#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xn0 h ASP 164 N 0.00 0.00 0.25 -1.84 3.32 -2.00 -3.28 116.42 112.88 1xn0 h ASP 164 Ca 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 1xn0 h ASP 164 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1xn0 h ASP 164 CO 0.00 0.56 -0.48 0.45 -1.72 0.00 0.00 179.24 178.05 1xn0 h HIS 165 N 0.00 0.33 -0.09 4.55 3.86 -1.99 -2.07 115.15 119.74 1xn0 h HIS 165 Ca -0.04 -0.10 -0.03 0.00 -1.16 0.00 0.00 60.37 59.04 1xn0 h HIS 165 Cb 1.46 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 29.86 1xn0 h HIS 165 CO 0.00 0.71 -0.05 1.25 0.86 0.00 0.00 177.93 180.70 1xn0 h LEU 166 N 0.22 0.20 -1.05 2.43 5.85 -1.90 -2.23 115.31 118.82 1xn0 h LEU 166 Ca 0.01 -0.43 -0.04 0.00 0.84 0.00 0.00 57.88 58.26 1xn0 h LEU 166 Cb 0.93 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 1xn0 h LEU 166 CO 0.08 0.58 0.23 0.00 -0.34 0.00 0.00 178.44 178.99 1xn0 h ALA 167 N 0.62 1.25 -0.28 1.25 0.00 -1.60 -0.76 119.26 119.74 1xn0 h ALA 167 Ca 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1xn0 h ALA 167 Cb 0.51 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1xn0 h ALA 167 CO 0.01 0.55 0.10 -0.22 0.00 0.00 0.00 179.25 179.69 1xn0 h LYS 168 N 0.89 0.43 -0.46 0.00 3.64 -1.35 -2.84 116.57 116.88 1xn0 h LYS 168 Ca 0.21 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1xn0 h LYS 168 Cb 0.20 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 1xn0 h LYS 168 CO -0.02 0.47 0.29 1.49 -2.27 0.00 0.00 179.45 179.42 1xn0 h GLU 169 N 0.29 0.61 0.00 1.90 4.57 -0.97 -2.68 114.58 118.30 1xn0 h GLU 169 Ca 0.09 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1xn0 h GLU 169 Cb 0.22 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1xn0 h GLU 169 CO -0.00 0.43 0.00 1.28 -1.18 0.00 0.00 179.01 179.53 1xn0 n LEU 170 N -4.75 0.00 0.26 1.64 4.77 -0.33 -2.00 117.00 116.59 1xn0 n LEU 170 Ca 0.01 0.49 0.08 0.00 -0.03 0.00 0.00 56.01 56.56 1xn0 n LEU 170 Cb 0.04 -0.49 0.64 0.00 -2.33 0.00 0.00 43.42 41.28 1xn0 n LEU 170 CO 0.35 -0.34 1.06 -0.33 -1.33 0.00 0.00 177.39 176.81 1xn0 h GLU 171 N 0.00 0.00 -0.87 3.23 5.08 -1.23 -1.31 114.58 119.47 1xn0 h GLU 171 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1xn0 h GLU 171 Cb 0.15 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1xn0 h GLU 171 CO 0.00 0.01 0.05 -0.25 -1.00 0.00 0.00 179.01 177.82 1xn0 n ASP 172 N -4.52 2.95 -0.33 1.42 8.00 -0.85 -4.61 116.55 118.62 1xn0 n ASP 172 Ca -0.03 -2.42 0.08 0.00 0.71 0.00 0.00 54.79 53.14 1xn0 n ASP 172 Cb 0.10 -0.59 0.25 0.00 -0.02 0.00 0.00 41.12 40.86 1xn0 n ASP 172 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1xn0 h LEU 173 N 1.46 0.70 -1.56 0.64 5.85 -1.43 -1.93 115.31 119.05 1xn0 h LEU 173 Ca 0.05 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1xn0 h LEU 173 Cb 1.21 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1xn0 h LEU 173 CO 0.24 0.31 0.00 0.59 -0.34 0.00 0.00 178.44 179.24 1xn0 n ASN 174 N -4.78 2.28 -4.44 1.25 3.02 -1.26 -4.86 115.26 106.47 1xn0 n ASN 174 Ca 0.19 -2.12 -0.27 0.00 -0.03 0.00 0.00 54.58 52.36 1xn0 n ASN 174 Cb 0.44 -0.33 -0.11 0.00 -0.61 0.00 0.00 39.78 39.17 1xn0 n ASN 174 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xn0 s LYS 175 N -1.60 1.57 0.43 3.52 1.02 -0.73 -4.87 