.31 0.00 0.00 61.69 63.13 1iqa s THR 182 Cb 0.07 -3.94 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 1iqa s THR 182 CO 0.01 0.21 1.14 -0.76 -0.69 0.00 0.00 174.62 174.53 1iqa s LEU 183 N 1.25 4.23 0.00 4.42 1.43 0.82 -4.92 118.68 125.91 1iqa s LEU 183 Ca 0.31 1.67 0.18 0.00 -1.03 0.00 0.00 54.13 55.25 1iqa s LEU 183 Cb -0.16 -3.55 0.22 0.00 0.03 0.00 0.00 46.19 42.73 1iqa s LEU 183 CO 0.13 -0.59 1.14 -1.54 0.23 0.00 0.00 176.35 175.72 1iqa n SER 184 N 5.52 2.71 -3.63 2.29 3.41 -1.26 -4.56 113.62 118.10 1iqa n SER 184 Ca 0.11 -1.80 -0.26 0.00 -0.26 0.00 0.00 58.87 56.66 1iqa n SER 184 Cb 0.47 -0.08 -0.17 0.00 -0.26 0.00 0.00 64.21 64.16 1iqa n SER 184 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1iqa s SER 185 N -1.38 2.31 0.11 4.04 0.01 -1.26 -2.30 113.70 115.23 1iqa s SER 185 Ca 0.24 -0.58 0.08 0.00 1.31 0.00 0.00 55.95 57.01 1iqa s SER 185 Cb 0.16 -0.28 -0.04 0.00 0.21 0.00 0.00 66.02 66.07 1iqa s SER 185 CO 0.23 -0.33 -0.19 0.26 0.41 0.00 0.00 173.24 173.61 1iqa s TRP 186 N 2.10 1.72 0.11 2.43 0.52 -1.26 -1.07 118.94 123.48 1iqa s TRP 186 Ca 0.02 -0.44 -0.08 0.00 0.02 0.00 0.00 56.10 55.62 1iqa s TRP 186 Cb -0.16 -0.92 -0.06 0.00 -1.15 0.00 0.00 33.47 31.19 1iqa s TRP 186 CO -0.08 0.21 0.39 0.71 0.02 0.00 0.00 176.95 178.21 1iqa s TYR 187 N -1.43 3.53 0.00 -1.98 4.12 0.11 -4.81 117.35 116.88 1iqa s TYR 187 Ca 0.08 0.70 0.00 0.00 0.02 0.00 0.00 57.07 57.86 1iqa s TYR 187 Cb -0.09 -2.10 0.00 0.00 -1.52 0.00 0.00 41.96 38.25 1iqa s TYR 187 CO 0.04 0.48 0.67 -2.39 0.02 0.00 0.00 175.55 174.37 1iqa n HIS 188 N 0.55 0.00 -2.34 2.71 1.44 -1.26 -2.67 115.22 113.65 1iqa n HIS 188 Ca -0.06 -0.21 0.04 0.00 -2.01 0.00 0.00 57.72 55.49 1iqa n HIS 188 Cb 0.52 -0.02 0.05 0.00 0.12 0.00 0.00 29.99 30.66 1iqa n HIS 188 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 1iqa n ASP 189 N -0.21 1.09 -3.56 4.39 5.75 -1.25 -3.09 116.55 119.67 1iqa n ASP 189 Ca 0.00 -2.31 -0.11 0.00 -0.01 0.00 0.00 54.79 52.36 1iqa n ASP 189 Cb 0.34 -0.33 -0.05 0.00 -1.03 0.00 0.00 41.12 40.05 1iqa n ASP 189 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1iqa s ARG 190 N -0.53 0.67 7.12 0.11 1.70 -1.21 -5.03 118.95 121.78 1iqa s ARG 190 Ca 0.34 0.11 0.00 0.00 -0.47 0.00 0.00 55.73 55.71 1iqa s ARG 190 Cb 0.38 0.32 0.00 0.00 -0.57 0.00 0.00 34.95 35.07 1iqa s ARG 190 CO -0.15 -0.22 0.00 0.41 -1.08 0.00 0.00 175.30 174.26 1iqa n GLY 191 N 0.65 3.40 0.09 3.88 0.00 -1.26 -1.46 105.19 110.49 1iqa n GLY 191 Ca -0.11 -0.17 0.14 0.00 0.00 0.00 0.00 46.02 45.88 1iqa n GLY 191 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1iqa n TRP 192 N 14.00 0.00 -2.11 1.61 5.03 -1.26 -4.83 117.44 129.88 1iqa n TRP 192 Ca 0.00 0.00 -0.42 0.00 3.03 0.00 0.00 57.50 60.11 1iqa n TRP 192 Cb 0.00 -0.23 -0.03 0.00 -1.03 0.00 0.00 31.31 30.02 1iqa n TRP 192 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 1iqa s ALA 193 N -2.61 3.61 0.17 6.99 0.00 -0.53 -4.82 121.76 124.55 1iqa s ALA 193 Ca 0.24 1.20 -0.20 0.00 0.00 0.00 0.00 51.96 53.21 1iqa s ALA 193 Cb 0.19 -3.54 0.05 0.00 0.00 0.00 0.00 23.12 19.82 1iqa s ALA 193 CO 0.51 -0.65 0.54 -1.59 0.00 0.00 0.00 175.76 174.58 1iqa s LYS 194 N 0.37 1.28 -0.27 0.00 -2.85 -0.29 -3.30 119.74 114.68 1iqa s LYS 194 Ca 0.62 -0.67 -0.24 0.00 -1.00 0.00 0.00 55.97 54.68 1iqa s LYS 194 Cb -0.39 0.54 0.07 0.00 -2.06 0.00 0.00 37.83 36.00 1iqa s LYS 194 CO 0.36 -0.55 0.73 -1.50 0.10 0.00 0.00 175.35 174.49 1iqa s ILE 195 N -3.81 0.00 -0.05 3.79 2.07 -1.25 -0.66 121.20 121.29 1iqa s ILE 195 Ca 0.04 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.26 1iqa s ILE 195 Cb -0.01 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.62 1iqa s ILE 195 CO -0.09 0.00 0.10 -0.55 -1.91 0.00 0.00 174.94 172.49 1iqa s SER 196 N 0.57 0.48 -0.72 4.50 0.15 0.69 -4.97 113.70 114.39 1iqa s SER 196 Ca -0.01 0.20 -0.07 0.00 0.70 0.00 0.00 55.95 56.76 1iqa s SER 196 Cb -0.05 0.07 0.01 0.00 -1.71 0.00 0.00 66.02 64.34 1iqa s SER 196 CO -0.02 -0.20 0.64 -3.20 1.20 0.00 0.00 173.24 171.66 1iqa n ASN 197 N 4.78 -6.00 -3.67 5.45 4.05 -1.26 -1.46 115.26 117.15 1iqa n ASN 197 Ca -0.15 -0.49 -0.10 0.00 0.45 0.00 0.00 54.58 54.30 1iqa n ASN 197 Cb 0.50 -2.96 -0.09 0.00 1.23 0.00 0.00 39.78 38.46 1iqa n ASN 197 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1iqa s THR 199 N -2.75 -0.01 -0.21 -0.44 2.01 -0.79 -4.21 115.64 109.24 1iqa s THR 199 Ca 0.07 0.05 -0.16 0.00 0.31 0.00 0.00 61.69 61.96 1iqa s THR 199 Cb -0.01 