#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q87 s MET 148 N 0.00 3.08 -0.16 -1.46 -2.45 -1.26 -4.76 119.30 112.30 1q87 s MET 148 Ca 0.00 -0.79 -0.22 0.00 -1.25 0.00 0.00 55.69 53.43 1q87 s MET 148 Cb 0.00 -2.63 0.06 0.00 1.25 0.00 0.00 34.83 33.51 1q87 s MET 148 CO 0.00 -0.15 0.57 0.00 1.05 0.00 0.00 175.02 176.49 1q87 s ILE 150 N -0.21 2.95 0.48 0.00 -4.36 -1.26 -4.25 121.20 114.56 1q87 s ILE 150 Ca -0.04 0.79 0.08 0.00 -0.26 0.00 0.00 60.65 61.22 1q87 s ILE 150 Cb -0.03 -3.50 0.04 0.00 1.25 0.00 0.00 42.46 40.21 1q87 s ILE 150 CO 0.03 0.12 0.66 -0.83 0.24 0.00 0.00 174.94 175.16 1q87 s GLY 151 N 0.38 1.86 -1.69 6.27 0.00 -1.26 -4.52 107.32 108.36 1q87 s GLY 151 Ca 0.58 -1.83 -0.02 0.00 0.00 0.00 0.00 44.72 43.45 1q87 s GLY 151 CO 0.40 -1.54 0.29 -2.01 0.00 0.00 0.00 173.10 170.24 1q87 n ASN 152 N -2.02 -6.05 -3.97 1.64 4.05 -1.26 -4.94 115.26 102.70 1q87 n ASN 152 Ca 0.11 -0.15 -0.16 0.00 0.45 0.00 0.00 54.58 54.83 1q87 n ASN 152 Cb 0.60 -4.96 -0.14 0.00 1.23 0.00 0.00 39.78 36.51 1q87 n ASN 152 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 1q87 s SER 153 N -2.36 0.68 0.66 1.20 0.01 -1.26 -5.09 113.70 107.55 1q87 s SER 153 Ca 0.14 -0.14 -0.13 0.00 1.31 0.00 0.00 55.95 57.13 1q87 s SER 153 Cb -0.06 -0.06 -0.00 0.00 0.21 0.00 0.00 66.02 66.10 1q87 s SER 153 CO 0.18 0.04 1.07 0.42 0.41 0.00 0.00 173.24 175.36 1q87 s THR 154 N -0.25 3.70 0.59 1.44 -4.23 -1.26 -4.80 115.64 110.83 1q87 s THR 154 Ca 0.01 0.68 0.28 0.00 -1.18 0.00 0.00 61.69 61.49 1q87 s THR 154 Cb -0.03 -3.26 0.36 0.00 1.34 0.00 0.00 72.50 70.90 1q87 s THR 154 CO -0.00 -0.60 2.15 -0.65 -0.54 0.00 0.00 174.62 174.98 1q87 h PRO 155 N -0.23 0.00 -0.13 3.99 0.11 -1.99 -0.41 132.00 133.33 1q87 h PRO 155 Ca -0.45 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1q87 h PRO 155 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1q87 h PRO 155 CO 0.56 0.00 0.03 -0.91 -0.21 0.00 0.00 178.00 177.46 1q87 h ASN 156 N 0.00 0.21 -0.49 -2.05 2.35 -1.99 -0.51 115.58 113.09 1q87 h ASN 156 Ca 0.06 -0.25 -0.13 0.00 -0.55 0.00 0.00 56.30 55.43 1q87 h ASN 156 Cb 0.33 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 1q87 h ASN 156 CO -0.00 0.41 -0.21 -0.33 -1.65 0.00 0.00 177.43 175.65 1q87 h GLU 157 N 0.01 1.01 -0.17 0.81 5.08 -1.49 -0.76 114.58 119.07 1q87 h GLU 157 Ca 0.04 -0.43 0.03 0.00 -1.00 0.00 0.00 59.36 58.01 1q87 h GLU 157 Cb 0.28 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 1q87 h GLU 157 CO 0.00 1.11 -0.04 1.96 -1.00 0.00 0.00 179.01 181.04 1q87 h GLN 158 N 0.87 -0.00 0.07 2.33 4.20 -1.13 0.51 115.11 121.95 1q87 h GLN 158 Ca 0.11 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.84 1q87 h GLN 158 Cb 0.79 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.55 1q87 h GLN 158 CO 0.07 -0.00 -0.19 1.49 -0.67 0.00 0.00 178.83 179.53 1q87 h GLU 159 N -0.00 -0.33 -0.15 1.46 4.57 -0.88 0.70 114.58 119.94 1q87 h GLU 159 Ca 0.08 0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.33 1q87 h GLU 159 Cb 0.13 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.75 1q87 h GLU 159 CO -0.18 -0.22 -0.11 1.15 -1.18 0.00 0.00 179.01 178.47 1q87 h THR 160 N -0.34 0.68 -0.45 0.32 2.02 -0.76 -2.17 112.91 112.20 1q87 h THR 160 Ca 0.03 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 1q87 h THR 160 Cb 0.38 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1q87 h THR 160 CO -0.13 0.00 0.25 0.15 0.37 0.00 0.00 175.52 176.16 1q87 h PHE 161 N -0.12 0.61 -0.17 3.16 3.04 -0.77 -1.26 116.94 121.43 1q87 h PHE 161 Ca 0.09 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.08 1q87 h PHE 161 Cb 0.25 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.56 1q87 h PHE 161 CO -0.24 0.46 0.14 -0.09 -2.02 0.00 0.00 178.31 176.56 1q87 h ARG 162 N 0.59 0.00 0.25 1.11 2.43 -0.53 -0.33 114.38 117.90 1q87 h ARG 162 Ca 0.16 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 59.00 1q87 h ARG 162 Cb 0.05 0.00 0.04 0.00 -0.42 0.00 0.00 29.97 29.63 1q87 h ARG 162 CO -0.03 0.00 -1.46 0.00 -1.51 0.00 0.00 179.97 176.97 1q87 h ALA 163 N 1.88 -0.15 -0.78 2.80 0.00 -0.74 -2.81 119.26 119.46 1q87 h ALA 163 Ca 0.08 -0.86 -0.02 0.00 0.00 0.00 0.00 54.91 54.11 1q87 h ALA 163 Cb 0.36 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1q87 h ALA 163 CO -0.00 0.69 0.41 0.87 0.00 0.00 0.00 179.25 181.21 1q87 h LYS 164 N 0.12 1.10 0.05 0.00 1.79 -0.16 0.31 116.57 119.78 1q87 h LYS 164 Ca -0.26 -0.14 -0.00 0.00 -2.18 0.00 0.00 60.65 58.08 1q87 h LYS 164 Cb 2.14 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 32.58 1q87 h LYS 164 CO 0.27 0.82 -0.03 0.28 -1.08 0.00 0.00 179.45 179.71 1q87 h VAL 165 N 1.10 1.05 -0.51 0.50 2.07 -1.17 -0.61 116.25 118.68 1q87 h VAL 165 Ca 0.27 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 67.55 1q87 h VAL 165 Cb 0.06 1.28 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1q87 h VAL 165 CO -0.04 0.09 0.04 0.44 0.02 0.00 0.00 177.57 178.12 1q87 h ASP 166 N -0.22 -0.13 -0.19 0.57 5.19 -1.10 0.25 116.42 120.80 1q87 h ASP 166 Ca -0.01 0.11 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1q87 h ASP 166 Cb 0.20 0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.88 1q87 h ASP 166 CO 0.01 -0.04 0.07 -0.08 -3.12 0.00 0.00 179.24 176.08 1q87 h GLU 167 N 0.16 0.28 -0.53 3.56 4.81 -0.74 -2.45 114.58 119.68 1q87 h GLU 167 Ca 0.26 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.40 1q87 h GLU 167 Cb 0.38 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 1q87 h GLU 167 CO -0.39 0.38 0.18 0.82 -0.73 0.00 0.00 179.01 179.26 1q87 h ILE 168 N 0.13 1.21 0.12 2.32 2.04 -0.52 -1.35 117.51 121.45 1q87 h ILE 168 Ca 0.06 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 1q87 h ILE 168 Cb 0.21 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1q87 h ILE 168 CO -0.00 0.26 -0.06 -0.25 0.00 0.00 0.00 178.15 178.10 1q87 h TRP 169 N 0.76 -0.15 -0.44 1.37 2.91 -0.32 -1.02 115.95 119.07 1q87 h TRP 169 Ca 0.18 -0.00 0.01 0.00 1.13 0.00 0.00 58.89 60.20 1q87 h TRP 169 Cb 0.21 0.05 -0.02 0.00 -0.51 0.00 0.00 29.16 28.88 1q87 h TRP 169 CO 0.01 -0.04 0.29 0.35 -1.03 0.00 0.00 178.44 178.02 1q87 h PHE 170 N -0.21 0.54 -0.10 2.65 3.57 -1.24 0.29 116.94 122.44 1q87 h PHE 170 Ca -0.02 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 1q87 h PHE 170 Cb 0.17 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 1q87 h PHE 170 CO -0.05 0.33 -0.17 0.00 -2.23 0.00 0.00 178.31 176.19 1q87 h ARG 171 N 0.58 0.15 0.03 1.11 3.08 -0.45 0.92 114.38 119.80 1q87 h ARG 171 Ca 0.16 -0.04 -0.35 0.00 0.07 0.00 0.00 59.98 59.82 1q87 h ARG 171 Cb -0.04 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 29.94 1q87 h ARG 171 CO -0.04 0.33 -2.14 1.28 -1.07 0.00 0.00 179.97 178.33 1q87 n LEU 172 