119.74 119.07 1xn0 s LYS 175 Ca 0.25 -1.51 0.19 0.00 0.02 0.00 0.00 55.97 54.91 1xn0 s LYS 175 Cb 0.14 -1.87 0.96 0.00 -0.52 0.00 0.00 37.83 36.54 1xn0 s LYS 175 CO 0.14 0.40 1.90 2.35 -0.92 0.00 0.00 175.35 179.22 1xn0 h TRP 176 N 3.14 0.00 0.00 3.18 -0.00 -1.91 -2.89 115.95 117.47 1xn0 h TRP 176 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.43 1xn0 h TRP 176 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.37 1xn0 h TRP 176 CO 0.69 0.28 0.00 0.41 -0.00 0.00 0.00 178.44 179.82 1xn0 n GLY 177 N -0.42 -0.99 3.71 2.65 0.00 -1.26 -4.88 105.19 104.00 1xn0 n GLY 177 Ca -0.02 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1xn0 n GLY 177 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xn0 n LEU 178 N -0.86 4.54 -4.15 0.99 7.94 -1.09 -4.97 117.00 119.40 1xn0 n LEU 178 Ca 0.17 1.03 -0.38 0.00 -1.11 0.00 0.00 56.01 55.72 1xn0 n LEU 178 Cb 0.08 -1.52 -0.10 0.00 0.53 0.00 0.00 43.42 42.41 1xn0 n LEU 178 CO 0.13 -0.76 -0.09 0.21 -1.11 0.00 0.00 177.39 175.76 1xn0 s ASN 179 N -0.75 5.40 0.44 1.96 3.84 -1.26 -4.96 114.94 119.62 1xn0 s ASN 179 Ca 0.66 -2.11 0.21 0.00 0.21 0.00 0.00 52.86 51.83 1xn0 s ASN 179 Cb -0.46 -1.89 1.05 0.00 -0.55 0.00 0.00 41.25 39.40 1xn0 s ASN 179 CO 0.54 -0.57 1.93 -0.29 -2.79 0.00 0.00 177.10 175.91 1xn0 h ILE 180 N 6.15 0.86 -0.65 -5.21 6.09 -1.98 -2.47 117.51 120.29 1xn0 h ILE 180 Ca -0.14 -0.94 -0.05 0.00 -1.37 0.00 0.00 64.86 62.36 1xn0 h ILE 180 Cb 1.04 1.56 -0.03 0.00 0.47 0.00 0.00 36.82 39.87 1xn0 h ILE 180 CO 0.75 0.24 0.20 -0.26 -3.07 0.00 0.00 178.15 176.00 1xn0 h PHE 181 N 0.00 1.06 -0.69 2.19 0.04 -1.96 -1.54 116.94 116.04 1xn0 h PHE 181 Ca -0.00 -0.11 -0.06 0.00 2.80 0.00 0.00 57.97 60.59 1xn0 h PHE 181 Cb 0.54 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 1xn0 h PHE 181 CO 0.00 0.86 0.18 -0.91 -0.60 0.00 0.00 178.31 177.84 1xn0 h ASN 182 N 0.95 1.04 -0.28 2.17 2.35 -1.88 -2.17 115.58 117.76 1xn0 h ASN 182 Ca 0.21 -0.23 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 1xn0 h ASN 182 Cb 0.30 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 1xn0 h ASN 182 CO -0.01 1.00 -0.14 -0.37 -1.65 0.00 0.00 177.43 176.27 1xn0 h VAL 183 N 1.03 1.26 0.07 2.81 -1.51 -1.23 -2.79 116.25 115.89 1xn0 h VAL 183 Ca 0.22 -1.18 0.02 0.00 -1.23 0.00 0.00 66.70 64.53 1xn0 h VAL 183 Cb 0.36 1.10 -0.03 0.00 -2.13 0.00 0.00 31.29 30.59 1xn0 h VAL 183 CO 0.00 0.40 -0.21 0.00 -1.23 0.00 0.00 177.57 176.53 1xn0 h ALA 184 N 1.21 -0.32 -1.00 5.19 0.00 -0.99 -2.66 119.26 120.68 1xn0 h ALA 184 Ca 0.11 -0.02 0.22 0.00 0.00 0.00 0.00 54.91 55.22 1xn0 h ALA 184 Cb 0.60 0.34 -0.10 0.00 0.00 0.00 0.00 17.79 18.63 1xn0 h ALA 184 CO 0.04 -0.73 0.62 0.78 0.00 0.00 0.00 179.25 179.96 1xn0 h GLY 185 N -0.37 1.60 -2.69 0.00 0.00 -1.14 -2.09 103.07 98.38 1xn0 h GLY 185 Ca 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1xn0 h GLY 185 CO -0.14 -0.12 0.00 -1.72 0.00 0.00 0.00 176.54 174.56 1xn0 n TYR 186 N -4.74 1.25 -1.70 5.60 4.01 -1.03 -4.37 117.16 116.18 1xn0 n TYR 186 Ca 0.24 -0.50 0.04 0.00 -0.16 0.00 0.00 57.90 57.52 1xn0 n TYR 186 Cb 0.69 -0.20 0.07 0.00 -0.31 0.00 0.00 39.34 39.59 1xn0 n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1xn0 n SER 187 N 1.00 1.04 -3.33 7.72 3.41 -0.80 -4.57 113.62 118.08 1xn0 