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.68 1iqa s THR 199 CO 0.84 0.02 0.41 -0.22 -0.69 0.00 0.00 174.62 174.99 1iqa s LEU 200 N 1.35 4.14 -0.29 4.42 2.96 -1.26 -0.51 118.68 129.49 1iqa s LEU 200 Ca -0.09 0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 54.33 1iqa s LEU 200 Cb -0.07 -2.53 0.09 0.00 0.50 0.00 0.00 46.19 44.18 1iqa s LEU 200 CO -0.14 -0.11 0.08 -0.44 -1.32 0.00 0.00 176.35 174.42 1iqa s SER 201 N 1.14 3.91 -0.64 3.68 0.01 -0.35 -4.91 113.70 116.54 1iqa s SER 201 Ca 0.19 -1.53 -0.00 0.00 1.31 0.00 0.00 55.95 55.92 1iqa s SER 201 Cb -0.15 -0.88 0.00 0.00 0.21 0.00 0.00 66.02 65.20 1iqa s SER 201 CO 0.08 -0.39 0.46 -0.46 0.41 0.00 0.00 173.24 173.35 1iqa n ASN 202 N 4.84 -3.66 0.00 2.44 6.94 -1.26 -1.51 115.26 123.05 1iqa n ASN 202 Ca -0.03 -0.76 0.00 0.00 -0.02 0.00 0.00 54.58 53.77 1iqa n ASN 202 Cb 0.43 -1.22 0.00 0.00 -2.36 0.00 0.00 39.78 36.63 1iqa n ASN 202 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1iqa n GLY 203 N -1.39 2.73 3.65 4.83 0.00 -0.97 -4.75 105.19 109.29 1iqa n GLY 203 Ca -0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 1iqa n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iqa s LYS 204 N -0.40 3.24 -0.53 1.61 1.02 -0.57 -4.51 119.74 119.60 1iqa s LYS 204 Ca 0.00 -0.41 -0.18 0.00 0.02 0.00 0.00 55.97 55.41 1iqa s LYS 204 Cb 0.00 -2.88 0.09 0.00 -0.52 0.00 0.00 37.83 34.52 1iqa s LYS 204 CO 0.00 0.57 0.57 -1.17 -0.92 0.00 0.00 175.35 174.41 1iqa s LEU 205 N -0.52 5.49 0.01 3.17 2.96 0.66 -1.21 118.68 129.22 1iqa s LEU 205 Ca 0.09 -1.34 -0.28 0.00 -0.22 0.00 0.00 54.13 52.38 1iqa s LEU 205 Cb -0.12 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 1iqa s LEU 205 CO 0.02 -0.90 0.90 -0.60 -1.32 0.00 0.00 176.35 174.45 1iqa s ARG 206 N 2.22 4.55 0.08 1.98 3.52 0.34 -0.51 118.95 131.12 1iqa s ARG 206 Ca 0.09 1.28 -0.29 0.00 -0.13 0.00 0.00 55.73 56.68 1iqa s ARG 206 Cb -0.24 -3.43 -0.05 0.00 -1.56 0.00 0.00 34.95 29.66 1iqa s ARG 206 CO 0.07 0.05 0.92 0.08 -0.81 0.00 0.00 175.30 175.61 1iqa s VAL 207 N 0.70 4.62 -0.05 7.11 1.01 -0.07 -1.88 120.40 131.83 1iqa s VAL 207 Ca 0.47 1.97 0.07 0.00 0.00 0.00 0.00 61.98 64.49 1iqa s VAL 207 Cb -0.21 -4.27 -0.11 0.00 0.00 0.00 0.00 36.38 31.79 1iqa s VAL 207 CO 0.26 0.30 0.18 0.59 0.00 0.00 0.00 175.10 176.43 1iqa n ASN 208 N 2.99 2.90 -3.98 3.32 3.02 -1.26 -0.55 115.26 121.71 1iqa n ASN 208 Ca 0.02 -0.09 -0.23 0.00 -0.03 0.00 0.00 54.58 54.25 1iqa n ASN 208 Cb 0.50 1.29 -0.16 0.00 -0.61 0.00 0.00 39.78 40.79 1iqa n ASN 208 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1iqa s GLN 209 N -2.40 1.43 0.47 3.52 0.74 -1.26 -4.66 119.66 117.49 1iqa s GLN 209 Ca -0.02 -0.31 -0.24 0.00 0.05 0.00 0.00 55.36 54.84 1iqa s GLN 209 Cb 0.05 -1.23 -0.08 0.00 1.10 0.00 0.00 33.01 32.85 1iqa s GLN 209 CO 0.31 -0.01 1.27 -0.25 -0.55 0.00 0.00 175.29 176.06 1iqa n ASP 210 N 3.91 2.47 0.00 6.67 9.92 -1.26 -4.52 116.55 133.74 1iqa n ASP 210 Ca -0.23 1.05 0.00 0.00 -0.53 0.00 0.00 54.79 55.08 1iqa n ASP 210 Cb 0.51 -1.52 0.00 0.00 -0.64 0.00 0.00 41.12 39.48 1iqa n ASP 210 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1iqa n GLY 211 N 0.83 -0.79 3.46 0.44 0.00 -0.26 -4.57 105.19 104.30 1iqa n GLY 211 Ca 0.08 -1.03 -0.37 0.00 0.00 0.00 0.00 46.02 44.69 1iqa n GLY 211 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iqa s PHE 212 N -2.00 3.14 0.10 1.61 0.40 0.13 -0.31 117.98 121.05 1iqa s PHE 212 Ca 0.00 -0.42 0.09 0.00 -0.60 0.00 0.00 56.93 56.00 1iqa s PHE 212 Cb 0.00 -2.30 -0.04 0.00 0.51 0.00 0.00 43.02 41.20 1iqa s PHE 212 CO 0.00 -0.37 -0.20 0.71 0.70 0.00 0.00 175.22 176.06 1iqa s TYR 213 N 1.63 2.49 -0.17 0.36 1.51 0.32 0.76 117.35 124.25 1iqa s TYR 213 Ca 0.06 -0.29 -0.17 0.00 -1.01 0.00 0.00 57.07 55.66 1iqa s TYR 213 Cb -0.16 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.30 1iqa s TYR 213 CO 0.05 0.35 0.43 -0.47 -1.11 0.00 0.00 175.55 174.80 1iqa s TYR 214 N -1.08 3.42 0.09 2.71 5.04 -0.41 -0.56 117.35 126.57 1iqa s TYR 214 Ca 0.16 0.72 0.06 0.00 -2.44 0.00 0.00 57.07 55.58 1iqa s TYR 214 Cb -0.10 -2.54 -0.04 0.00 0.35 0.00 0.00 41.96 39.63 1iqa s TYR 214 CO 0.08 0.06 -0.09 -0.51 -1.34 0.00 0.00 175.55 173.75 1iqa s LEU 215 N 1.06 3.08 0.10 6.97 1.43 0.61 -1.78 118.68 130.16 1iqa s LEU 215 Ca 0.22 -0.34 -0.25 0.00 -1.03 0.00 0.00 54.13 52.73 1iqa s LEU 215 Cb -0.15 -1.86 0.07 0.00 0.03 0.00 0.00 46.19 44.28 1iqa s LEU 215 CO 0.08 0.19 0.61 -0.72 0.23 0.00 0.00 176.35 176.75 