N -4.27 1.61 -0.00 3.04 4.77 -0.11 -4.53 117.00 117.51 1q87 n LEU 172 Ca -0.01 0.12 0.09 0.00 -0.03 0.00 0.00 56.01 56.18 1q87 n LEU 172 Cb 0.28 -0.33 -0.11 0.00 -2.33 0.00 0.00 43.42 40.93 1q87 n LEU 172 CO 0.38 0.67 -0.09 0.35 -1.33 0.00 0.00 177.39 177.36 1q87 n THR 173 N -3.13 0.00 -0.92 -5.08 -2.24 0.83 -4.96 114.28 98.78 1q87 n THR 173 Ca -0.32 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1q87 n THR 173 Cb 1.06 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 70.23 1q87 n THR 173 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1q87 n GLN 174 N -1.49 -1.10 -4.48 -0.78 -0.06 0.32 -4.96 117.38 104.83 1q87 n GLN 174 Ca 0.03 0.27 -0.25 0.00 -2.00 0.00 0.00 57.00 55.05 1q87 n GLN 174 Cb 0.31 -4.29 -0.10 0.00 -4.06 0.00 0.00 30.24 22.10 1q87 n GLN 174 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 1q87 s LYS 175 N -1.25 1.88 0.10 3.69 1.02 -1.26 -5.03 119.74 118.89 1q87 s LYS 175 Ca 0.00 -1.87 0.23 0.00 0.02 0.00 0.00 55.97 54.36 1q87 s LYS 175 Cb 0.00 -1.77 0.17 0.00 -0.52 0.00 0.00 37.83 35.71 1q87 s LYS 175 CO 0.00 0.16 1.15 0.25 -0.92 0.00 0.00 175.35 175.99 1q87 n THR 176 N -0.82 0.31 0.00 2.17 -2.24 -1.26 -3.56 114.28 108.88 1q87 n THR 176 Ca -0.05 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1q87 n THR 176 Cb 0.63 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1q87 n THR 176 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1q87 n ASP 177 N -2.13 0.66 0.00 3.42 -0.08 -1.26 -4.90 116.55 112.26 1q87 n ASP 177 Ca 0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.30 1q87 n ASP 177 Cb 0.45 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.91 1q87 n ASP 177 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1q87 n GLY 178 N 0.00 -0.14 3.28 0.27 0.00 -1.26 -4.91 105.19 102.43 1q87 n GLY 178 Ca 0.00 -1.01 -0.15 0.00 0.00 0.00 0.00 46.02 44.86 1q87 n GLY 178 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q87 s THR 179 N 0.00 0.51 0.15 2.61 -4.23 -1.26 -4.49 115.64 108.93 1q87 s THR 179 Ca 0.00 -1.99 -0.00 0.00 -1.18 0.00 0.00 61.69 58.52 1q87 s THR 179 Cb 0.00 -2.46 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 1q87 s THR 179 CO 0.00 -0.14 0.04 -0.69 -0.54 0.00 0.00 174.62 173.29 1q87 s VAL 180 N -3.78 0.29 -0.17 2.29 1.01 -0.30 -4.96 120.40 114.77 1q87 s VAL 180 Ca 0.34 -1.93 -0.27 0.00 0.00 0.00 0.00 61.98 60.12 1q87 s VAL 180 Cb 0.07 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 1q87 s VAL 180 CO 0.10 -0.46 0.91 -0.04 0.00 0.00 0.00 175.10 175.62 1q87 s MET 181 N -4.01 4.32 0.06 2.72 -1.94 -1.26 -1.31 119.30 117.88 1q87 s MET 181 Ca 0.24 1.17 -0.05 0.00 -1.71 0.00 0.00 55.69 55.34 1q87 s MET 181 Cb 0.07 -3.58 0.07 0.00 2.01 0.00 0.00 34.83 33.40 1q87 s MET 181 CO 0.03 -0.39 0.43 -2.13 -0.01 0.00 0.00 175.02 172.95 1q87 n ARG 182 N 5.40 -0.07 0.22 2.03 0.63 0.94 0.31 116.66 126.13 1q87 n ARG 182 Ca 0.07 0.43 0.06 0.00 -0.92 0.00 0.00 57.85 57.49 1q87 n ARG 182 Cb 0.48 -0.63 0.51 0.00 0.45 0.00 0.00 32.46 33.27 1q87 n ARG 182 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1q87 h ASP 183 N 0.00 0.00 -0.33 6.15 3.45 -1.91 -1.35 116.42 122.43 1q87 h ASP 183 Ca 0.10 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.50 1q87 h ASP 183 Cb 0.17 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.92 1q87 h ASP 183 CO -0.27 0.23 -0.02 0.15 -1.57 0.00 0.00 179.24 177.76 1q87 h PHE 184 N 0.00 0.65 0.09 4.55 3.04 0.45 -0.90 116.94 124.82 1q87 h PHE 184 Ca -0.00 -0.12 -0.00 0.00 3.98 0.00 0.00 57.97 61.82 1q87 h PHE 184 Cb 0.46 -0.17 0.00 0.00 2.56 0.00 0.00 35.95 38.80 1q87 h PHE 184 CO 0.00 0.72 -0.04 1.25 -2.02 0.00 0.00 178.31 178.22 1q87 h LEU 185 N 0.39 -0.10 -0.42 0.59 6.46 -1.15 -2.53 115.31 118.54 1q87 h LEU 185 Ca 0.09 -0.22 0.08 0.00 -0.12 0.00 0.00 57.88 57.71 1q87 h LEU 185 Cb 0.48 0.03 -0.08 0.00 -0.73 0.00 0.00 40.66 40.36 1q87 h LEU 185 CO 0.02 0.17 -0.08 0.40 -0.62 0.00 0.00 178.44 178.33 1q87 h ILE 186 N -0.37 0.60 0.16 4.05 1.08 -1.23 0.33 117.51 122.13 1q87 h ILE 186 Ca -0.01 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 1q87 h ILE 186 Cb 0.31 0.57 0.00 0.00 -3.07 0.00 0.00 36.82 34.64 1q87 h ILE 186 CO 0.02 0.00 -0.07 -0.08 -0.69 0.00 0.00 178.15 177.33 1q87 h GLU 187 N 0.03 -0.20 -0.17 2.37 4.81 -1.15 0.13 114.58 120.39 1q87 h GLU 187 Ca 0.21 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1q87 h GLU 187 Cb 0.31 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1q87 h GLU 187 CO -0.41 -0.07 0.05 0.87 -0.73 0.00 0.00 179.01 178.71 1q87 h LYS 188 N -0.28 0.26 -0.94 1.92 1.79 -1.30 -1.61 116.57 116.40 1q87 h LYS 188 Ca -0.02 -0.06 0.17 0.00 -2.18 0.00 0.00 60.65 58.56 1q87 h LYS 188 Cb 0.22 -0.04 -0.08 0.00 -1.58 0.00 0.00 32.23 30.75 1q87 h LYS 188 CO 0.04 0.38 0.60 0.00 -1.08 0.00 0.00 179.45 179.39 1q87 h ALA 189 N 0.87 1.83 -0.25 3.86 0.00 -0.25 -0.53 119.26 124.80 1q87 h ALA 189 Ca 0.05 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1q87 h ALA 189 Cb 0.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1q87 h ALA 189 CO -0.00 -0.12 -0.35 0.00 0.00 0.00 0.00 179.25 178.78 1q87 h ALA 190 N 1.61 0.94 -0.08 0.00 0.00 -0.34 -0.16 119.26 121.22 1q87 h ALA 190 Ca 0.50 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1q87 h ALA 190 Cb 0.84 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1q87 h ALA 190 CO -0.26 0.62 -0.43 0.93 0.00 0.00 0.00 179.25 180.11 1q87 h GLU 191 N 0.45 0.44 -0.05 0.00 5.08 -0.15 -2.89 114.58 117.46 1q87 h GLU 191 Ca 0.05 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.01 1q87 h GLU 191 Cb 0.82 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1q87 h GLU 191 CO 0.07 1.00 -0.12 -0.92 -1.00 0.00 0.00 179.01 178.04 1q87 h TYR 192 N -0.01 0.21 0.00 4.33 5.03 -1.35 -3.36 116.97 121.82 1q87 h TYR 192 Ca -0.03 -0.08 -0.03 0.00 2.58 0.00 0.00 58.73 61.17 1q87 h TYR 192 Cb 1.08 -0.04 -0.00 0.00 1.55 0.00 0.00 36.73 39.32 1q87 h TYR 192 CO 0.12 0.72 -0.13 0.74 -1.32 0.00 0.00 178.16 178.29 1q87 h PHE 193 N -0.36 0.00 -4.08 -3.82 0.04 -1.15 -3.48 116.94 104.09 1q87 h PHE 193 Ca -0.00 0.00 -0.49 0.00 2.80 0.00 0.00 57.97 60.28 1q87 h PHE 193 Cb 0.71 0.00 0.16 0.00 2.20 0.00 0.00 35.95 39.02 1q87 h PHE 193 CO 0.12 0.13 0.24 -1.59 -0.60 0.00 0.00 178.31 176.61 1q87 s LYS 194 N -3.16 1.23 0.40 1.51 -2.85 -1.09 -4.64 119.74 111.14 1q87 s LYS 194 Ca 0.06 1.00 -0.18 0.00 -1.00 0.00 0.00 55.97 55.86 1q87 s LYS 194 Cb 0.06 -1.79 -0.10 0.00 -2.06 0.00 0.00 37.83 33.94 1q87 s LYS 194 CO 0.69 -2.31 0.86 -0.65 0.10 0.00 0.00 175.35 174.04 1q87 s GLN 195 N -4.84 4.09 0.21 1.78 -1.52 -1.26 -4.98 119.66 113.13 1q87 s GLN 195 Ca 0.64 0.89 -0.14 0.00 -1.95 0.00 0.00 55.36 54.80 1q87 s GLN 195 Cb -0.19 -2.28 0.22 0.00 -0.22 0.00 0.00 