n SER 187 Ca 0.22 -2.52 -0.20 0.00 -0.26 0.00 0.00 58.87 56.11 1xn0 n SER 187 Cb 0.76 -0.31 0.08 0.00 -0.26 0.00 0.00 64.21 64.47 1xn0 n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1xn0 n HIS 188 N -0.53 -2.48 -4.05 7.33 8.25 -1.25 -2.28 115.22 120.21 1xn0 n HIS 188 Ca 0.08 0.92 -0.28 0.00 -0.26 0.00 0.00 57.72 58.18 1xn0 n HIS 188 Cb 0.72 -4.78 -0.03 0.00 1.12 0.00 0.00 29.99 27.01 1xn0 n HIS 188 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1xn0 n ASN 189 N -2.77 -0.53 -2.66 0.41 5.15 -1.13 -4.92 115.26 108.81 1xn0 n ASN 189 Ca -0.08 -1.05 -0.24 0.00 -0.60 0.00 0.00 54.58 52.61 1xn0 n ASN 189 Cb 0.59 -2.79 -0.01 0.00 -0.53 0.00 0.00 39.78 37.04 1xn0 n ASN 189 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1xn0 n ARG 190 N -4.43 2.97 -0.30 1.20 1.74 -0.97 -4.93 116.66 111.94 1xn0 n ARG 190 Ca -0.26 -4.39 0.05 0.00 -0.77 0.00 0.00 57.85 52.48 1xn0 n ARG 190 Cb 0.66 -2.10 0.20 0.00 -1.02 0.00 0.00 32.46 30.20 1xn0 n ARG 190 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1xn0 h PRO 191 N 2.76 0.75 -0.22 5.56 0.13 -1.85 -2.91 132.00 136.22 1xn0 h PRO 191 Ca 0.20 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.24 1xn0 h PRO 191 Cb 0.84 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1xn0 h PRO 191 CO 0.78 0.50 -0.01 1.25 -0.23 0.00 0.00 178.00 180.29 1xn0 h LEU 192 N 0.77 0.39 -0.62 1.56 5.85 -1.92 -0.45 115.31 120.88 1xn0 h LEU 192 Ca 0.43 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1xn0 h LEU 192 Cb 0.47 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1xn0 h LEU 192 CO -0.28 0.61 0.00 0.41 -0.34 0.00 0.00 178.44 178.83 1xn0 n THR 193 N -4.66 0.00 0.00 1.05 -1.04 -1.10 -1.52 114.28 107.01 1xn0 n THR 193 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1xn0 n THR 193 Cb 0.24 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.56 1xn0 n THR 193 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xn0 n ILE 195 N 0.12 0.00 -0.20 12.58 0.13 -0.18 -2.02 119.36 129.79 1xn0 n ILE 195 Ca 0.00 0.00 -0.09 0.00 -1.10 0.00 0.00 62.75 61.56 1xn0 n ILE 195 Cb 0.00 0.00 0.03 0.00 -0.84 0.00 0.00 39.64 38.83 1xn0 n ILE 195 CO 0.00 0.00 0.00 0.24 2.80 0.00 0.00 176.55 179.59 1xn0 h MET 196 N 0.00 1.05 -0.42 9.51 2.86 -1.50 0.18 114.93 126.61 1xn0 h MET 196 Ca 0.00 -0.35 -0.08 0.00 -2.06 0.00 0.00 59.70 57.22 1xn0 h MET 196 Cb 0.00 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1xn0 h MET 196 CO 0.00 1.04 -0.04 -0.92 1.06 0.00 0.00 176.91 178.05 1xn0 h TYR 197 N 0.95 0.85 -0.25 -0.22 3.20 -1.64 -1.40 116.97 118.46 1xn0 h TYR 197 Ca 0.16 -0.16 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1xn0 h TYR 197 Cb 0.59 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 1xn0 h TYR 197 CO 0.04 0.86 0.04 0.00 -1.64 0.00 0.00 178.16 177.46 1xn0 h ALA 198 N 0.87 0.33 -0.77 1.82 0.00 -1.75 -2.32 119.26 117.44 1xn0 h ALA 198 Ca 0.11 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.91 1xn0 h ALA 198 Cb 0.55 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1xn0 h ALA 198 CO 0.03 0.01 0.45 0.82 0.00 0.00 0.00 179.25 180.57 1xn0 h ILE 199 N 0.22 0.99 -0.14 0.00 2.04 -0.59 -1.41 117.51 118.61 1xn0 h ILE 199 Ca 0.08 -0.28 -0.17 0.00 1.00 0.00 0.00 64.86 65.48 1xn0 h ILE 199 Cb 0.32 