1iqa s TYR 216 N -1.18 -0.55 0.00 0.29 -0.85 -0.66 -1.54 117.35 112.85 1iqa s TYR 216 Ca 0.21 0.53 -0.16 0.00 -0.52 0.00 0.00 57.07 57.12 1iqa s TYR 216 Cb -0.11 0.50 0.03 0.00 0.38 0.00 0.00 41.96 42.76 1iqa s TYR 216 CO 0.13 -0.77 0.35 0.00 -1.52 0.00 0.00 175.55 173.74 1iqa s ALA 217 N -3.02 -0.88 -0.04 9.51 0.00 -0.39 -0.84 121.76 126.09 1iqa s ALA 217 Ca -0.02 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.28 1iqa s ALA 217 Cb -0.01 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.29 1iqa s ALA 217 CO -0.06 -0.33 -0.02 1.21 0.00 0.00 0.00 175.76 176.56 1iqa s ASN 218 N -1.56 0.82 -0.05 0.00 2.47 0.53 -1.62 114.94 115.53 1iqa s ASN 218 Ca -0.11 -0.07 0.04 0.00 0.42 0.00 0.00 52.86 53.14 1iqa s ASN 218 Cb -0.03 -0.34 0.00 0.00 -1.45 0.00 0.00 41.25 39.43 1iqa s ASN 218 CO 0.02 -0.10 -0.15 -0.63 -3.72 0.00 0.00 177.10 172.52 1iqa s ILE 219 N 1.14 1.30 -0.05 -5.21 -1.09 0.10 -0.80 121.20 116.60 1iqa s ILE 219 Ca -0.08 -0.63 0.06 0.00 -2.23 0.00 0.00 60.65 57.77 1iqa s ILE 219 Cb -0.14 -1.14 -0.01 0.00 -1.58 0.00 0.00 42.46 39.60 1iqa s ILE 219 CO -0.01 0.38 -0.22 0.00 -1.23 0.00 0.00 174.94 173.86 1iqa s PHE 221 N -0.13 2.37 0.16 0.00 0.40 0.48 -0.26 117.98 121.01 1iqa s PHE 221 Ca -0.02 -0.36 -0.22 0.00 -0.60 0.00 0.00 56.93 55.72 1iqa s PHE 221 Cb -0.12 -1.32 0.06 0.00 0.51 0.00 0.00 43.02 42.15 1iqa s PHE 221 CO 0.03 0.29 0.58 -0.98 0.70 0.00 0.00 175.22 175.84 1iqa s ARG 222 N -1.83 1.28 -0.12 0.44 3.03 0.89 -1.14 118.95 121.50 1iqa s ARG 222 Ca 0.14 -0.52 -0.08 0.00 2.03 0.00 0.00 55.73 57.30 1iqa s ARG 222 Cb -0.10 0.58 0.04 0.00 -1.03 0.00 0.00 34.95 34.44 1iqa s ARG 222 CO 0.06 -0.56 0.29 -1.58 -1.13 0.00 0.00 175.30 172.38 1iqa s HIS 223 N -3.76 -0.37 -0.15 5.89 2.46 -0.12 -4.69 115.29 114.55 1iqa s HIS 223 Ca 0.02 0.86 -0.02 0.00 0.47 0.00 0.00 55.06 56.39 1iqa s HIS 223 Cb -0.01 0.11 -0.02 0.00 -0.13 0.00 0.00 32.58 32.54 1iqa s HIS 223 CO -0.12 -0.21 -0.09 -1.01 -2.47 0.00 0.00 174.74 170.84 1iqa s HIS 224 N 0.71 2.90 0.59 3.88 3.76 -1.26 -1.32 115.29 124.54 1iqa s HIS 224 Ca -0.05 -0.57 0.29 0.00 -0.15 0.00 0.00 55.06 54.58 1iqa s HIS 224 Cb -0.06 -1.91 1.72 0.00 1.11 0.00 0.00 32.58 33.43 1iqa s HIS 224 CO -0.05 -0.20 2.18 0.93 -0.85 0.00 0.00 174.74 176.75 1iqa h GLU 225 N 6.89 0.00 0.00 1.40 4.39 -1.53 0.68 114.58 126.41 1iqa h GLU 225 Ca -0.30 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.40 1iqa h GLU 225 Cb 1.20 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.85 1iqa h GLU 225 CO 0.59 0.00 -0.02 1.79 -1.16 0.00 0.00 179.01 180.21 1iqa h THR 226 N 0.00 0.06 -0.00 1.13 1.35 -1.94 -0.72 112.91 112.79 1iqa h THR 226 Ca 0.04 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1iqa h THR 226 Cb 0.24 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 1iqa h THR 226 CO -0.00 0.02 -0.06 -1.20 -0.25 0.00 0.00 175.52 174.02 1iqa n SER 227 N -3.14 0.08 0.00 5.36 7.64 0.24 -5.04 113.62 118.77 1iqa n SER 227 Ca -0.01 0.28 0.00 0.00 1.01 0.00 0.00 58.87 60.15 1iqa n SER 227 Cb 0.24 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 1iqa n SER 227 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1iqa n GLY 228 N 1.46 0.33 3.57 0.23 0.00 -0.28 -5.03 105.19 105.47 1iqa n GLY 228 Ca 0.08 -2.13 -0.26 0.00 0.00 0.00 0.00 46.02 43.71 1iqa n GLY 228 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iqa s SER 229 N -4.00 3.71 0.39 1.61 0.15 -1.26 -4.40 113.70 109.90 1iqa s SER 229 Ca 0.00 -1.27 -0.23 0.00 0.70 0.00 0.00 55.95 55.15 1iqa s SER 229 Cb 0.00 -0.35 -0.10 0.00 -1.71 0.00 0.00 66.02 63.85 1iqa s SER 229 CO 0.00 -0.31 0.95 0.68 1.20 0.00 0.00 173.24 175.76 1iqa s VAL 230 N -2.68 4.28 0.63 4.45 -7.23 -1.26 -4.96 120.40 113.63 1iqa s VAL 230 Ca 0.33 1.59 0.33 0.00 -1.81 0.00 0.00 61.98 62.42 1iqa s VAL 230 Cb 0.06 -3.74 0.37 0.00 0.56 0.00 0.00 36.38 33.62 1iqa s VAL 230 CO 0.17 -0.15 2.12 1.55 -0.31 0.00 0.00 175.10 178.48 1iqa h PRO 231 N 2.35 0.00 -2.80 4.82 0.13 -2.00 -3.43 132.00 131.07 1iqa h PRO 231 Ca -0.48 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 1iqa h PRO 231 Cb 1.19 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.15 1iqa h PRO 231 CO 0.62 0.00 0.02 0.99 -0.23 0.00 0.00 178.00 179.40 1iqa s THR 232 N -4.40 0.03 0.19 1.56 2.01 -1.26 -5.04 115.64 108.74 1iqa s THR 232 Ca -0.04 -0.27 0.00 0.00 0.31 0.00 0.00 61.69 61.69 1iqa s THR 232 Cb 0.13 -0.97 -0.09 0.00 0.01 0.00 0.00 72.50 71.58 1iqa s THR 232 CO 0.45 -0.15 1.46 0.44 -0.69 