33.01 30.54 1q87 s GLN 195 CO 0.58 0.01 1.63 -1.35 -0.25 0.00 0.00 175.29 175.91 1q87 h PRO 196 N 1.89 -0.01 -0.00 2.91 0.11 -1.99 0.96 132.00 135.86 1q87 h PRO 196 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1q87 h PRO 196 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1q87 h PRO 196 CO 0.63 -0.00 -0.06 0.39 -0.21 0.00 0.00 178.00 178.74 1q87 n GLU 197 N -5.42 0.56 -2.70 1.05 4.71 -1.26 -4.85 120.64 112.73 1q87 n GLU 197 Ca 0.07 -0.11 -0.42 0.00 -0.01 0.00 0.00 57.16 56.68 1q87 n GLU 197 Cb 0.32 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.23 1q87 n GLU 197 CO 0.00 0.00 0.00 -1.14 0.09 0.00 0.00 177.13 176.08 1q87 s GLN 198 N -2.51 4.39 0.35 3.49 0.74 0.33 -5.00 119.66 121.44 1q87 s GLN 198 Ca 0.29 1.36 -0.29 0.00 0.05 0.00 0.00 55.36 56.77 1q87 s GLN 198 Cb 0.20 -3.56 -0.11 0.00 1.10 0.00 0.00 33.01 30.64 1q87 s GLN 198 CO 0.47 -0.36 1.50 -2.14 -0.55 0.00 0.00 175.29 174.21 1q87 s PRO 199 N 2.21 4.12 0.49 1.67 0.02 -1.26 -4.70 135.00 137.55 1q87 s PRO 199 Ca 0.47 2.55 0.17 0.00 0.02 0.00 0.00 61.00 64.22 1q87 s PRO 199 Cb -0.18 -2.99 1.21 0.00 0.02 0.00 0.00 34.50 32.57 1q87 s PRO 199 CO 0.16 -0.54 2.06 -0.22 -0.33 0.00 0.00 177.00 178.13 1q87 h LYS 200 N 3.50 0.14 -0.24 5.54 3.64 -1.94 -2.07 116.57 125.14 1q87 h LYS 200 Ca -0.50 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.86 1q87 h LYS 200 Cb 1.23 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1q87 h LYS 200 CO 0.68 0.09 0.09 1.96 -2.27 0.00 0.00 179.45 180.00 1q87 h GLN 201 N 0.14 0.37 -0.58 1.90 1.08 -1.98 -1.78 115.11 114.26 1q87 h GLN 201 Ca 0.14 -0.07 -0.05 0.00 -1.45 0.00 0.00 58.65 57.22 1q87 h GLN 201 Cb 0.39 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.74 1q87 h GLN 201 CO -0.02 0.43 0.18 -0.97 -0.95 0.00 0.00 178.83 177.51 1q87 h ASN 202 N 0.23 0.85 -0.49 1.46 -0.73 -1.85 -0.45 115.58 114.59 1q87 h ASN 202 Ca 0.08 -0.21 0.06 0.00 1.87 0.00 0.00 56.30 58.11 1q87 h ASN 202 Cb 0.21 -0.22 -0.05 0.00 0.27 0.00 0.00 38.32 38.53 1q87 h ASN 202 CO -0.00 0.83 0.19 0.00 -0.37 0.00 0.00 177.43 178.07 1q87 h ALA 203 N 1.05 0.61 -0.44 1.57 0.00 -1.15 -0.61 119.26 120.28 1q87 h ALA 203 Ca 0.19 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 1q87 h ALA 203 Cb 0.28 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1q87 h ALA 203 CO -0.01 -0.20 0.07 0.82 0.00 0.00 0.00 179.25 179.94 1q87 h ILE 204 N 0.37 1.24 -0.68 0.00 2.04 -1.06 -1.21 117.51 118.22 1q87 h ILE 204 Ca 0.23 -0.89 0.05 0.00 1.00 0.00 0.00 64.86 65.25 1q87 h ILE 204 Cb 0.23 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 1q87 h ILE 204 CO -0.22 0.31 0.39 -0.33 0.00 0.00 0.00 178.15 178.30 1q87 h GLU 205 N 0.59 0.71 0.32 2.37 5.08 -0.50 0.26 114.58 123.41 1q87 h GLU 205 Ca 0.13 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1q87 h GLU 205 Cb 0.38 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1q87 h GLU 205 CO 0.01 0.47 -0.15 0.28 -1.00 0.00 0.00 179.01 178.62 1q87 h VAL 206 N 0.74 0.70 -1.00 3.13 2.07 -0.95 -2.08 116.25 118.85 1q87 h VAL 206 Ca 0.29 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 67.39 1q87 h VAL 206 Cb 0.13 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.79 1q87 h VAL 206 CO -0.16 0.09 0.65 0.40 0.02 0.00 0.00 177.57 178.58 1q87 h ILE 207 N -0.68 1.17 -0.12 4.57 1.08 -0.98 -2.31 117.51 120.24 1q87 h ILE 207 Ca -0.04 -0.43 -0.00 0.00 -0.39 0.00 0.00 64.86 63.99 1q87 h ILE 207 Cb 0.48 -0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 34.02 1q87 h ILE 207 CO 0.07 0.23 0.06 0.28 -0.69 0.00 0.00 178.15 178.10 1q87 h SER 208 N 1.26 0.15 -0.56 1.72 0.02 -0.40 0.14 113.55 115.88 1q87 h SER 208 Ca 0.40 -0.11 0.10 0.00 -0.84 0.00 0.00 61.79 61.34 1q87 h SER 208 Cb 0.01 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 1q87 h SER 208 CO -0.13 0.22 0.38 0.00 -1.14 0.00 0.00 176.83 176.16 1q87 h ALA 209 N 0.93 2.07 0.23 3.77 0.00 -1.04 -2.44 119.26 122.79 1q87 h ALA 209 Ca 0.04 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.62 1q87 h ALA 209 Cb 0.11 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 17.87 1q87 h ALA 209 CO -0.01 -0.20 -1.45 0.82 0.00 0.00 0.00 179.25 178.41 1q87 h ILE 210 N 0.34 1.24 0.00 0.00 2.04 -1.06 -3.38 117.51 116.69 1q87 h ILE 210 Ca 0.26 -2.64 -0.62 0.00 1.00 0.00 0.00 64.86 62.85 1q87 h ILE 210 Cb 0.57 3.01 0.01 0.00 -0.74 0.00 0.00 36.82 39.67 1q87 h ILE 210 CO -0.06 0.80 3.33 0.80 0.00 0.00 0.00 178.15 183.02 1q87 n MET 211 N -3.75 3.01 -2.91 2.37 1.56 0.45 -4.93 117.12 112.92 1q87 n MET 211 Ca -0.18 -2.13 -0.19 0.00 -0.27 0.00 0.00 57.70 54.93 1q87 n MET 211 Cb 1.07 -2.87 0.03 0.00 2.15 0.00 0.00 33.22 33.60 1q87 n MET 211 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1q87 s ALA 212 N 2.89 4.38 0.62 -5.12 0.00 -1.26 -4.47 121.76 118.81 1q87 s ALA 212 Ca 0.58 -1.67 -0.18 0.00 0.00 0.00 0.00 51.96 50.69 1q87 s ALA 212 Cb 0.15 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.53 1q87 s ALA 212 CO -0.05 -0.52 1.23 -2.14 0.00 0.00 0.00 175.76 174.29 1q87 s PRO 213 N -4.52 2.79 0.36 0.00 0.02 -1.26 -4.88 135.00 127.51 1q87 s PRO 213 Ca 0.57 1.89 0.09 0.00 0.02 0.00 0.00 61.00 63.57 1q87 s PRO 213 Cb -0.09 -1.90 0.69 0.00 0.02 0.00 0.00 34.50 33.22 1q87 s PRO 213 CO 0.36 -1.36 1.85 1.96 -0.33 0.00 0.00 177.00 179.47 1q87 h GLN 214 N 0.70 0.20 -4.08 5.54 1.08 -1.91 -3.31 115.11 113.33 1q87 h GLN 214 Ca -0.50 -0.06 -0.74 0.00 -1.45 0.00 0.00 58.65 55.90 1q87 h GLN 214 Cb 1.31 -0.02 -0.12 0.00 -0.05 0.00 0.00 27.48 28.60 1q87 h GLN 214 CO 0.54 0.43 2.17 0.39 -0.95 0.00 0.00 178.83 181.42 1q87 n GLU 215 N -4.19 3.36 -3.69 1.46 4.71 -1.26 -4.84 120.64 116.19 1q87 n GLU 215 Ca -0.01 -3.35 -0.10 0.00 -0.01 0.00 0.00 57.16 53.68 1q87 n GLU 215 Cb 0.34 -3.09 -0.11 0.00 -1.01 0.00 0.00 31.44 27.58 1q87 n GLU 215 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1q87 s GLU 216 N 1.62 0.35 -0.10 3.49 2.12 -1.25 -5.06 118.70 119.86 1q87 s GLU 216 Ca 0.43 0.83 -0.17 0.00 0.36 0.00 0.00 54.97 56.43 1q87 s GLU 216 Cb 0.08 0.06 -0.27 0.00 0.26 0.00 0.00 34.13 34.25 1q87 s GLU 216 CO -0.01 -0.19 0.57 -0.56 -0.54 0.00 0.00 175.26 174.54 1q87 h GLN 217 N 7.46 0.23 -6.73 4.30 3.07 -1.94 -3.42 115.11 118.09 1q87 h GLN 217 Ca -0.30 -0.40 -0.49 0.00 0.09 0.00 0.00 58.65 57.55 1q87 h GLN 217 Cb 1.16 0.15 0.02 0.00 0.08 0.00 0.00 27.48 28.89 1q87 h GLN 217 CO 0.25 1.19 -0.03 0.99 0.09 0.00 0.00 178.83 181.31 1q87 s THR 218 N -2.46 5.00 -0.17 1.86 2.01 -1.26 -0.04 115.64 120.57 1q87 s THR 218 Ca -0.20 -0.08 -0.12 0.00 0.31 0.00 0.00 61.69 61.61 1q87 s THR 218 Cb 0.04 -3.85 0.05 0.00 0.01 0.00 0.00 72.50 68.75 1q87 s THR 218 CO 0.76 -0.69 0.44 -0.75 -0.69 0.00 0.00 174.62 173.70 1q87 s LYS 219 N -4.46 0.46 0.42 4.92 2.47 -0.43 -4.62 119.74 118.51 1q87 s LYS 219 Ca 0.44 0.75 0.07 0.00 -1.56 0.00 0.00 55.97 55.67 1q87 s LYS 219 Cb -0.10 0.09 -0.05 0.00 -1.46 0.00 0.00 37.83 36.31 1q87 s LYS 219 CO 0.40 -0.12 0.15 -1.54 0.16 0.00 0.00 175.35 174.40 1q87 s SER 220 N 0.95 4.33 0.55 1.43 1.04 -1.26 -1.15 113.70 119.58 1q87 s SER 220 Ca -0.06 -1.17 0.26 0.00 0.48 0.00 0.00 55.95 55.47 1q87 s SER 220 Cb -0.06 -0.36 1.44 0.00 0.10 0.00 0.00 66.02 67.14 1q87 s SER 220 CO -0.08 -0.58 1.99 0.50 0.98 0.00 0.00 173.24 176.06 1q87 h LYS 221 N 1.44 0.00 0.00 4.02 3.64 -1.93 0.41 116.57 124.15 1q87 h LYS 221 Ca -0.43 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.94 1q87 h LYS 221 Cb 1.26 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1q87 h LYS 221 CO 0.71 0.00 -0.06 0.00 -2.27 0.00 0.00 179.45 177.83 1q87 h ALA 222 N 1.70 1.37 -0.01 5.00 0.00 -1.95 0.99 119.26 126.36 1q87 h ALA 222 Ca 0.23 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 1q87 h ALA 222 Cb 1.00 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.79 1q87 h ALA 222 CO -0.00 0.08 -0.82 -0.44 0.00 0.00 0.00 179.25 178.06 1q87 h ASP 223 N 0.00 0.73 -0.15 0.00 3.32 -0.56 -2.23 116.42 117.54 1q87 h ASP 223 Ca -0.00 -0.74 -0.00 0.00 0.02 0.00 0.00 57.03 56.30 1q87 h ASP 223 Cb 0.18 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1q87 h ASP 223 CO 0.01 1.38 0.09 0.25 -1.72 0.00 0.00 179.24 179.25 1q87 h LEU 224 N 0.16 0.18 -0.47 1.55 6.46 -1.32 -0.65 115.31 121.23 1q87 h LEU 224 Ca -0.10 -0.05 0.09 0.00 -0.12 0.00 0.00 57.88 57.69 1q87 h LEU 224 Cb 1.50 -0.05 -0.08 0.00 -0.73 0.00 0.00 40.66 41.31 1q87 h LEU 224 CO 0.16 0.18 -0.00 0.22 -0.62 0.00 0.00 178.44 178.38 1q87 h TYR 225 N 0.16 -0.03 -0.59 1.25 3.20 -0.85 0.18 116.97 120.30 1q87 h TYR 225 Ca 0.05 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 1q87 h TYR 225 Cb 0.03 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 1q87 h TYR 225 CO -0.05 -0.10 0.35 -0.22 -1.64 0.00 0.00 178.16 176.50 1q87 h LYS 226 N 0.11 0.80 0.15 1.82 3.64 -0.94 0.31 116.57 122.46 1q87 h LYS 226 Ca 0.23 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1q87 h LYS 226 Cb 0.35 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1q87 h LYS 226 CO -0.39 0.58 -0.07 0.35 -2.27 0.00 0.00 179.45 177.64 1q87 h PHE 227 N 0.79 -0.19 -0.01 1.91 3.57 -0.13 -0.77 116.94 122.11 1q87 h PHE 227 Ca 0.21 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.65 1q87 h PHE 227 Cb -0.02 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1q87 h PHE 227 CO -0.02 0.01 -0.26 -0.07 -2.23 0.00 0.00 178.31 175.74 1q87 h LEU 228 N -0.37 0.01 -0.68 0.59 3.38 -0.57 -1.97 115.31 115.70 1q87 h LEU 228 Ca -0.02 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 1q87 h LEU 228 Cb 0.29 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1q87 h LEU 228 CO 0.03 0.27 -0.52 0.00 0.09 0.00 0.00 178.44 178.32 1q87 h ALA 229 N 1.73 0.86 -0.21 1.53 0.00 -0.01 0.82 119.26 123.99 1q87 h ALA 229 Ca -0.00 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.25 1q87 h ALA 229 Cb 0.46 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1q87 h ALA 229 CO 0.03 0.68 -0.51 0.52 0.00 0.00 0.00 179.25 179.97 1q87 h MET 230 N 0.29 0.71 0.00 0.00 2.86 -0.43 -3.33 114.93 115.03 1q87 h MET 230 Ca 0.01 -0.49 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 1q87 h MET 230 Cb 1.01 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.74 1q87 h MET 230 CO 0.09 1.11 0.00 1.19 1.06 0.00 0.00 176.91 180.36 1q87 n PHE 231 N -4.13 0.00 -0.84 -0.22 3.72 -0.86 -4.86 117.46 110.27 1q87 n PHE 231 Ca -0.06 -0.11 -0.28 0.00 -0.05 0.00 0.00 57.45 56.94 1q87 n PHE 231 Cb 0.60 -0.01 0.22 0.00 -0.94 0.00 0.00 39.48 39.35 1q87 n PHE 231 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1q87 s GLY 232 N -0.23 1.55 0.59 1.37 0.00 0.29 -4.04 107.32 106.86 1q87 s GLY 232 Ca 0.00 -0.26 -0.15 0.00 0.00 0.00 0.00 44.72 44.31 1q87 s GLY 232 CO 0.00 0.42 1.04 2.56 0.00 0.00 0.00 173.10 177.12 1q87 s PRO 233 N -4.70 3.39 0.45 2.90 0.05 -0.17 -4.35 135.00 132.57 1q87 s PRO 233 Ca 0.67 1.12 0.18 0.00 0.05 0.00 0.00 61.00 63.02 1q87 s PRO 233 Cb -0.22 -2.05 1.14 0.00 0.05 0.00 0.00 34.50 33.42 1q87 s PRO 233 CO 0.61 -0.75 1.92 0.10 0.05 0.00 0.00 177.00 178.94 1q87 h TYR 234 N 0.36 0.39 -0.64 0.56 -0.00 -1.87 -1.65 116.97 114.11 1q87 h TYR 234 Ca -0.46 0.01 0.19 0.00 0.00 0.00 0.00 58.73 58.46 1q87 h TYR 234 Cb 1.21 -0.12 -0.03 0.00 0.00 0.00 0.00 36.73 37.80 1q87 h TYR 234 CO 0.60 0.14 0.60 0.93 -0.00 0.00 0.00 178.16 180.42 1q87 h GLU 235 N 0.32 0.00 0.00 0.10 3.07 -1.95 -1.79 114.58 114.34 1q87 h GLU 235 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 1q87 h GLU 235 Cb 0.98 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1q87 h GLU 235 CO -0.10 0.00 -0.12 0.25 -1.40 0.00 0.00 179.01 177.64 1q87 n THR 236 N -3.84 0.61 -0.28 1.13 -2.24 -0.68 -4.87 114.28 104.11 1q87 n THR 236 Ca 0.13 -0.69 0.05 0.00 -2.27 0.00 0.00 64.05 61.27 1q87 n THR 236 Cb 0.83 0.52 0.14 0.00 -2.10 0.00 0.00 70.33 69.72 1q87 n THR 236 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1q87 h ILE 237 N 2.61 0.23 -0.20 2.28 -0.00 -0.72 0.60 117.51 122.31 1q87 h ILE 237 Ca 0.00 -0.01 -0.09 0.00 -0.00 0.00 0.00 64.86 64.76 1q87 h ILE 237 Cb 0.97 0.19 -0.01 0.00 -0.00 0.00 0.00 36.82 37.96 1q87 h ILE 237 CO 0.00 0.01 -0.26 -0.03 -0.00 0.00 0.00 178.15 177.87 1q87 h MET 238 N 0.04 0.38 -0.32 2.19 4.05 -1.82 -1.12 114.93 118.33 1q87 h MET 238 Ca 0.42 -0.14 -0.08 0.00 -0.28 0.00 0.00 59.70 59.62 1q87 h MET 238 Cb 0.71 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.47 1q87 h MET 238 CO -0.78 0.61 -0.11 -0.07 0.23 0.00 0.00 176.91 176.79 1q87 h LEU 239 N 0.34 0.65 -0.36 3.39 3.38 -0.21 -1.10 115.31 121.40 1q87 h LEU 239 Ca 0.05 -0.39 -0.08 0.00 0.09 0.00 0.00 57.88 57.56 1q87 h LEU 239 Cb 0.64 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1q87 h LEU 239 CO 0.05 0.89 -0.08 0.11 0.09 0.00 0.00 178.44 179.50 1q87 h LYS 240 N 0.41 0.69 -0.05 1.13 1.57 -1.04 -1.97 116.57 117.31 1q87 h LYS 240 Ca 0.08 -0.26 0.04 0.00 -1.87 0.00 0.00 60.65 58.63 1q87 h LYS 240 Cb 0.62 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.85 1q87 h LYS 240 CO 0.04 0.85 -0.24 0.82 -0.57 0.00 0.00 179.45 180.35 1q87 h ILE 241 N 0.49 0.44 -0.25 1.86 2.04 -1.13 -0.95 117.51 120.01 1q87 h ILE 241 Ca 0.09 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 1q87 h ILE 241 Cb 0.59 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1q87 h ILE 241 CO 0.03 0.00 0.10 0.00 0.00 0.00 0.00 178.15 178.29 1q87 h ALA 242 N 0.55 1.73 0.08 1.87 0.00 -1.14 -0.50 119.26 121.85 1q87 h ALA 242 Ca 0.08 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1q87 h ALA 242 Cb 0.45 