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1xn0 h ILE 199 CO 0.00 0.15 -0.62 -0.26 0.00 0.00 0.00 178.15 177.42 1xn0 h PHE 200 N 0.82 0.66 -0.09 1.37 -1.00 -1.14 -2.30 116.94 115.26 1xn0 h PHE 200 Ca 0.35 -0.25 -0.02 0.00 2.81 0.00 0.00 57.97 60.85 1xn0 h PHE 200 Cb 0.20 -0.12 -0.00 0.00 3.61 0.00 0.00 35.95 39.65 1xn0 h PHE 200 CO -0.06 1.00 -0.04 1.96 -1.61 0.00 0.00 178.31 179.57 1xn0 h GLN 201 N 0.38 0.19 -1.00 1.51 4.20 -1.28 -0.73 115.11 118.37 1xn0 h GLN 201 Ca -0.01 -0.08 0.15 0.00 0.06 0.00 0.00 58.65 58.77 1xn0 h GLN 201 Cb 1.18 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 28.86 1xn0 h GLN 201 CO 0.11 0.53 0.62 1.49 -0.67 0.00 0.00 178.83 180.92 1xn0 h GLU 202 N -0.17 0.87 -0.02 1.46 4.57 -1.20 -2.19 114.58 117.90 1xn0 h GLU 202 Ca 0.02 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1xn0 h GLU 202 Cb 0.47 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1xn0 h GLU 202 CO 0.01 0.58 -0.05 0.54 -1.18 0.00 0.00 179.01 178.91 1xn0 n ARG 203 N -4.67 1.93 -1.98 1.92 1.74 -0.87 -4.95 116.66 109.77 1xn0 n ARG 203 Ca 0.21 -1.43 -0.19 0.00 -0.77 0.00 0.00 57.85 55.67 1xn0 n ARG 203 Cb 0.44 -1.47 -0.04 0.00 -1.02 0.00 0.00 32.46 30.37 1xn0 n ARG 203 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1xn0 n ASP 204 N 0.71 -5.40 -0.01 0.55 8.00 -0.41 -4.90 116.55 115.09 1xn0 n ASP 204 Ca 0.15 0.21 -0.03 0.00 0.71 0.00 0.00 54.79 55.83 1xn0 n ASP 204 Cb 0.49 -4.50 0.21 0.00 -0.02 0.00 0.00 41.12 37.29 1xn0 n ASP 204 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1xn0 h LEU 205 N 0.00 0.54 -0.88 0.64 3.38 -1.49 -1.54 115.31 115.96 1xn0 h LEU 205 Ca -0.42 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.40 1xn0 h LEU 205 Cb 1.29 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.85 1xn0 h LEU 205 CO 0.55 0.73 0.58 -0.07 0.09 0.00 0.00 178.44 180.32 1xn0 h LEU 206 N 0.50 0.99 -0.01 1.67 3.38 -1.87 -2.19 115.31 117.78 1xn0 h LEU 206 Ca 0.08 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1xn0 h LEU 206 Cb 0.58 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1xn0 h LEU 206 CO 0.04 0.71 -0.03 0.11 0.09 0.00 0.00 178.44 179.36 1xn0 h LYS 207 N 1.17 0.04 -0.85 1.13 1.57 -1.80 0.11 116.57 117.93 1xn0 h LYS 207 Ca 0.33 -0.03 0.13 0.00 -1.87 0.00 0.00 60.65 59.22 1xn0 h LYS 207 Cb -0.10 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.13 1xn0 h LYS 207 CO -0.08 0.67 0.46 1.15 -0.57 0.00 0.00 179.45 181.08 1xn0 h THR 208 N -0.59 0.78 -0.31 -0.16 2.02 -1.23 -2.15 112.91 111.26 1xn0 h THR 208 Ca -0.00 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1xn0 h THR 208 Cb 0.68 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1xn0 h THR 208 CO 0.01 0.12 0.00 0.49 0.37 0.00 0.00 175.52 176.51 1xn0 n PHE 209 N -4.83 1.02 -4.16 3.16 3.72 -0.83 -4.99 117.46 110.56 1xn0 n PHE 209 Ca 0.16 -0.82 -0.41 0.00 -0.05 0.00 0.00 57.45 56.34 1xn0 n PHE 209 Cb 0.40 -0.30 -0.02 0.00 -0.94 0.00 0.00 39.48 38.61 1xn0 n PHE 209 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1xn0 n ARG 210 N -0.24 -0.47 -3.50 -1.08 1.74 -0.77 -4.58 116.66 107.76 1xn0 n ARG 210 Ca 0.21 0.05 -0.38 0.00 -0.77 0.00 0.00 57.85 56.96 1xn0 n ARG 210 Cb 0.87 -2.76 -0.10 0.00 -1.02 0.00 0.00 32.46 29.46 1xn0 n ARG 210 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xn0 