0.00 0.00 174.62 176.13 1iqa h ASP 233 N 2.83 0.42 -3.64 3.53 3.45 -1.94 -3.39 116.42 117.68 1iqa h ASP 233 Ca -0.31 -0.27 -0.70 0.00 0.43 0.00 0.00 57.03 56.19 1iqa h ASP 233 Cb 1.21 -0.12 -0.30 0.00 -0.56 0.00 0.00 39.33 39.56 1iqa h ASP 233 CO 0.41 0.99 -0.60 -0.47 -1.57 0.00 0.00 179.24 178.01 1iqa s TYR 234 N -3.63 3.30 0.06 4.55 5.04 -1.26 -1.99 117.35 123.42 1iqa s TYR 234 Ca -0.05 -1.62 -0.08 0.00 -2.44 0.00 0.00 57.07 52.88 1iqa s TYR 234 Cb 0.11 -2.44 -0.05 0.00 0.35 0.00 0.00 41.96 39.92 1iqa s TYR 234 CO 0.83 -0.78 0.35 -0.51 -1.34 0.00 0.00 175.55 174.10 1iqa s LEU 235 N 1.35 4.35 -0.36 6.97 1.43 -0.19 -4.87 118.68 127.36 1iqa s LEU 235 Ca -0.01 0.70 -0.12 0.00 -1.03 0.00 0.00 54.13 53.67 1iqa s LEU 235 Cb -0.20 -2.91 0.00 0.00 0.03 0.00 0.00 46.19 43.11 1iqa s LEU 235 CO 0.01 0.19 0.23 -1.10 0.23 0.00 0.00 176.35 175.91 1iqa s GLN 236 N -1.92 3.24 -0.14 1.70 -0.21 -1.26 -0.41 119.66 120.65 1iqa s GLN 236 Ca 0.32 -0.81 -0.02 0.00 0.02 0.00 0.00 55.36 54.86 1iqa s GLN 236 Cb -0.14 -3.79 -0.02 0.00 1.00 0.00 0.00 33.01 30.06 1iqa s GLN 236 CO 0.18 -0.55 -0.07 -0.51 -2.12 0.00 0.00 175.29 172.22 1iqa s LEU 237 N 1.67 3.05 -0.25 2.90 1.43 0.31 -4.55 118.68 123.24 1iqa s LEU 237 Ca 0.05 -0.19 -0.27 0.00 -1.03 0.00 0.00 54.13 52.69 1iqa s LEU 237 Cb -0.18 -1.71 0.14 0.00 0.03 0.00 0.00 46.19 44.46 1iqa s LEU 237 CO 0.09 0.18 1.10 0.54 0.23 0.00 0.00 176.35 178.49 1iqa s VAL 239 N 0.26 0.00 -0.06 -1.59 0.11 -0.47 -0.42 120.40 118.24 1iqa s VAL 239 Ca -0.05 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.01 1iqa s VAL 239 Cb -0.15 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.72 1iqa s VAL 239 CO 0.04 0.00 -0.09 -0.31 -3.33 0.00 0.00 175.10 171.41 1iqa s TYR 240 N -0.24 1.20 -0.31 1.54 1.51 0.57 -1.83 117.35 119.78 1iqa s TYR 240 Ca 0.03 -0.42 -0.13 0.00 -1.01 0.00 0.00 57.07 55.54 1iqa s TYR 240 Cb -0.04 -0.93 -0.03 0.00 -0.11 0.00 0.00 41.96 40.86 1iqa s TYR 240 CO -0.06 -0.26 0.25 0.08 -1.11 0.00 0.00 175.55 174.46 1iqa s VAL 241 N 0.81 5.27 0.05 0.71 1.01 -1.26 -1.35 120.40 125.63 1iqa s VAL 241 Ca -0.12 0.03 0.06 0.00 0.00 0.00 0.00 61.98 61.95 1iqa s VAL 241 Cb -0.15 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1iqa s VAL 241 CO 0.02 0.09 -0.15 -0.69 0.00 0.00 0.00 175.10 174.37 1iqa s VAL 242 N 1.81 3.05 -0.13 2.92 1.01 -0.38 -0.18 120.40 128.49 1iqa s VAL 242 Ca 0.08 -1.13 0.02 0.00 0.00 0.00 0.00 61.98 60.95 1iqa s VAL 242 Cb -0.17 -2.32 -0.00 0.00 0.00 0.00 0.00 36.38 33.89 1iqa s VAL 242 CO 0.11 0.30 -0.19 -0.75 0.00 0.00 0.00 175.10 174.58 1iqa s LYS 243 N -1.58 3.16 0.34 2.72 2.20 0.23 -0.96 119.74 125.86 1iqa s LYS 243 Ca 0.16 -0.80 0.03 0.00 -0.36 0.00 0.00 55.97 55.01 1iqa s LYS 243 Cb -0.11 -2.50 -0.01 0.00 -1.51 0.00 0.00 37.83 33.70 1iqa s LYS 243 CO 0.07 0.09 0.12 0.25 -0.36 0.00 0.00 175.35 175.52 1iqa n THR 244 N 3.83 0.00 -3.80 3.43 -2.24 0.08 -0.74 114.28 114.84 1iqa n THR 244 Ca -0.19 -1.99 -0.13 0.00 -2.27 0.00 0.00 64.05 59.47 1iqa n THR 244 Cb 0.52 0.71 -0.12 0.00 -2.10 0.00 0.00 70.33 69.34 1iqa n THR 244 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1iqa s SER 245 N -3.10 -0.21 0.60 3.42 0.15 -1.26 -0.41 113.70 112.89 1iqa s SER 245 Ca 0.17 0.41 0.28 0.00 0.70 0.00 0.00 55.95 57.51 1iqa s SER 245 Cb 0.01 0.41 1.38 0.00 -1.71 0.00 0.00 66.02 66.11 1iqa s SER 245 CO 0.12 -0.07 1.78 -0.29 1.20 0.00 0.00 173.24 175.98 1iqa h ILE 246 N 4.85 0.27 0.00 6.45 2.10 -1.69 -3.25 117.51 126.24 1iqa h ILE 246 Ca -0.26 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.68 1iqa h ILE 246 Cb 1.19 0.50 0.00 0.00 -1.09 0.00 0.00 36.82 37.43 1iqa h ILE 246 CO 0.38 0.00 -0.30 0.29 -1.08 0.00 0.00 178.15 177.44 1iqa n LYS 247 N -3.56 0.18 -2.90 2.19 4.76 -1.26 -5.02 118.16 112.54 1iqa n LYS 247 Ca 0.10 0.18 -0.25 0.00 -2.87 0.00 0.00 58.31 55.47 1iqa n LYS 247 Cb 0.81 -0.93 0.00 0.00 -1.84 0.00 0.00 35.03 33.07 1iqa n LYS 247 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1iqa s ILE 248 N -1.61 4.63 -0.50 -0.18 -4.36 -1.23 -5.00 121.20 112.95 1iqa s ILE 248 Ca -0.09 -0.17 0.07 0.00 -0.26 0.00 0.00 60.65 60.20 1iqa s ILE 248 Cb 0.01 -3.73 0.47 0.00 1.25 0.00 0.00 42.46 40.46 1iqa s ILE 248 CO 0.13 -0.61 1.30 -0.81 0.24 0.00 0.00 174.94 175.19 1iqa n PRO 249 N -2.12 3.05 -0.21 0.37 -0.04 -1.26 -4.02 135.00 130.77 1iqa n PRO 249 Ca -0.00 -1.86 -0.13 0.00 -0.04 0.00 0.00 63.50 61.46 1iqa n PRO 249 Cb 0.56 -1.91 0.13 0.00 -0.04 0.00 0.00 33.50 32.24 