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1q87 h ALA 242 CO -0.25 0.22 -0.04 1.03 0.00 0.00 0.00 179.25 180.21 1q87 h SER 243 N 0.34 -0.10 -0.16 0.00 0.87 -0.71 -1.75 113.55 112.05 1q87 h SER 243 Ca 0.09 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.38 1q87 h SER 243 Cb 0.06 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1q87 h SER 243 CO -0.01 0.18 -0.05 0.25 -0.53 0.00 0.00 176.83 176.67 1q87 h LEU 244 N -0.38 0.33 -0.69 2.23 6.46 -0.74 -2.86 115.31 119.66 1q87 h LEU 244 Ca -0.01 -0.37 0.03 0.00 -0.12 0.00 0.00 57.88 57.41 1q87 h LEU 244 Cb 0.32 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.12 1q87 h LEU 244 CO 0.02 0.63 0.43 -0.07 -0.62 0.00 0.00 178.44 178.82 1q87 h LEU 245 N 0.02 0.70 -0.31 2.25 4.07 -1.16 -0.69 115.31 120.19 1q87 h LEU 245 Ca 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.00 1q87 h LEU 245 Cb 0.49 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.07 1q87 h LEU 245 CO 0.02 0.48 0.19 0.25 -1.08 0.00 0.00 178.44 178.30 1q87 h LEU 246 N 0.83 0.37 -0.14 1.67 7.12 -1.32 -0.48 115.31 123.36 1q87 h LEU 246 Ca 0.28 -0.04 0.02 0.00 0.13 0.00 0.00 57.88 58.27 1q87 h LEU 246 Cb 0.04 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.06 1q87 h LEU 246 CO -0.12 0.30 0.02 0.40 -0.13 0.00 0.00 178.44 178.91 1q87 h ILE 247 N 0.40 0.93 -0.38 4.05 2.04 -1.18 -2.05 117.51 121.32 1q87 h ILE 247 Ca 0.11 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 65.96 1q87 h ILE 247 Cb -0.01 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 1q87 h ILE 247 CO -0.02 0.01 0.23 -1.28 0.00 0.00 0.00 178.15 177.09 1q87 h SER 248 N 0.07 0.37 0.33 1.72 0.87 -0.87 -2.17 113.55 113.87 1q87 h SER 248 Ca 0.06 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 1q87 h SER 248 Cb 0.06 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1q87 h SER 248 CO -0.09 0.27 -0.08 0.78 -0.53 0.00 0.00 176.83 177.18 1q87 h ASN 249 N 0.46 0.00 -0.40 6.23 2.35 -0.89 -0.87 115.58 122.46 1q87 h ASN 249 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1q87 h ASN 249 Cb -0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1q87 h ASN 249 CO -0.07 0.08 0.00 0.59 -1.65 0.00 0.00 177.43 176.39 1q87 n ASN 250 N -3.56 2.54 -0.95 5.81 4.13 -0.79 -4.13 115.26 118.31 1q87 n ASN 250 Ca -0.02 -2.11 0.01 0.00 1.68 0.00 0.00 54.58 54.15 1q87 n ASN 250 Cb 0.20 -0.35 0.00 0.00 -1.54 0.00 0.00 39.78 38.10 1q87 n ASN 250 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1q87 n LYS 251 N 0.65 0.00 0.00 3.52 4.76 -0.57 -4.99 118.16 121.52 1q87 n LYS 251 Ca 0.14 -1.35 0.00 0.00 -2.87 0.00 0.00 58.31 54.23 1q87 n LYS 251 Cb 0.44 -0.19 0.00 0.00 -1.84 0.00 0.00 35.03 33.44 1q87 n LYS 251 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q87 n GLY 252 N 0.21 0.90 3.42 0.72 0.00 -1.19 -4.53 105.19 104.72 1q87 n GLY 252 Ca 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 1q87 n GLY 252 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1q87 n HIS 253 N -1.33 -2.20 0.22 1.61 8.25 -0.44 -4.92 115.22 116.41 1q87 n HIS 253 Ca 0.00 0.93 0.12 0.00 -0.26 0.00 0.00 57.72 58.51 1q87 n HIS 253 Cb 0.00 -5.00 0.20 0.00 1.12 0.00 0.00 29.99 26.32 1q87 n HIS 253 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 1q87 h TRP 254 N -1.84 0.00 -3.64 4.41 5.08 -1.80 -3.46 115.95 114.70 1q87 h TRP 254 Ca -0.59 0.00 -0.51 0.00 1.08 0.00 0.00 58.89 58.87 1q87 h TRP 254 Cb 1.34 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.48 1q87 h TRP 254 CO 0.43 0.05 0.38 -1.17 -1.28 0.00 0.00 178.44 176.85 1q87 s LEU 255 N -6.24 4.55 0.01 0.11 0.20 -1.26 -1.41 118.68 114.64 1q87 s LEU 255 Ca 0.06 1.92 -0.01 0.00 0.69 0.00 0.00 54.13 56.79 1q87 s LEU 255 Cb 0.06 -3.60 -0.01 0.00 -0.43 0.00 0.00 46.19 42.21 1q87 s LEU 255 CO 0.67 -0.01 0.02 0.28 -0.29 0.00 0.00 176.35 177.01 1q87 s THR 256 N -0.52 0.07 -1.46 3.68 -1.32 -0.31 -4.92 115.64 110.86 1q87 s THR 256 Ca 0.45 -0.56 0.15 0.00 -1.21 0.00 0.00 61.69 60.52 1q87 s THR 256 Cb -0.26 -0.21 0.36 0.00 -1.51 0.00 0.00 72.50 70.88 1q87 s THR 256 CO 0.32 -0.31 1.28 0.49 -2.21 0.00 0.00 174.62 174.19 1q87 n PHE 257 N 2.09 0.50 -2.53 9.09 3.72 -1.26 -4.42 117.46 124.65 1q87 n PHE 257 Ca -0.20 -0.39 -0.42 0.00 -0.05 0.00 0.00 57.45 56.40 1q87 n PHE 257 Cb 0.57 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 39.06 1q87 n PHE 257 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1q87 s ASP 258 N -1.07 7.18 0.62 4.37 3.68 -1.26 -4.54 116.67 125.65 1q87 s ASP 258 Ca 0.29 1.85 0.40 0.00 2.13 0.00 0.00 52.55 57.23 1q87 s ASP 258 Cb 0.16 -2.57 2.03 0.00 -1.45 0.00 0.00 42.92 41.09 1q87 s ASP 258 CO 0.22 -0.41 2.23 -0.65 0.13 0.00 0.00 175.17 176.69 1q87 h PRO 259 N 6.89 0.00 -0.92 4.34 0.11 -1.94 -0.77 132.00 139.71 1q87 h PRO 259 Ca -0.40 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.61 1q87 h PRO 259 Cb 1.21 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 1q87 h PRO 259 CO 0.80 0.01 0.13 0.94 -0.21 0.00 0.00 178.00 179.66 1q87 n GLN 260 N -3.13 1.95 0.06 1.05 -0.06 -1.26 -4.24 117.38 111.74 1q87 n GLN 260 Ca -0.02 -1.14 -0.11 0.00 -2.00 0.00 0.00 57.00 53.73 1q87 n GLN 260 Cb 0.15 -1.61 -0.07 0.00 -4.06 0.00 0.00 30.24 24.65 1q87 n GLN 260 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1q87 h ALA 261 N 2.18 -0.22 -0.89 1.69 0.00 -1.53 -3.30 119.26 117.19 1q87 h ALA 261 Ca 0.12 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1q87 h ALA 261 Cb 1.38 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.21 1q87 h ALA 261 CO 0.30 -0.30 0.59 1.49 0.00 0.00 0.00 179.25 181.33 1q87 h GLU 262 N -0.87 1.16 -1.31 0.00 4.81 -1.83 -2.03 114.58 114.51 1q87 h GLU 262 Ca -0.02 -0.07 0.38 0.00 -0.13 0.00 0.00 59.36 59.52 1q87 h GLU 262 Cb 0.52 -0.26 -0.08 0.00 0.63 0.00 0.00 28.75 29.56 1q87 h GLU 262 CO 0.04 0.77 0.91 0.87 -0.73 0.00 0.00 179.01 180.86 1q87 h LYS 263 N 1.19 0.09 -3.83 1.92 1.79 -1.83 -3.15 116.57 112.76 1q87 h LYS 263 Ca 0.33 -0.01 -0.37 0.00 -2.18 0.00 0.00 60.65 58.42 1q87 h LYS 263 Cb -0.13 -0.02 0.03 0.00 -1.58 0.00 0.00 32.23 30.53 1q87 h LYS 263 CO -0.07 0.06 2.18 0.09 -1.08 0.00 0.00 179.45 180.63 1q87 n ASN 264 N -4.32 3.32 -4.13 0.86 3.02 -0.76 -5.17 115.26 108.08 1q87 n ASN 264 Ca 0.30 -2.34 -0.38 0.00 -0.03 0.00 0.00 54.58 52.14 1q87 n ASN 264 Cb 1.33 -0.95 -0.09 0.00 -0.61 0.00 0.00 39.78 39.45 1q87 n ASN 264 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q87 s ALA 265 N 4.20 3.59 0.00 5.41 0.00 -1.20 -5.12 121.76 128.65 1q87 s ALA 265 Ca 0.37 -3.16 0.00 0.00 0.00 0.00 0.00 51.96 49.16 1q87 s ALA 265 Cb 0.09 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.46 1q87 s ALA 265 CO 0.02 -2.09 0.00 -1.13 0.00 0.00 0.00 175.76 172.57 1q87 n SER 271 N 3.72 -1.98 -4.73 0.00 3.41 -1.26 -5.25 113.62 107.54 1q87 