s ILE 211 N -3.85 5.25 0.44 0.55 1.01 -0.05 -4.66 121.20 119.89 1xn0 s ILE 211 Ca 0.31 0.36 -0.26 0.00 0.00 0.00 0.00 60.65 61.07 1xn0 s ILE 211 Cb -0.17 -3.61 -0.09 0.00 0.01 0.00 0.00 42.46 38.60 1xn0 s ILE 211 CO 0.96 0.21 1.43 -0.24 0.00 0.00 0.00 174.94 177.30 1xn0 n SER 212 N 5.16 3.34 -0.12 3.58 2.88 -1.26 -4.73 113.62 122.47 1xn0 n SER 212 Ca -0.11 1.13 -0.11 0.00 -1.33 0.00 0.00 58.87 58.45 1xn0 n SER 212 Cb 0.51 -1.60 -0.02 0.00 -0.75 0.00 0.00 64.21 62.35 1xn0 n SER 212 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1xn0 h SER 213 N 2.36 0.62 -0.05 -3.46 0.02 -1.97 -1.05 113.55 110.03 1xn0 h SER 213 Ca -0.51 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.12 1xn0 h SER 213 Cb 1.27 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.64 1xn0 h SER 213 CO 0.61 0.79 0.02 0.44 -1.14 0.00 0.00 176.83 177.55 1xn0 h ASP 214 N 0.43 0.03 -0.88 3.07 3.32 -1.99 -0.38 116.42 120.01 1xn0 h ASP 214 Ca 0.10 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.16 1xn0 h ASP 214 Cb 0.49 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.99 1xn0 h ASP 214 CO 0.02 0.02 0.58 0.74 -1.72 0.00 0.00 179.24 178.88 1xn0 h THR 215 N 0.04 1.23 -0.37 0.35 2.02 -1.87 -0.20 112.91 114.11 1xn0 h THR 215 Ca 0.02 -0.43 -0.13 0.00 0.77 0.00 0.00 66.41 66.64 1xn0 h THR 215 Cb 0.00 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.35 1xn0 h THR 215 CO -0.02 0.22 -0.28 0.15 0.37 0.00 0.00 175.52 175.97 1xn0 h PHE 216 N 1.20 1.01 -0.45 3.16 3.57 -0.99 -2.60 116.94 121.83 1xn0 h PHE 216 Ca 0.32 -0.28 -0.10 0.00 3.53 0.00 0.00 57.97 61.44 1xn0 h PHE 216 Cb -0.13 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 1xn0 h PHE 216 CO -0.01 1.07 -0.13 0.82 -2.23 0.00 0.00 178.31 177.83 1xn0 h ILE 217 N 0.65 1.27 -0.56 1.41 1.08 -0.64 -1.44 117.51 119.29 1xn0 h ILE 217 Ca 0.07 -1.25 -0.06 0.00 -0.39 0.00 0.00 64.86 63.23 1xn0 h ILE 217 Cb 0.86 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.73 1xn0 h ILE 217 CO 0.07 0.43 0.10 0.74 -0.69 0.00 0.00 178.15 178.80 1xn0 h THR 218 N 0.72 1.24 -0.05 -0.27 2.02 -1.02 0.19 112.91 115.73 1xn0 h THR 218 Ca 0.11 -0.90 -0.01 0.00 0.77 0.00 0.00 66.41 66.37 1xn0 h THR 218 Cb 0.68 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 67.79 1xn0 h THR 218 CO 0.05 0.33 -0.02 0.22 0.37 0.00 0.00 175.52 176.47 1xn0 h TYR 219 N 0.84 0.11 -0.82 3.16 3.20 -1.35 -2.02 116.97 120.10 1xn0 h TYR 219 Ca 0.18 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1xn0 h TYR 219 Cb 0.36 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 1xn0 h TYR 219 CO 0.02 0.49 0.35 0.52 -1.64 0.00 0.00 178.16 177.89 1xn0 h MET 220 N -0.29 1.21 -0.40 1.82 2.86 -1.07 0.71 114.93 119.77 1xn0 h MET 220 Ca 0.01 -0.21 -0.11 0.00 -2.06 0.00 0.00 59.70 57.33 1xn0 h MET 220 Cb 0.46 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1xn0 h MET 220 CO 0.01 0.96 -0.20 0.52 1.06 0.00 0.00 176.91 179.26 1xn0 h MET 221 N 1.18 0.78 -0.26 1.72 2.86 -0.95 -0.56 114.93 119.70 1xn0 h MET 221 Ca 0.28 -0.30 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 1xn0 h MET 221 Cb 0.19 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1xn0 h MET 221 CO -0.03 0.92 -0.15 1.15 1.06 0.00 0.00 176.91 179.86 1xn0 h THR 222 N 0.68 1.30 -0.63 2.22 2.02 -1.08 -1.42 