1iqa n PRO 249 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1iqa n SER 250 N 0.22 -2.75 -3.15 3.54 3.41 -1.26 -4.99 113.62 108.63 1iqa n SER 250 Ca 0.20 -0.38 0.05 0.00 -0.26 0.00 0.00 58.87 58.48 1iqa n SER 250 Cb 0.88 -0.51 -0.01 0.00 -0.26 0.00 0.00 64.21 64.31 1iqa n SER 250 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1iqa s SER 251 N -2.21 -0.40 -0.04 4.04 0.15 -1.26 -4.66 113.70 109.32 1iqa s SER 251 Ca 0.29 0.20 0.06 0.00 0.70 0.00 0.00 55.95 57.20 1iqa s SER 251 Cb -0.05 1.31 -0.01 0.00 -1.71 0.00 0.00 66.02 65.56 1iqa s SER 251 CO 0.25 -0.07 -0.21 -1.00 1.20 0.00 0.00 173.24 173.41 1iqa s HIS 252 N 2.96 1.98 -0.17 3.44 3.76 0.08 -4.96 115.29 122.37 1iqa s HIS 252 Ca 0.03 -0.51 -0.22 0.00 -0.15 0.00 0.00 55.06 54.21 1iqa s HIS 252 Cb -0.08 -1.30 -0.02 0.00 1.11 0.00 0.00 32.58 32.28 1iqa s HIS 252 CO -0.13 -0.14 0.67 -0.80 -0.85 0.00 0.00 174.74 173.50 1iqa s ASN 253 N -0.19 6.78 -0.02 1.40 -0.87 -1.26 0.77 114.94 121.54 1iqa s ASN 253 Ca 0.00 0.94 0.21 0.00 -1.57 0.00 0.00 52.86 52.44 1iqa s ASN 253 Cb -0.11 -2.37 -0.28 0.00 -0.02 0.00 0.00 41.25 38.47 1iqa s ASN 253 CO 0.02 -0.27 0.65 0.18 -2.57 0.00 0.00 177.10 175.11 1iqa n LEU 254 N 4.89 0.45 -3.61 0.60 4.77 0.75 -4.95 117.00 119.90 1iqa n LEU 254 Ca -0.00 -0.23 -0.07 0.00 -0.03 0.00 0.00 56.01 55.68 1iqa n LEU 254 Cb 0.50 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.54 1iqa n LEU 254 CO 0.45 0.11 0.95 -0.75 -1.33 0.00 0.00 177.39 176.82 1iqa s LYS 256 N -3.21 0.35 0.22 3.23 2.20 -1.26 -5.00 119.74 116.26 1iqa s LYS 256 Ca -0.00 0.12 -0.19 0.00 -0.36 0.00 0.00 55.97 55.53 1iqa s LYS 256 Cb 0.14 0.16 0.03 0.00 -1.51 0.00 0.00 37.83 36.66 1iqa s LYS 256 CO 0.86 -0.10 0.60 0.20 -0.36 0.00 0.00 175.35 176.54 1iqa s GLY 257 N -0.91 -0.15 0.00 5.54 0.00 -0.76 -5.00 107.32 106.04 1iqa s GLY 257 Ca 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.59 1iqa s GLY 257 CO -0.04 -0.15 0.00 0.61 0.00 0.00 0.00 173.10 173.52 1iqa n GLY 258 N -0.39 -0.14 3.52 0.20 0.00 -1.26 -1.36 105.19 105.75 1iqa n GLY 258 Ca -0.09 -1.64 -0.14 0.00 0.00 0.00 0.00 46.02 44.15 1iqa n GLY 258 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iqa s SER 259 N -3.15 -0.53 0.01 1.61 0.15 0.45 -4.99 113.70 107.24 1iqa s SER 259 Ca 0.00 0.45 -0.16 0.00 0.70 0.00 0.00 55.95 56.94 1iqa s SER 259 Cb 0.00 0.46 -0.06 0.00 -1.71 0.00 0.00 66.02 64.72 1iqa s SER 259 CO 0.00 -0.59 0.44 0.42 1.20 0.00 0.00 173.24 174.71 1iqa s THR 260 N -1.75 4.98 -0.07 6.45 -4.23 -1.26 -0.53 115.64 119.23 1iqa s THR 260 Ca -0.05 0.91 -0.06 0.00 -1.18 0.00 0.00 61.69 61.32 1iqa s THR 260 Cb -0.00 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 70.11 1iqa s THR 260 CO 0.02 0.57 0.18 -0.54 -0.54 0.00 0.00 174.62 174.31 1iqa s LYS 261 N -1.04 0.19 -0.27 3.99 -0.14 0.45 -4.94 119.74 117.99 1iqa s LYS 261 Ca 0.25 0.30 -0.19 0.00 -1.36 0.00 0.00 55.97 54.97 1iqa s LYS 261 Cb -0.17 0.03 -0.02 0.00 -1.68 0.00 0.00 37.83 35.99 1iqa s LYS 261 CO 0.14 -0.06 0.55 1.21 -0.76 0.00 0.00 175.35 176.43 1iqa s ASN 262 N 0.39 6.46 -0.20 2.83 3.84 -1.26 -1.02 114.94 125.99 1iqa s ASN 262 Ca -0.02 0.52 0.12 0.00 0.21 0.00 0.00 52.86 53.68 1iqa s ASN 262 Cb -0.04 -2.30 0.42 0.00 -0.55 0.00 0.00 41.25 38.79 1iqa s ASN 262 CO -0.02 -0.34 1.22 0.79 -2.79 0.00 0.00 177.10 175.96 1iqa n TRP 263 N 5.63 0.07 -1.46 0.43 7.02 -0.84 -5.03 117.44 123.25 1iqa n TRP 263 Ca -0.03 -1.44 -0.59 0.00 -1.02 0.00 0.00 57.50 54.42 1iqa n TRP 263 Cb 0.49 -0.24 -0.10 0.00 -2.42 0.00 0.00 31.31 29.04 1iqa n TRP 263 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 1iqa n SER 264 N -0.99 1.46 -2.53 -0.99 7.64 -1.25 -4.64 113.62 112.32 1iqa n SER 264 Ca 0.19 0.77 -0.24 0.00 1.01 0.00 0.00 58.87 60.59 1iqa n SER 264 Cb 0.73 -1.03 -0.08 0.00 -1.01 0.00 0.00 64.21 62.82 1iqa n SER 264 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1iqa n GLY 265 N 6.10 -0.26 0.00 0.23 0.00 -1.26 -4.56 105.19 105.44 1iqa n GLY 265 Ca 0.43 0.65 0.00 0.00 0.00 0.00 0.00 46.02 47.10 1iqa n GLY 265 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1iqa n ASN 266 N 5.77 0.00 -4.61 1.61 2.04 -1.26 -5.11 115.26 113.70 1iqa n ASN 266 Ca 0.37 0.00 -0.41 0.00 -0.44 0.00 0.00 54.58 54.10 1iqa n ASN 266 Cb 0.01 0.00 0.02 0.00 -2.53 0.00 0.00 39.78 37.28 1iqa n ASN 266 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 1iqa n SER 267 N -0.21 1.23 0.10 0.53 2.88 -1.26 -4.88 113.62 112.00 1iqa n SER 267 Ca 0.00 1.00 0.13 0.00 -1.33 