n SER 271 Ca 0.07 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.27 1q87 n SER 271 Cb 0.39 -0.99 -0.04 0.00 -0.26 0.00 0.00 64.21 63.31 1q87 n SER 271 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1q87 s ILE 272 N 0.00 4.48 -0.03 -1.33 1.01 -1.26 -4.90 121.20 119.17 1q87 s ILE 272 Ca 0.00 2.06 -0.30 0.00 0.00 0.00 0.00 60.65 62.42 1q87 s ILE 272 Cb 0.00 -4.32 0.07 0.00 0.01 0.00 0.00 42.46 38.22 1q87 s ILE 272 CO 0.00 0.33 0.66 -0.55 0.00 0.00 0.00 174.94 175.38 1q87 s SER 273 N -0.07 -0.63 -0.04 3.58 0.15 -0.99 -4.75 113.70 110.94 1q87 s SER 273 Ca 0.46 0.62 -0.06 0.00 0.70 0.00 0.00 55.95 57.68 1q87 s SER 273 Cb -0.23 0.54 0.01 0.00 -1.71 0.00 0.00 66.02 64.62 1q87 s SER 273 CO 0.30 -0.64 0.15 -0.83 1.20 0.00 0.00 173.24 173.42 1q87 s GLY 274 N -1.36 -0.07 0.21 9.45 0.00 -0.50 0.84 107.32 115.89 1q87 s GLY 274 Ca -0.10 0.28 -0.17 0.00 0.00 0.00 0.00 44.72 44.73 1q87 s GLY 274 CO 0.07 0.20 0.54 0.66 0.00 0.00 0.00 173.10 174.57 1q87 s TRP 275 N -0.32 -0.06 -0.14 1.90 -2.14 -0.33 -1.16 118.94 116.69 1q87 s TRP 275 Ca -0.04 -0.29 -0.16 0.00 2.66 0.00 0.00 56.10 58.27 1q87 s TRP 275 Cb -0.03 0.40 -0.04 0.00 -3.10 0.00 0.00 33.47 30.69 1q87 s TRP 275 CO 0.01 -0.96 0.39 -0.06 -2.66 0.00 0.00 176.95 173.67 1q87 s PHE 276 N -3.90 3.48 0.11 1.66 0.08 -1.26 0.34 117.98 118.50 1q87 s PHE 276 Ca 0.11 0.74 -0.32 0.00 0.12 0.00 0.00 56.93 57.58 1q87 s PHE 276 Cb -0.01 -2.45 -0.12 0.00 -0.57 0.00 0.00 43.02 39.87 1q87 s PHE 276 CO -0.00 0.19 1.79 -3.47 -0.10 0.00 0.00 175.22 173.63 1q87 n ASP 277 N 3.66 3.80 0.27 1.36 4.64 -0.84 -4.86 116.55 124.58 1q87 n ASP 277 Ca -0.09 1.01 0.13 0.00 -1.38 0.00 0.00 54.79 54.46 1q87 n ASP 277 Cb 0.52 -1.51 0.82 0.00 -1.04 0.00 0.00 41.12 39.91 1q87 n ASP 277 CO 0.00 0.00 0.00 -0.61 -0.82 0.00 0.00 177.20 175.77 1q87 h GLN 278 N 8.01 0.00 0.10 -0.67 5.75 -1.95 -2.62 115.11 123.73 1q87 h GLN 278 Ca -0.46 0.00 -0.34 0.00 -0.15 0.00 0.00 58.65 57.70 1q87 h GLN 278 Cb 1.23 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.76 1q87 h GLN 278 CO 0.94 0.00 -1.83 0.09 -2.65 0.00 0.00 178.83 175.37 1q87 n ASN 279 N -4.08 2.08 -4.08 -0.69 4.13 -1.26 -4.53 115.26 106.83 1q87 n ASN 279 Ca -0.02 0.26 -0.35 0.00 1.68 0.00 0.00 54.58 56.15 1q87 n ASN 279 Cb 0.12 -0.90 -0.08 0.00 -1.54 0.00 0.00 39.78 37.39 1q87 n ASN 279 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1q87 s GLU 280 N -2.52 3.01 0.40 3.52 2.12 -1.10 -1.71 118.70 122.42 1q87 s GLU 280 Ca -0.24 -3.12 0.16 0.00 0.36 0.00 0.00 54.97 52.14 1q87 s GLU 280 Cb 0.06 -3.84 1.03 0.00 0.26 0.00 0.00 34.13 31.65 1q87 s GLU 280 CO 0.73 -1.25 1.85 -1.35 -0.54 0.00 0.00 175.26 174.71 1q87 h PRO 281 N 6.16 0.45 -0.00 4.30 0.11 -1.69 -2.20 132.00 139.12 1q87 h PRO 281 Ca 0.12 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1q87 h PRO 281 Cb 0.84 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1q87 h PRO 281 CO 0.80 0.30 0.00 0.27 -0.21 0.00 0.00 178.00 179.16 1q87 n ASN 282 N -4.54 0.04 -4.49 -2.05 6.94 -1.25 -4.06 115.26 105.85 1q87 n ASN 282 Ca 0.19 -1.27 -0.37 0.00 -0.02 0.00 0.00 54.58 53.12 1q87 n ASN 282 Cb 0.67 -0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.97 1q87 n ASN 282 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1q87 s LEU 284 N 1.51 4.07 -0.21 0.00 2.96 0.64 -1.98 118.68 125.68 1q87 s LEU 284 Ca 0.06 0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 54.26 1q87 s LEU 284 Cb -0.15 -2.50 -0.05 0.00 0.50 0.00 0.00 46.19 43.99 1q87 s LEU 284 CO 0.05 -0.18 0.15 -0.63 -1.32 0.00 0.00 176.35 174.41 1q87 s ILE 285 N 1.96 5.39 -0.15 6.68 1.01 0.15 -1.96 121.20 134.28 1q87 s ILE 285 Ca 0.17 0.20 0.01 0.00 0.00 0.00 0.00 60.65 61.04 1q87 s ILE 285 Cb -0.15 -3.49 0.01 0.00 0.01 0.00 0.00 42.46 38.83 1q87 s ILE 285 CO 0.09 0.40 -0.19 -0.76 0.00 0.00 0.00 174.94 174.48 1q87 s LEU 286 N 0.61 2.24 -0.75 2.97 1.43 0.23 -1.18 118.68 124.23 1q87 s LEU 286 Ca 0.08 -0.57 -0.14 0.00 -1.03 0.00 0.00 54.13 52.47 1q87 s LEU 286 Cb -0.12 -1.49 0.19 0.00 0.03 0.00 0.00 46.19 44.80 1q87 s LEU 286 CO 0.00 0.07 0.69 -0.75 0.23 0.00 0.00 176.35 176.59 1q87 s LYS 287 N 0.90 3.42 0.56 1.70 2.20 0.25 -0.17 119.74 128.60 1q87 s LYS 287 Ca -0.05 -2.27 -0.03 0.00 -0.36 0.00 0.00 55.97 53.27 1q87 s LYS 287 Cb -0.15 -4.38 0.02 0.00 -1.51 0.00 0.00 37.83 31.81 1q87 s LYS 287 CO -0.03 -1.30 0.83 0.95 -0.36 0.00 0.00 175.35 175.44 1q87 s THR 288 N 0.53 3.31 0.45 3.43 -4.23 0.77 -2.35 115.64 117.54 1q87 s THR 288 Ca 0.14 -0.33 0.19 0.00 -1.18 0.00 0.00 61.69 60.51 1q87 s THR 288 Cb -0.15 -3.29 0.22 0.00 1.34 0.00 0.00 72.50 70.62 1q87 s THR 288 CO -0.06 -0.25 2.03 -0.65 -0.54 0.00 0.00 174.62 175.15 1q87 h PRO 289 N -0.03 0.00 -1.21 3.99 0.11 -1.93 -2.23 132.00 130.69 1q87 h PRO 289 Ca -0.45 0.00 -0.41 0.00 0.11 0.00 0.00 66.00 65.25 1q87 h PRO 289 Cb 1.27 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.19 1q87 h PRO 289 CO 0.58 0.15 0.53 -2.37 -0.21 0.00 0.00 178.00 176.67 1q87 n THR 290 N -4.14 2.85 0.00 -1.15 5.66 -1.26 -5.02 114.28 111.22 1q87 n THR 290 Ca -0.02 -1.79 0.00 0.00 -3.05 0.00 0.00 64.05 59.19 1q87 n THR 290 Cb 0.23 -1.04 0.00 0.00 -1.55 0.00 0.00 70.33 67.97 1q87 n THR 290 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1q87 n GLY 291 N -0.28 -1.60 3.88 1.09 0.00 -0.84 -5.00 105.19 102.44 1q87 n GLY 291 Ca 0.41 -2.07 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 1q87 n GLY 291 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q87 s ILE 292 N 0.00 5.13 -0.00 -0.61 1.01 -1.26 -0.17 121.20 125.30 1q87 s ILE 292 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.92 1q87 s ILE 292 Cb 0.00 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.85 1q87 s ILE 292 CO 0.00 0.18 0.00 -0.13 0.00 0.00 0.00 174.94 174.99 1q87 s ARG 293 N -2.23 0.03 -0.03 2.79 0.52 0.76 -4.94 118.95 115.85 1q87 s ARG 293 Ca 0.36 0.01 0.05 0.00 -0.52 0.00 0.00 55.73 55.63 1q87 s ARG 293 Cb -0.13 -0.07 -0.01 0.00 0.52 0.00 0.00 34.95 35.26 1q87 s ARG 293 CO 0.20 -0.02 -0.17 0.15 0.02 0.00 0.00 175.30 175.49 1q87 s LYS 294 N 0.15 1.64 -0.02 3.54 1.02 -1.26 0.77 119.74 125.57 1q87 s LYS 294 Ca -0.01 -0.62 -0.02 0.00 0.02 0.00 0.00 55.97 55.34 1q87 s LYS 294 Cb -0.02 -1.48 0.01 0.00 -0.52 0.00 0.00 37.83 35.81 1q87 s LYS 294 CO -0.00 0.30 0.06 -1.50 -0.92 0.00 0.00 175.35 173.28 1q87 s ILE 295 N -0.13 0.00 -0.09 2.17 1.10 -0.83 -4.57 121.20 118.85 1q87 s ILE 295 Ca 0.00 -0.01 0.02 0.00 -0.51 0.00 0.00 60.65 60.15 1q87 s ILE 295 Cb -0.10 -0.10 -0.02 0.00 0.15 0.00 0.00 42.46 42.40 1q87 s ILE 295 CO 0.01 -0.01 -0.16 0.26 -2.11 0.00 0.00 174.94 172.94 1q87 s TRP 296 N 0.01 2.71 0.24 3.50 0.51 -0.38 -0.26 118.94 125.27 1q87 s TRP 296 Ca -0.00 -0.52 -0.28 0.00 -2.12 0.00 0.00 