112.91 116.01 1xn0 h THR 222 Ca 0.10 -1.26 0.03 0.00 0.77 0.00 0.00 66.41 66.05 1xn0 h THR 222 Cb 0.71 1.57 -0.04 0.00 -1.74 0.00 0.00 68.15 68.65 1xn0 h THR 222 CO 0.05 0.39 0.39 0.25 0.37 0.00 0.00 175.52 176.98 1xn0 h LEU 223 N 0.28 0.65 -0.70 2.58 5.85 -0.72 -2.29 115.31 120.96 1xn0 h LEU 223 Ca 0.05 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 1xn0 h LEU 223 Cb 0.67 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1xn0 h LEU 223 CO 0.04 0.45 -0.16 -0.08 -0.34 0.00 0.00 178.44 178.35 1xn0 h GLU 224 N 0.77 0.83 0.00 1.25 4.81 -1.02 -2.03 114.58 119.20 1xn0 h GLU 224 Ca 0.25 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1xn0 h GLU 224 Cb 0.01 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1xn0 h GLU 224 CO -0.10 0.94 0.00 -3.47 -0.73 0.00 0.00 179.01 175.65 1xn0 n ASP 225 N -4.14 0.67 0.09 1.04 2.03 -0.54 -1.74 116.55 113.96 1xn0 n ASP 225 Ca 0.01 0.69 0.12 0.00 0.52 0.00 0.00 54.79 56.13 1xn0 n ASP 225 Cb 0.41 -0.82 0.24 0.00 -0.72 0.00 0.00 41.12 40.22 1xn0 n ASP 225 CO 0.00 0.00 0.00 0.45 -1.92 0.00 0.00 177.20 175.73 1xn0 h HIS 226 N 0.00 0.00 -3.90 -0.67 3.86 -0.82 -3.44 115.15 110.18 1xn0 h HIS 226 Ca 0.00 0.00 -0.47 0.00 -1.16 0.00 0.00 60.37 58.74 1xn0 h HIS 226 Cb 0.30 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 1xn0 h HIS 226 CO 0.00 0.00 0.36 0.71 0.86 0.00 0.00 177.93 179.86 1xn0 s TYR 227 N -3.16 3.63 -0.20 2.45 1.51 -0.71 -2.07 117.35 118.79 1xn0 s TYR 227 Ca 0.07 1.76 -0.24 0.00 -1.01 0.00 0.00 57.07 57.66 1xn0 s TYR 227 Cb 0.12 -2.96 -0.02 0.00 -0.11 0.00 0.00 41.96 39.00 1xn0 s TYR 227 CO 0.68 0.08 0.77 -1.01 -1.11 0.00 0.00 175.55 174.96 1xn0 s HIS 228 N -1.62 3.37 0.07 2.71 3.76 -1.26 -4.81 115.29 117.51 1xn0 s HIS 228 Ca 0.51 1.12 0.30 0.00 -0.15 0.00 0.00 55.06 56.84 1xn0 s HIS 228 Cb -0.19 -2.96 1.14 0.00 1.11 0.00 0.00 32.58 31.68 1xn0 s HIS 228 CO 0.25 -0.27 1.90 0.66 -0.85 0.00 0.00 174.74 176.43 1xn0 h SER 229 N 7.48 0.00 -0.39 1.40 4.64 -1.93 -3.09 113.55 121.67 1xn0 h SER 229 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1xn0 h SER 229 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1xn0 h SER 229 CO 0.83 0.07 0.00 -0.90 -0.87 0.00 0.00 176.83 175.96 1xn0 n ASP 230 N -3.19 2.72 -4.58 4.97 5.68 -1.26 -4.81 116.55 116.09 1xn0 n ASP 230 Ca 0.01 -2.17 -0.34 0.00 -0.50 0.00 0.00 54.79 51.78 1xn0 n ASP 230 Cb 0.36 -0.39 -0.11 0.00 -1.14 0.00 0.00 41.12 39.85 1xn0 n ASP 230 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1xn0 s VAL 231 N -1.62 4.42 0.12 2.12 1.01 -1.17 -5.02 120.40 120.26 1xn0 s VAL 231 Ca 0.29 -0.17 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 1xn0 s VAL 231 Cb 0.18 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1xn0 s VAL 231 CO 0.16 0.48 1.50 0.00 0.00 0.00 0.00 175.10 177.24 1xn0 h ALA 232 N 6.67 0.52 0.00 5.51 0.00 -1.87 -3.37 119.26 126.73 1xn0 h ALA 232 Ca -0.35 -0.34 -0.23 0.00 0.00 0.00 0.00 54.91 53.99 1xn0 h ALA 232 Cb 1.18 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1xn0 h ALA 232 CO 0.67 0.43 -1.70 0.98 0.00 0.00 0.00 179.25 179.63 1xn0 n TYR 233 N -4.32 0.00 -1.17 0.00 9.36 -1.25 -4.75 117.16 115.04 1xn0 n TYR 233 Ca -0.02 0.00 -0.22 0.00 3.32 0.00 0.00 57.90 60.98 1xn0 n TYR 233 Cb 0.39 -0.63 -0.12 0.00 -0.63 0.00 0.00 