0.00 0.00 58.87 58.67 1iqa n SER 267 Cb 0.00 -1.36 0.43 0.00 -0.75 0.00 0.00 64.21 62.53 1iqa n SER 267 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1iqa n GLU 268 N -0.01 0.23 -4.16 -1.46 0.28 -1.26 -4.80 120.64 109.47 1iqa n GLU 268 Ca 0.10 0.24 -0.18 0.00 -0.16 0.00 0.00 57.16 57.16 1iqa n GLU 268 Cb 0.40 -1.80 -0.16 0.00 1.43 0.00 0.00 31.44 31.32 1iqa n GLU 268 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1iqa s PHE 269 N -3.13 0.60 0.02 -1.84 5.36 -1.26 -1.69 117.98 116.04 1iqa s PHE 269 Ca 0.10 -0.13 0.06 0.00 -0.96 0.00 0.00 56.93 56.00 1iqa s PHE 269 Cb 0.12 -0.50 -0.02 0.00 -0.34 0.00 0.00 43.02 42.28 1iqa s PHE 269 CO 0.56 -0.10 -0.18 -1.01 -1.46 0.00 0.00 175.22 173.02 1iqa s HIS 270 N 0.48 1.61 -0.07 10.12 3.76 -0.44 -5.00 115.29 125.75 1iqa s HIS 270 Ca -0.06 -0.34 -0.17 0.00 -0.15 0.00 0.00 55.06 54.34 1iqa s HIS 270 Cb -0.09 -0.98 0.04 0.00 1.11 0.00 0.00 32.58 32.65 1iqa s HIS 270 CO -0.00 0.04 0.40 0.12 -0.85 0.00 0.00 174.74 174.44 1iqa s PHE 271 N -0.68 -0.34 -0.27 1.40 5.36 -1.26 -0.94 117.98 121.24 1iqa s PHE 271 Ca 0.06 0.67 -0.23 0.00 -0.96 0.00 0.00 56.93 56.48 1iqa s PHE 271 Cb -0.08 0.16 0.08 0.00 -0.34 0.00 0.00 43.02 42.84 1iqa s PHE 271 CO 0.01 -0.36 0.73 -0.47 -1.46 0.00 0.00 175.22 173.66 1iqa s TYR 272 N -0.78 -0.85 0.13 10.12 5.04 -0.29 -4.99 117.35 125.73 1iqa s TYR 272 Ca -0.09 1.95 0.09 0.00 -2.44 0.00 0.00 57.07 56.58 1iqa s TYR 272 Cb -0.04 0.37 -0.04 0.00 0.35 0.00 0.00 41.96 42.60 1iqa s TYR 272 CO 0.04 -0.41 -0.20 -1.54 -1.34 0.00 0.00 175.55 172.09 1iqa s SER 273 N 0.71 2.66 0.05 4.32 1.04 -1.26 -0.39 113.70 120.84 1iqa s SER 273 Ca -0.03 -0.76 0.05 0.00 0.48 0.00 0.00 55.95 55.69 1iqa s SER 273 Cb -0.05 -0.15 -0.02 0.00 0.10 0.00 0.00 66.02 65.89 1iqa s SER 273 CO -0.05 0.03 -0.13 -0.63 0.98 0.00 0.00 173.24 173.44 1iqa s ILE 274 N -1.48 1.03 0.00 -1.02 1.01 0.88 -4.97 121.20 116.65 1iqa s ILE 274 Ca 0.11 -1.13 -0.01 0.00 0.00 0.00 0.00 60.65 59.62 1iqa s ILE 274 Cb -0.08 -0.97 -0.01 0.00 0.01 0.00 0.00 42.46 41.41 1iqa s ILE 274 CO 0.05 -0.14 0.02 0.21 0.00 0.00 0.00 174.94 175.08 1iqa s ASN 275 N -1.43 0.08 -0.00 3.58 3.84 -1.26 0.03 114.94 119.77 1iqa s ASN 275 Ca -0.01 -0.17 -0.06 0.00 0.21 0.00 0.00 52.86 52.83 1iqa s ASN 275 Cb -0.09 0.09 -0.00 0.00 -0.55 0.00 0.00 41.25 40.70 1iqa s ASN 275 CO 0.02 -0.15 0.11 0.68 -2.79 0.00 0.00 177.10 174.97 1iqa s VAL 276 N -0.65 0.08 -0.01 -5.21 -7.23 -0.64 -4.96 120.40 101.77 1iqa s VAL 276 Ca -0.07 -0.62 -0.23 0.00 -1.81 0.00 0.00 61.98 59.24 1iqa s VAL 276 Cb -0.05 -0.37 0.05 0.00 0.56 0.00 0.00 36.38 36.57 1iqa s VAL 276 CO -0.00 -0.34 0.51 -0.83 -0.31 0.00 0.00 175.10 174.12 1iqa s GLY 277 N -1.19 -0.39 -0.07 2.32 0.00 -1.26 -1.27 107.32 105.46 1iqa s GLY 277 Ca -0.13 0.76 -0.31 0.00 0.00 0.00 0.00 44.72 45.03 1iqa s GLY 277 CO 0.01 0.47 1.09 -0.32 0.00 0.00 0.00 173.10 174.35 1iqa s GLY 278 N -1.49 -0.36 -0.36 0.20 0.00 -0.59 -4.99 107.32 99.73 1iqa s GLY 278 Ca -0.10 1.15 -0.14 0.00 0.00 0.00 0.00 44.72 45.63 1iqa s GLY 278 CO 0.04 0.36 0.30 -0.12 0.00 0.00 0.00 173.10 173.69 1iqa s PHE 279 N -2.73 3.22 0.05 1.90 5.36 -1.26 -0.28 117.98 124.24 1iqa s PHE 279 Ca 0.09 -0.25 0.06 0.00 -0.96 0.00 0.00 56.93 55.87 1iqa s PHE 279 Cb -0.00 -2.58 -0.02 0.00 -0.34 0.00 0.00 43.02 40.07 1iqa s PHE 279 CO -0.05 -0.45 -0.17 -0.06 -1.46 0.00 0.00 175.22 173.03 1iqa s PHE 280 N 1.82 1.50 -0.14 10.12 0.40 0.28 -4.95 117.98 127.01 1iqa s PHE 280 Ca 0.08 -0.37 -0.24 0.00 -0.60 0.00 0.00 56.93 55.79 1iqa s PHE 280 Cb -0.17 -0.88 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 1iqa s PHE 280 CO 0.11 0.07 0.76 0.21 0.70 0.00 0.00 175.22 177.08 1iqa s LYS 281 N -1.26 4.34 0.04 0.44 2.20 -1.26 -0.52 119.74 123.71 1iqa s LYS 281 Ca 0.04 0.92 0.05 0.00 -0.36 0.00 0.00 55.97 56.63 1iqa s LYS 281 Cb -0.09 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 32.68 1iqa s LYS 281 CO 0.02 -0.18 -0.15 -0.51 -0.36 0.00 0.00 175.35 174.16 1iqa s LEU 282 N 1.65 2.17 0.06 5.43 1.43 0.58 -4.97 118.68 125.03 1iqa s LEU 282 Ca 0.37 -0.46 0.06 0.00 -1.03 0.00 0.00 54.13 53.06 1iqa s LEU 282 Cb -0.17 -0.68 -0.04 0.00 0.03 0.00 0.00 46.19 45.34 1iqa s LEU 282 CO 0.14 0.06 -0.10 -0.13 0.23 0.00 0.00 176.35 176.55 1iqa s ARG 283 N -1.12 2.25 0.16 1.70 3.00 -1.26 -1.10 118.95 122.59 1iqa s ARG 283 Ca 0.03 -0.92 -0.33 0.00 0.00 0.00 0.00 55.73 54.50 1iqa s ARG 283 Cb -0.08 -2.35 -0.15 0.00 0.00 0.00 0.00 34.95 32.37 1iqa