56.10 53.17 1q87 s TRP 296 Cb -0.01 -1.74 -0.09 0.00 -0.81 0.00 0.00 33.47 30.83 1q87 s TRP 296 CO 0.00 -0.10 0.91 1.21 -0.51 0.00 0.00 176.95 178.46 1q87 s ASN 297 N -0.06 7.55 -0.45 2.95 2.47 0.20 -1.59 114.94 126.00 1q87 s ASN 297 Ca -0.03 1.87 -0.12 0.00 0.42 0.00 0.00 52.86 55.00 1q87 s ASN 297 Cb -0.14 -2.58 0.08 0.00 -1.45 0.00 0.00 41.25 37.16 1q87 s ASN 297 CO 0.04 0.13 0.33 -0.54 -3.72 0.00 0.00 177.10 173.34 1q87 s LYS 298 N -1.34 2.75 0.57 0.43 -0.14 0.12 -4.82 119.74 117.31 1q87 s LYS 298 Ca 0.42 -1.47 0.29 0.00 -1.36 0.00 0.00 55.97 53.85 1q87 s LYS 298 Cb -0.24 -3.95 1.47 0.00 -1.68 0.00 0.00 37.83 33.42 1q87 s LYS 298 CO 0.29 -1.03 1.91 -1.35 -0.76 0.00 0.00 175.35 174.42 1q87 h PRO 299 N 8.57 0.00 0.00 -1.68 0.11 -1.82 -2.27 132.00 134.90 1q87 h PRO 299 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1q87 h PRO 299 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1q87 h PRO 299 CO 0.83 0.00 -0.94 1.28 -0.21 0.00 0.00 178.00 178.96 1q87 n LEU 300 N -3.98 0.80 -4.62 2.35 4.77 -1.26 -1.00 117.00 114.07 1q87 n LEU 300 Ca 0.11 0.28 -0.39 0.00 -0.03 0.00 0.00 56.01 55.99 1q87 n LEU 300 Cb 0.74 -0.09 -0.09 0.00 -2.33 0.00 0.00 43.42 41.65 1q87 n LEU 300 CO 0.32 -0.15 0.05 -0.63 -1.33 0.00 0.00 177.39 175.66 1q87 s ILE 301 N -3.32 5.19 1.02 -0.08 1.09 -0.86 -4.79 121.20 119.46 1q87 s ILE 301 Ca 0.01 0.56 -0.12 0.00 -1.10 0.00 0.00 60.65 60.00 1q87 s ILE 301 Cb 0.11 -3.69 0.20 0.00 -1.06 0.00 0.00 42.46 38.02 1q87 s ILE 301 CO 0.78 0.19 1.08 -1.61 -0.10 0.00 0.00 174.94 175.27 1q87 s GLU 302 N 1.88 0.24 0.58 2.79 2.02 -1.26 -4.39 118.70 120.57 1q87 s GLU 302 Ca 0.15 0.92 0.38 0.00 0.02 0.00 0.00 54.97 56.44 1q87 s GLU 302 Cb -0.15 -1.68 2.09 0.00 0.10 0.00 0.00 34.13 34.48 1q87 s GLU 302 CO 0.09 -2.96 2.18 0.00 0.02 0.00 0.00 175.26 174.59 1q87 h ALA 303 N -2.08 1.02 0.00 5.21 0.00 -1.92 -1.21 119.26 120.27 1q87 h ALA 303 Ca -0.54 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.16 1q87 h ALA 303 Cb 1.31 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 1q87 h ALA 303 CO 0.51 -0.02 -1.09 1.79 0.00 0.00 0.00 179.25 180.44 1q87 h THR 304 N 0.00 1.47 -2.81 0.00 1.35 -1.91 -3.46 112.91 107.55 1q87 h THR 304 Ca 0.00 -3.17 -0.20 0.00 -0.55 0.00 0.00 66.41 62.49 1q87 h THR 304 Cb 0.03 2.72 0.08 0.00 -1.73 0.00 0.00 68.15 69.25 1q87 h THR 304 CO 0.00 0.84 0.18 0.61 -0.25 0.00 0.00 175.52 176.90 1q87 n GLY 305 N 1.38 -1.39 3.39 5.82 0.00 -0.46 -4.98 105.19 108.96 1q87 n GLY 305 Ca -0.03 -1.67 -0.44 0.00 0.00 0.00 0.00 46.02 43.87 1q87 n GLY 305 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q87 s GLN 306 N -4.32 3.08 0.00 1.61 -0.21 -1.26 -4.81 119.66 113.75 1q87 s GLN 306 Ca 0.34 -1.24 0.18 0.00 0.02 0.00 0.00 55.36 54.66 1q87 s GLN 306 Cb -0.01 -4.28 0.52 0.00 1.00 0.00 0.00 33.01 30.24 1q87 s GLN 306 CO 0.24 -1.61 1.42 2.48 -2.12 0.00 0.00 175.29 175.70 1q87 n TYR 307 N 6.63 0.48 -5.19 0.91 0.18 -1.21 -4.77 117.16 114.20 1q87 n TYR 307 Ca -0.07 -0.24 -0.31 0.00 1.88 0.00 0.00 57.90 59.16 1q87 n TYR 307 Cb 0.43 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 39.23 1q87 n TYR 307 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1q87 s LEU 308 N -1.25 2.04 -0.02 -3.48 1.43 -1.19 0.12 118.68 116.33 1q87 s LEU 308 Ca 0.33 -0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1q87 s LEU 308 Cb 0.18 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 45.10 1q87 s LEU 308 CO 0.24 0.22 0.06 -0.32 0.23 0.00 0.00 176.35 176.78 1q87 s MET 309 N -0.04 0.04 0.43 1.70 1.75 -0.62 -0.12 119.30 122.42 1q87 s MET 309 Ca -0.06 0.14 0.03 0.00 -1.25 0.00 0.00 55.69 54.55 1q87 s MET 309 Cb -0.14 -0.07 0.08 0.00 2.84 0.00 0.00 34.83 37.54 1q87 s MET 309 CO 0.04 -0.07 0.59 -0.40 -0.65 0.00 0.00 175.02 174.53 1q87 n ASP 310 N 3.48 1.13 0.28 1.11 3.85 -0.68 -1.25 116.55 124.47 1q87 n ASP 310 Ca -0.18 -1.87 0.16 0.00 -0.71 0.00 0.00 54.79 52.19 1q87 n ASP 310 Cb 0.56 -0.35 0.80 0.00 -1.35 0.00 0.00 41.12 40.78 1q87 n ASP 310 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 1q87 h GLU 311 N 0.00 0.00 0.00 0.11 9.09 -1.90 -1.57 114.58 120.31 1q87 h GLU 311 Ca -0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.21 1q87 h GLU 311 Cb 0.81 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.91 1q87 h GLU 311 CO 0.24 0.06 -0.26 -0.91 0.05 0.00 0.00 179.01 178.19 1q87 h ASN 312 N 0.00 0.00 0.00 3.06 -0.26 -1.97 -3.47 115.58 112.94 1q87 h ASN 312 Ca -0.00 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.69 1q87 h ASN 312 Cb 0.36 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.62 1q87 h ASN 312 CO 0.01 0.02 0.00 0.61 -1.06 0.00 0.00 177.43 177.01 1q87 n GLY 313 N 1.24 0.35 3.75 2.83 0.00 -0.59 -5.05 105.19 107.72 1q87 n GLY 313 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1q87 n GLY 313 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q87 s GLU 314 N -0.91 4.31 0.20 1.61 0.41 -1.26 -4.76 118.70 118.29 1q87 s GLU 314 Ca 0.00 2.24 0.02 0.00 -0.41 0.00 0.00 54.97 56.83 1q87 s GLU 314 Cb 0.00 -3.11 -0.04 0.00 -1.78 0.00 0.00 34.13 29.21 1q87 s GLU 314 CO 0.00 -0.32 0.35 0.15 -0.49 0.00 0.00 175.26 174.95 1q87 s LYS 315 N -0.84 3.46 0.06 1.61 1.02 -1.26 -1.69 119.74 122.11 1q87 s LYS 315 Ca 0.55 -0.56 0.03 0.00 0.02 0.00 0.00 55.97 56.01 1q87 s LYS 315 Cb -0.40 -2.89 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 1q87 s LYS 315 CO 0.46 0.44 -0.08 0.71 -0.92 0.00 0.00 175.35 175.96 1q87 s TYR 316 N -1.88 0.82 0.16 3.18 2.02 0.82 -4.94 117.35 117.53 1q87 s TYR 316 Ca 0.36 -0.61 -0.10 0.00 -0.37 0.00 0.00 57.07 56.34 1q87 s TYR 316 Cb -0.10 -0.48 0.00 0.00 -0.40 0.00 0.00 41.96 40.98 1q87 s TYR 316 CO 0.29 -0.08 1.54 -0.44 -1.57 0.00 0.00 175.55 175.30 1q87 h ASP 317 N 4.00 1.03 -5.38 2.29 3.32 -1.89 -3.15 116.42 116.64 1q87 h ASP 317 Ca -0.36 -0.40 0.16 0.00 0.02 0.00 0.00 57.03 56.45 1q87 h ASP 317 Cb 1.19 -0.29 -0.05 0.00 0.22 0.00 0.00 39.33 40.41 1q87 h ASP 317 CO 0.48 1.20 0.55 -0.94 -1.72 0.00 0.00 179.24 178.81 1q87 s SER 318 N -6.74 -0.05 0.17 6.45 1.04 -1.26 -3.88 113.70 109.43 1q87 s SER 318 Ca -0.11 -0.61 -0.13 0.00 0.48 0.00 0.00 55.95 55.58 1q87 s SER 318 Cb 0.12 0.50 0.07 0.00 0.10 0.00 0.00 66.02 66.82 1q87 s SER 318 CO 0.87 -0.98 1.80 -0.50 0.98 0.00 0.00 173.24 175.41 1q87 h TRP 319 N 2.00 0.75 -0.07 5.02 4.06 -1.93 -0.08 115.95 125.71 1q87 h TRP 319 Ca -0.27 -0.01 0.02 0.00 2.06 0.00 0.00 58.89 60.70 1q87 h TRP 319 Cb 1.22 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 29.11 1q87 h TRP 319 CO 1.04 0.53 -0.07 -0.44 -3.56 0.00 0.00 178.44 175.94 1q87 h ASP 320 N 0.76 -0.21 -0.11 -3.49 3.32 -1.96 0.61 116.42 115.34 1q87 h ASP 320 Ca 0.20 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.30 1q87 