39.34 38.35 1xn0 n TYR 233 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1xn0 n HIS 234 N -4.06 0.91 -3.20 2.98 8.25 -1.26 -4.34 115.22 114.49 1xn0 n HIS 234 Ca -0.31 -2.04 -0.05 0.00 -0.26 0.00 0.00 57.72 55.06 1xn0 n HIS 234 Cb 0.66 -1.84 0.01 0.00 1.12 0.00 0.00 29.99 29.94 1xn0 n HIS 234 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1xn0 n ASN 235 N 2.64 0.83 0.29 0.41 0.23 -1.26 -4.51 115.26 113.89 1xn0 n ASN 235 Ca 0.54 -1.42 0.19 0.00 -0.53 0.00 0.00 54.58 53.36 1xn0 n ASN 235 Cb 0.67 -0.08 0.82 0.00 -2.08 0.00 0.00 39.78 39.12 1xn0 n ASN 235 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1xn0 h SER 236 N 0.07 0.00 -0.52 0.53 4.64 -1.87 -2.69 113.55 113.71 1xn0 h SER 236 Ca -0.08 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.13 1xn0 h SER 236 Cb 0.32 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 1xn0 h SER 236 CO 0.11 0.00 -0.14 0.25 -0.87 0.00 0.00 176.83 176.18 1xn0 h LEU 237 N 0.00 1.03 -0.24 5.97 5.85 -1.95 -0.07 115.31 125.89 1xn0 h LEU 237 Ca 0.00 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1xn0 h LEU 237 Cb 0.36 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1xn0 h LEU 237 CO 0.00 1.15 0.13 -0.74 -0.34 0.00 0.00 178.44 178.64 1xn0 h HIS 238 N 0.89 0.33 -0.52 1.25 2.76 -1.67 -1.37 115.15 116.81 1xn0 h HIS 238 Ca 0.13 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1xn0 h HIS 238 Cb 0.71 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.53 1xn0 h HIS 238 CO 0.05 0.30 0.31 0.00 -1.30 0.00 0.00 177.93 177.29 1xn0 h ALA 239 N 1.01 0.67 -0.85 5.26 0.00 -1.51 -1.03 119.26 122.81 1xn0 h ALA 239 Ca 0.08 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1xn0 h ALA 239 Cb 0.08 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1xn0 h ALA 239 CO -0.01 0.02 0.56 0.00 0.00 0.00 0.00 179.25 179.81 1xn0 h ALA 240 N 1.23 1.49 -0.39 0.00 0.00 -0.75 -1.00 119.26 119.84 1xn0 h ALA 240 Ca 0.21 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 1xn0 h ALA 240 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1xn0 h ALA 240 CO -0.10 0.42 -0.38 0.22 0.00 0.00 0.00 179.25 179.42 1xn0 h ASP 241 N 1.04 1.00 0.01 0.00 3.58 -0.77 -1.04 116.42 120.24 1xn0 h ASP 241 Ca 0.34 -0.45 -0.17 0.00 0.42 0.00 0.00 57.03 57.17 1xn0 h ASP 241 Cb 0.06 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 40.83 1xn0 h ASP 241 CO -0.11 1.25 -0.57 0.58 -2.88 0.00 0.00 179.24 177.52 1xn0 h VAL 242 N 0.77 1.32 -0.21 2.25 2.07 -0.66 -0.61 116.25 121.17 1xn0 h VAL 242 Ca 0.06 -1.82 -0.02 0.00 0.82 0.00 0.00 66.70 65.74 1xn0 h VAL 242 Cb 0.97 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 1xn0 h VAL 242 CO 0.09 0.57 0.04 0.00 0.02 0.00 0.00 177.57 178.29 1xn0 h ALA 243 N 0.93 0.28 -0.72 1.67 0.00 -1.00 -1.12 119.26 119.31 1xn0 h ALA 243 Ca 0.00 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1xn0 h ALA 243 Cb 1.12 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1xn0 h ALA 243 CO 0.11 -0.05 0.18 0.37 0.00 0.00 0.00 179.25 179.85 1xn0 h GLN 244 N 0.15 1.15 -0.52 0.00 -0.00 -1.08 -1.53 115.11 113.28 1xn0 h GLN 244 Ca 0.07 -0.28 -0.06 0.00 -0.00 0.00 0.00 58.65 58.38 1xn0 h GLN 244 Cb 0.30 -0.15 -0.02 0.00 0.00 0.00 0.00 27.48 27.61 1xn0 h GLN 244 CO 0.00 1.01 0.09 0.77 0.00 0.00 0.00 178.83 180.70 1xn0 