s ARG 283 CO 0.01 0.54 1.26 0.00 0.00 0.00 0.00 175.30 177.11 1iqa n ALA 284 N 1.12 -0.44 0.00 2.13 0.00 -1.26 -0.60 120.51 121.47 1iqa n ALA 284 Ca -0.14 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1iqa n ALA 284 Cb 0.52 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1iqa n ALA 284 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iqa n GLY 285 N 2.21 2.73 3.80 0.00 0.00 0.29 -4.96 105.19 109.26 1iqa n GLY 285 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1iqa n GLY 285 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iqa s GLU 286 N -0.28 3.97 -0.00 1.61 2.02 0.23 -1.73 118.70 124.52 1iqa s GLU 286 Ca 0.00 1.32 0.05 0.00 0.02 0.00 0.00 54.97 56.36 1iqa s GLU 286 Cb 0.00 -2.19 -0.01 0.00 0.10 0.00 0.00 34.13 32.03 1iqa s GLU 286 CO 0.00 -0.28 -0.16 -1.21 0.02 0.00 0.00 175.26 173.63 1iqa s GLU 287 N -3.10 1.29 -0.17 1.61 2.02 0.45 -0.90 118.70 119.90 1iqa s GLU 287 Ca 0.64 -0.62 -0.06 0.00 0.02 0.00 0.00 54.97 54.96 1iqa s GLU 287 Cb -0.15 -1.26 -0.04 0.00 0.10 0.00 0.00 34.13 32.78 1iqa s GLU 287 CO 0.19 0.34 0.03 0.42 0.02 0.00 0.00 175.26 176.26 1iqa s ILE 288 N -0.44 4.45 0.18 -1.63 -1.09 0.33 -0.74 121.20 122.26 1iqa s ILE 288 Ca 0.06 -0.15 -0.00 0.00 -2.23 0.00 0.00 60.65 58.32 1iqa s ILE 288 Cb -0.07 -2.99 -0.04 0.00 -1.58 0.00 0.00 42.46 37.78 1iqa s ILE 288 CO -0.00 0.47 0.07 -0.94 -1.23 0.00 0.00 174.94 173.31 1iqa s SER 289 N 0.37 0.59 -0.15 3.58 1.04 -0.13 -0.25 113.70 118.75 1iqa s SER 289 Ca 0.00 -1.27 0.00 0.00 0.48 0.00 0.00 55.95 55.16 1iqa s SER 289 Cb -0.13 0.26 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 1iqa s SER 289 CO 0.01 -0.72 -0.15 -0.63 0.98 0.00 0.00 173.24 172.73 1iqa s ILE 290 N -3.95 2.75 -0.08 -1.02 -1.09 -1.26 -1.25 121.20 115.30 1iqa s ILE 290 Ca 0.30 -0.75 0.04 0.00 -2.23 0.00 0.00 60.65 58.01 1iqa s ILE 290 Cb 0.07 -2.16 -0.01 0.00 -1.58 0.00 0.00 42.46 38.78 1iqa s ILE 290 CO 0.07 0.52 -0.21 -1.10 -1.23 0.00 0.00 174.94 172.98 1iqa s GLN 291 N 0.67 2.80 0.06 2.79 -0.21 -0.46 -0.13 119.66 125.18 1iqa s GLN 291 Ca -0.08 -0.84 -0.00 0.00 0.02 0.00 0.00 55.36 54.47 1iqa s GLN 291 Cb -0.16 -2.30 -0.04 0.00 1.00 0.00 0.00 33.01 31.52 1iqa s GLN 291 CO 0.02 0.34 -0.04 0.14 -2.12 0.00 0.00 175.29 173.63 1iqa s VAL 292 N -0.04 0.33 0.55 1.09 -7.23 -0.25 -0.31 120.40 114.53 1iqa s VAL 292 Ca -0.06 -1.66 0.00 0.00 -1.81 0.00 0.00 61.98 58.45 1iqa s VAL 292 Cb -0.15 -1.31 0.03 0.00 0.56 0.00 0.00 36.38 35.52 1iqa s VAL 292 CO 0.05 -0.86 0.79 -0.94 -0.31 0.00 0.00 175.10 173.83 1iqa s SER 293 N -2.64 5.32 -1.48 4.85 1.04 -1.26 -1.72 113.70 117.80 1iqa s SER 293 Ca 0.04 0.11 -0.06 0.00 0.48 0.00 0.00 55.95 56.52 1iqa s SER 293 Cb 0.04 -1.03 0.01 0.00 0.10 0.00 0.00 66.02 65.13 1iqa s SER 293 CO -0.07 -1.12 0.14 0.59 0.98 0.00 0.00 173.24 173.76 1iqa n ASN 294 N -2.37 0.02 0.32 7.02 4.13 -1.01 -4.80 115.26 118.56 1iqa n ASN 294 Ca 0.07 -1.27 0.20 0.00 1.68 0.00 0.00 54.58 55.26 1iqa n ASN 294 Cb 0.59 -1.70 1.09 0.00 -1.54 0.00 0.00 39.78 38.23 1iqa n ASN 294 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1iqa h PRO 295 N -1.94 0.00 0.00 3.52 0.13 -1.78 -1.15 132.00 130.79 1iqa h PRO 295 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1iqa h PRO 295 Cb 1.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.53 1iqa h PRO 295 CO 0.67 0.01 0.00 -1.13 -0.23 0.00 0.00 178.00 177.32 1iqa n SER 296 N -3.31 0.00 -0.92 1.44 3.41 -1.24 -2.46 113.62 110.53 1iqa n SER 296 Ca -0.03 0.45 0.12 0.00 -0.26 0.00 0.00 58.87 59.16 1iqa n SER 296 Cb 0.09 -0.48 0.20 0.00 -0.26 0.00 0.00 64.21 63.77 1iqa n SER 296 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1iqa n LEU 297 N -1.48 2.84 -4.77 1.04 4.77 -0.43 -4.99 117.00 113.98 1iqa n LEU 297 Ca 0.05 -1.04 -0.41 0.00 -0.03 0.00 0.00 56.01 54.58 1iqa n LEU 297 Cb 0.22 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1iqa n LEU 297 CO 0.18 0.52 1.15 0.18 -1.33 0.00 0.00 177.39 178.09 1iqa n LEU 298 N 1.17 4.68 -4.66 2.23 4.77 -1.03 -0.08 117.00 124.08 1iqa n LEU 298 Ca 0.16 1.21 -0.42 0.00 -0.03 0.00 0.00 56.01 56.94 1iqa n LEU 298 Cb 0.55 -1.61 -0.04 0.00 -2.33 0.00 0.00 43.42 39.99 1iqa n LEU 298 CO 0.15 0.14 0.68 -0.62 -1.33 0.00 0.00 177.39 176.42 1iqa s ASP 299 N -0.02 6.98 0.00 -1.43 -1.08 0.64 -4.77 116.67 116.98 1iqa s ASP 299 Ca 0.55 1.21 0.29 0.00 -0.52 0.00 0.00 52.55 54.07 1iqa s ASP 299 Cb -0.48 -2.47 1.71 0.00 -1.46 0.00 0.00 42.92 40.22 1iqa s ASP 299 CO 0.61 -0.47 2.08 -0.81 