h ASP 320 Cb 0.01 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1q87 h ASP 320 CO -0.04 -0.10 0.03 0.50 -1.72 0.00 0.00 179.24 177.92 1q87 h LYS 321 N -0.09 0.08 -0.06 3.56 3.64 -1.90 -1.45 116.57 120.36 1q87 h LYS 321 Ca 0.05 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1q87 h LYS 321 Cb 0.16 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1q87 h LYS 321 CO -0.12 0.06 -0.01 -0.92 -2.27 0.00 0.00 179.45 176.19 1q87 h TYR 322 N 0.09 -0.01 0.00 1.91 5.03 -0.61 -1.36 116.97 122.02 1q87 h TYR 322 Ca 0.05 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.36 1q87 h TYR 322 Cb 0.03 0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.32 1q87 h TYR 322 CO -0.10 -0.01 0.00 1.19 -1.32 0.00 0.00 178.16 177.91 1q87 n PHE 323 N -5.11 0.00 -0.02 -3.82 3.72 0.17 -1.39 117.46 111.01 1q87 n PHE 323 Ca -0.06 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.13 1q87 n PHE 323 Cb 0.05 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.46 1q87 n PHE 323 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1q87 h GLU 324 N 0.00 0.20 -0.00 -1.08 4.81 -0.21 -3.26 114.58 115.04 1q87 h GLU 324 Ca 0.00 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 1q87 h GLU 324 Cb 0.00 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1q87 h GLU 324 CO 0.00 1.16 -0.17 -1.33 -0.73 0.00 0.00 179.01 177.94 1q87 n MET 325 N -3.76 0.54 -3.04 1.92 2.81 -0.71 -4.36 117.12 110.52 1q87 n MET 325 Ca -0.32 -0.22 -0.18 0.00 -1.81 0.00 0.00 57.70 55.18 1q87 n MET 325 Cb 0.95 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.94 1q87 n MET 325 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1q87 n LYS 326 N -1.04 0.78 -1.53 0.03 4.76 -0.48 -5.10 118.16 115.58 1q87 n LYS 326 Ca 0.12 -2.74 -0.41 0.00 -2.87 0.00 0.00 58.31 52.41 1q87 n LYS 326 Cb 0.30 -1.33 0.01 0.00 -1.84 0.00 0.00 35.03 32.17 1q87 n LYS 326 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1q87 n PRO 327 N 1.27 0.92 -0.03 1.97 -0.02 -1.23 -4.61 135.00 133.28 1q87 n PRO 327 Ca 0.17 0.33 -0.12 0.00 -2.02 0.00 0.00 63.50 61.86 1q87 n PRO 327 Cb 0.58 -1.78 -0.07 0.00 -0.02 0.00 0.00 33.50 32.21 1q87 n PRO 327 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1q87 h ILE 328 N 1.08 1.24 -3.66 4.25 6.09 -1.97 -3.41 117.51 121.12 1q87 h ILE 328 Ca -0.43 -0.74 -0.50 0.00 -1.37 0.00 0.00 64.86 61.82 1q87 h ILE 328 Cb 1.37 1.56 -0.03 0.00 0.47 0.00 0.00 36.82 40.19 1q87 h ILE 328 CO 0.54 0.21 0.19 -1.61 -3.07 0.00 0.00 178.15 174.40 1q87 s GLU 329 N -5.05 4.37 -0.01 2.19 0.41 -1.26 -4.62 118.70 114.73 1q87 s GLU 329 Ca -0.14 1.03 -0.12 0.00 -0.41 0.00 0.00 54.97 55.33 1q87 s GLU 329 Cb 0.05 -2.88 -0.06 0.00 -1.78 0.00 0.00 34.13 29.45 1q87 s GLU 329 CO 0.70 0.37 0.70 1.79 -0.49 0.00 0.00 175.26 178.33 1q87 h THR 330 N 2.74 0.00 -3.75 3.63 1.35 -2.00 -3.47 112.91 111.40 1q87 h THR 330 Ca -0.47 -0.27 -0.52 0.00 -0.55 0.00 0.00 66.41 64.59 1q87 h THR 330 Cb 1.19 0.00 0.21 0.00 -1.73 0.00 0.00 68.15 67.82 1q87 h THR 330 CO 0.65 0.00 -0.23 0.00 -0.25 0.00 0.00 175.52 175.70 1q87 n TYR 331 N -3.88 -0.44 -1.71 4.73 4.11 -1.26 -4.95 117.16 113.75 1q87 n TYR 331 Ca -0.05 0.29 -0.43 0.00 -0.00 0.00 0.00 57.90 57.71 1q87 n TYR 331 Cb 0.17 -1.87 -0.03 0.00 -0.00 0.00 0.00 39.34 37.60 1q87 n TYR 331 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.86 176.75 1q87 n LEU 332 N -2.70 3.79 0.00 -3.48 -0.00 -1.26 -4.93 117.00 108.42 1q87 n LEU 332 Ca 0.09 1.08 0.00 0.00 -0.00 0.00 0.00 56.01 57.18 1q87 n LEU 332 Cb 0.53 -1.54 0.00 0.00 -0.00 0.00 0.00 43.42 42.41 1q87 n LEU 332 CO 0.50 0.04 0.36 0.35 -0.00 0.00 0.00 177.39 178.65 1q87 n THR 333 N 3.59 0.47 -3.53 1.96 -2.24 -1.26 -5.03 114.28 108.24 1q87 n THR 333 Ca 0.15 -0.71 -0.33 0.00 -2.27 0.00 0.00 64.05 60.90 1q87 n THR 333 Cb 0.33 0.79 -0.05 0.00 -2.10 0.00 0.00 70.33 69.30 1q87 n THR 333 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1q87 s ALA 334 N -0.47 3.68 -0.19 6.98 0.00 -1.26 -5.09 121.76 125.41 1q87 s ALA 334 Ca 0.00 -0.38 -0.18 0.00 0.00 0.00 0.00 51.96 51.40 1q87 s ALA 334 Cb 0.00 -2.30 0.05 0.00 0.00 0.00 0.00 23.12 20.87 1q87 s ALA 334 CO 0.00 0.57 0.51 -0.47 0.00 0.00 0.00 175.76 176.37 1q87 s TYR 335 N -1.65 -0.56 0.43 0.00 5.04 -1.26 -5.14 117.35 114.21 1q87 s TYR 335 Ca 0.42 1.36 -0.25 0.00 -2.44 0.00 0.00 57.07 56.16 1q87 s TYR 335 Cb -0.12 0.19 -0.08 0.00 0.35 0.00 0.00 41.96 42.30 1q87 s TYR 335 CO 0.22 -0.27 1.26 -2.14 -1.34 0.00 0.00 175.55 173.28 1q87 s PRO 336 N 0.26 3.83 -0.12 4.97 0.02 -1.26 -5.02 135.00 137.68 1q87 s PRO 336 Ca -0.00 2.04 -0.00 0.00 0.02 0.00 0.00 61.00 63.06 1q87 s PRO 336 Cb -0.04 -2.61 0.02 0.00 0.02 0.00 0.00 34.50 31.90 1q87 s PRO 336 CO 0.01 -0.57 -0.09 0.95 -0.33 0.00 0.00 177.00 176.97 1q87 s THR 337 N -1.35 1.15 -0.29 0.99 -4.23 -1.26 -5.03 115.64 105.62 1q87 s THR 337 Ca 0.60 -0.37 0.03 0.00 -1.18 0.00 0.00 61.69 60.77 1q87 s THR 337 Cb -0.35 -1.14 0.36 0.00 1.34 0.00 0.00 72.50 72.71 1q87 s THR 337 CO 0.44 0.39 1.43 0.49 -0.54 0.00 0.00 174.62 176.83 1q87 n PHE 338 N 4.87 1.52 -4.62 3.99 3.72 -1.26 -4.89 117.46 120.79 1q87 n PHE 338 Ca -0.14 -1.08 -0.29 0.00 -0.05 0.00 0.00 57.45 55.89 1q87 n PHE 338 Cb 0.50 -0.57 -0.14 0.00 -0.94 0.00 0.00 39.48 38.33 1q87 n PHE 338 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1q87 s ALA 339 N -1.75 2.29 0.65 4.37 0.00 -1.26 -5.12 121.76 120.94 1q87 s ALA 339 Ca 0.29 -1.37 -0.17 0.00 0.00 0.00 0.00 51.96 50.72 1q87 s ALA 339 Cb 0.24 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 1q87 s ALA 339 CO 0.06 0.53 1.19 -2.14 0.00 0.00 0.00 175.76 175.40 1q87 s PRO 340 N -1.68 2.69 0.26 0.00 0.02 -1.26 -4.92 135.00 130.12 1q87 s PRO 340 Ca 0.13 1.72 -0.01 0.00 0.02 0.00 0.00 61.00 62.86 1q87 s PRO 340 Cb -0.10 -1.90 0.55 0.00 0.02 0.00 0.00 34.50 33.06 1q87 s PRO 340 CO 0.04 -1.40 1.74 0.52 -0.33 0.00 0.00 177.00 177.57 1q87 h MET 341 N 0.37 0.51 0.00 5.54 2.86 -1.99 -0.42 114.93 121.80 1q87 h MET 341 Ca -0.49 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.12 1q87 h MET 341 Cb 1.29 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.83 1q87 h MET 341 CO 0.53 0.34 0.00 0.72 1.06 0.00 0.00 176.91 179.56 1q87 n HIS 342 N -4.95 0.00 0.73 -0.22 8.25 -1.26 -1.96 115.22 115.81 1q87 n HIS 342 Ca 0.17 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.74 1q87 n HIS 342 Cb 0.47 -0.23 0.47 0.00 1.12 0.00 0.00 29.99 31.83 1q87 n HIS 342 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1q87 n HIS 343 N -1.23 0.19 0.45 4.41 -0.00 -0.17 -5.27 115.22 113.60 1q87 n HIS 343 Ca 0.09 0.06 0.05 0.00 -0.00 0.00 0.00 57.72 57.93 1q87 n HIS 343 Cb 0.12 -0.60 0.04 0.00 -0.00 0.00 0.00 29.99 29.56 1q87 n HIS 343 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95