0.52 0.00 0.00 175.17 177.11 1iqa n PRO 300 N 5.53 0.97 -2.75 4.34 -0.04 -1.26 -4.17 135.00 137.62 1iqa n PRO 300 Ca 0.06 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.18 1iqa n PRO 300 Cb 0.48 -1.46 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 1iqa n PRO 300 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1iqa s ASP 301 N -1.93 6.83 0.50 3.54 1.11 -1.26 -4.78 116.67 120.68 1iqa s ASP 301 Ca 0.43 1.77 0.24 0.00 0.18 0.00 0.00 52.55 55.17 1iqa s ASP 301 Cb 0.20 -2.55 1.33 0.00 1.07 0.00 0.00 42.92 42.96 1iqa s ASP 301 CO 0.33 -0.44 2.04 0.06 1.18 0.00 0.00 175.17 178.35 1iqa h GLN 302 N 1.95 0.00 0.00 8.23 3.07 -1.89 0.25 115.11 126.72 1iqa h GLN 302 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.25 1iqa h GLN 302 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.75 1iqa h GLN 302 CO 0.61 0.14 -0.37 -0.40 0.09 0.00 0.00 178.83 178.91 1iqa n ASP 303 N -3.77 0.56 -0.09 0.06 5.75 -1.26 -4.37 116.55 113.42 1iqa n ASP 303 Ca -0.02 0.19 -0.16 0.00 -0.01 0.00 0.00 54.79 54.79 1iqa n ASP 303 Cb 0.25 -0.12 -0.08 0.00 -1.03 0.00 0.00 41.12 40.14 1iqa n ASP 303 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1iqa h ALA 304 N 2.71 0.17 -3.81 2.12 0.00 -1.29 -3.47 119.26 115.69 1iqa h ALA 304 Ca 0.00 -0.97 -0.66 0.00 0.00 0.00 0.00 54.91 53.29 1iqa h ALA 304 Cb 0.65 0.65 -0.37 0.00 0.00 0.00 0.00 17.79 18.72 1iqa h ALA 304 CO 0.00 0.63 -0.79 0.99 0.00 0.00 0.00 179.25 180.08 1iqa s THR 305 N -2.31 2.05 0.30 0.00 2.01 -0.86 -3.62 115.64 113.21 1iqa s THR 305 Ca -0.24 -1.61 -0.16 0.00 0.31 0.00 0.00 61.69 60.00 1iqa s THR 305 Cb 0.04 -2.21 0.02 0.00 0.01 0.00 0.00 72.50 70.36 1iqa s THR 305 CO 0.46 -0.09 0.64 -0.72 -0.69 0.00 0.00 174.62 174.23 1iqa s TYR 306 N 1.14 0.17 0.16 4.92 -0.85 0.02 -2.44 117.35 120.47 1iqa s TYR 306 Ca -0.07 -0.63 -0.15 0.00 -0.52 0.00 0.00 57.07 55.70 1iqa s TYR 306 Cb -0.20 0.51 0.02 0.00 0.38 0.00 0.00 41.96 42.68 1iqa s TYR 306 CO -0.06 -1.24 0.42 -0.59 -1.52 0.00 0.00 175.55 172.57 1iqa s PHE 307 N -3.49 -0.06 0.05 -3.49 -0.12 -0.69 -0.35 117.98 109.84 1iqa s PHE 307 Ca 0.17 -0.28 -0.05 0.00 -0.05 0.00 0.00 56.93 56.72 1iqa s PHE 307 Cb -0.04 0.24 0.02 0.00 -0.63 0.00 0.00 43.02 42.61 1iqa s PHE 307 CO 0.10 -0.78 0.24 0.41 -0.05 0.00 0.00 175.22 175.14 1iqa n GLY 308 N -0.26 1.22 3.48 1.99 0.00 -0.02 -0.86 105.19 110.75 1iqa n GLY 308 Ca -0.12 -0.99 -0.15 0.00 0.00 0.00 0.00 46.02 44.75 1iqa n GLY 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iqa s ALA 309 N -1.25 -1.71 -0.18 4.61 0.00 -0.65 -1.65 121.76 120.93 1iqa s ALA 309 Ca 0.05 0.99 -0.09 0.00 0.00 0.00 0.00 51.96 52.92 1iqa s ALA 309 Cb -0.01 0.35 0.07 0.00 0.00 0.00 0.00 23.12 23.53 1iqa s ALA 309 CO 0.02 -0.53 0.43 -0.59 0.00 0.00 0.00 175.76 175.08 1iqa s PHE 310 N -2.22 -0.67 0.20 0.00 -0.12 -0.73 -0.83 117.98 113.61 1iqa s PHE 310 Ca -0.06 1.38 -0.31 0.00 -0.05 0.00 0.00 56.93 57.89 1iqa s PHE 310 Cb -0.00 0.29 -0.11 0.00 -0.63 0.00 0.00 43.02 42.57 1iqa s PHE 310 CO 0.01 -0.38 1.59 0.21 -0.05 0.00 0.00 175.22 176.59 1iqa s LYS 311 N 1.69 4.19 -0.24 1.99 2.20 -0.85 -1.28 119.74 127.43 1iqa s LYS 311 Ca -0.08 2.44 0.02 0.00 -0.36 0.00 0.00 55.97 57.99 1iqa s LYS 311 Cb -0.09 -3.11 -0.16 0.00 -1.51 0.00 0.00 37.83 32.96 1iqa s LYS 311 CO -0.13 -0.62 -0.22 0.28 -0.36 0.00 0.00 175.35 174.30 1iqa n VAL 312 N 3.51 1.40 -3.75 4.02 0.31 0.23 -4.89 118.33 119.16 1iqa n VAL 312 Ca 0.13 -0.54 -0.07 0.00 -0.01 0.00 0.00 64.34 63.85 1iqa n VAL 312 Cb 0.38 -1.37 -0.02 0.00 -0.91 0.00 0.00 33.84 31.92 1iqa n VAL 312 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1iqa s GLN 313 N -2.49 1.52 0.59 5.55 -2.07 -1.13 -4.99 119.66 116.64 1iqa s GLN 313 Ca -0.33 -0.79 -0.13 0.00 -1.82 0.00 0.00 55.36 52.29 1iqa s GLN 313 Cb 0.08 0.55 -0.05 0.00 -1.09 0.00 0.00 33.01 32.50 1iqa s GLN 313 CO 0.56 -0.69 1.02 -0.51 -1.32 0.00 0.00 175.29 174.35 1iqa s ASP 314 N -2.87 6.31 0.18 12.60 1.11 -1.26 0.19 116.67 132.92 1iqa s ASP 314 Ca 0.09 1.47 -0.32 0.00 0.18 0.00 0.00 52.55 53.98 1iqa s ASP 314 Cb -0.04 -2.48 -0.12 0.00 1.07 0.00 0.00 42.92 41.35 1iqa s ASP 314 CO 0.02 -0.81 1.76 -0.38 1.18 0.00 0.00 175.17 176.94 1iqa n ILE 315 N -2.42 0.12 -1.14 0.77 5.41 -1.26 -4.66 119.36 116.18 1iqa n ILE 315 Ca 0.06 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.79 1iqa n ILE 315 Cb 0.54 -2.02 0.00 0.00 -0.71 0.00 0.00 39.64 37.45 1iqa n ILE 315 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65