h SER 245 N 1.09 0.83 -0.52 -0.69 0.02 -1.03 -2.56 113.55 110.69 1xn0 h SER 245 Ca 0.23 -0.26 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 1xn0 h SER 245 Cb 0.37 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 1xn0 h SER 245 CO 0.00 0.87 0.09 0.74 -1.14 0.00 0.00 176.83 177.39 1xn0 h THR 246 N 0.75 1.24 -0.60 -2.27 2.02 -0.99 -1.66 112.91 111.40 1xn0 h THR 246 Ca 0.16 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.39 1xn0 h THR 246 Cb 0.39 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1xn0 h THR 246 CO 0.01 0.35 0.37 -0.74 0.37 0.00 0.00 175.52 175.88 1xn0 h HIS 247 N 0.86 0.78 0.01 3.16 -0.00 -1.02 -1.00 115.15 117.94 1xn0 h HIS 247 Ca 0.18 0.01 -0.24 0.00 -0.00 0.00 0.00 60.37 60.32 1xn0 h HIS 247 Cb 0.39 -0.26 0.02 0.00 -0.00 0.00 0.00 27.41 27.56 1xn0 h HIS 247 CO 0.02 0.51 -0.94 0.28 -0.00 0.00 0.00 177.93 177.81 1xn0 h VAL 248 N 0.82 1.32 -0.17 5.26 2.07 -1.06 -3.30 116.25 121.19 1xn0 h VAL 248 Ca 0.22 -2.21 -0.05 0.00 0.82 0.00 0.00 66.70 65.48 1xn0 h VAL 248 Cb -0.05 2.46 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1xn0 h VAL 248 CO -0.04 0.67 -0.12 -0.07 0.02 0.00 0.00 177.57 178.03 1xn0 h LEU 249 N 0.25 0.25 -1.64 2.57 3.38 -0.99 -1.85 115.31 117.27 1xn0 h LEU 249 Ca -0.12 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1xn0 h LEU 249 Cb 1.61 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.29 1xn0 h LEU 249 CO 0.18 0.40 -0.20 -0.07 0.09 0.00 0.00 178.44 178.85 1xn0 h LEU 250 N 0.26 0.00 -1.16 1.67 3.38 -1.27 -2.73 115.31 115.46 1xn0 h LEU 250 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1xn0 h LEU 250 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1xn0 h LEU 250 CO 0.02 0.20 0.00 -1.20 0.09 0.00 0.00 178.44 177.55 1xn0 n SER 251 N -3.84 1.72 -4.72 -0.43 7.64 -0.70 -4.79 113.62 108.51 1xn0 n SER 251 Ca -0.02 -1.78 -0.43 0.00 1.01 0.00 0.00 58.87 57.65 1xn0 n SER 251 Cb 0.30 -0.14 -0.02 0.00 -1.01 0.00 0.00 64.21 63.33 1xn0 n SER 251 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1xn0 n THR 252 N 0.38 0.84 -0.33 0.44 5.66 -1.03 -4.85 114.28 115.39 1xn0 n THR 252 Ca 0.15 -0.21 0.17 0.00 -3.05 0.00 0.00 64.05 61.11 1xn0 n THR 252 Cb 0.32 -1.79 0.41 0.00 -1.55 0.00 0.00 70.33 67.71 1xn0 n THR 252 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 1xn0 h PRO 253 N 4.87 0.58 0.00 1.09 0.11 -1.92 -1.37 132.00 135.36 1xn0 h PRO 253 Ca -0.46 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1xn0 h PRO 253 Cb 1.24 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1xn0 h PRO 253 CO 0.80 0.38 -0.07 0.00 -0.21 0.00 0.00 178.00 178.90 1xn0 h ALA 254 N 1.65 1.43 -0.68 -0.75 0.00 -1.83 -2.56 119.26 116.51 1xn0 h ALA 254 Ca 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1xn0 h ALA 254 Cb 1.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1xn0 h ALA 254 CO -0.34 0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.28 1xn0 n LEU 255 N -3.79 4.30 -4.68 0.00 4.77 -0.52 -1.66 117.00 115.42 1xn0 n LEU 255 Ca -0.02 -2.22 -0.45 0.00 -0.03 0.00 0.00 56.01 53.28 1xn0 n LEU 255 Cb 0.17 -0.52 -0.04 0.00 -2.33 0.00 0.00 43.42 40.70 1xn0 n LEU 255 CO 0.29 0.90 1.43 -0.67 -1.33 0.00 0.00 177.39 178.01 1xn0 n ASP 256 N 1.34 3.61 -0.70 -1.43 2.03 -0.97 -2.24 116.55 118.20 1xn0 n ASP 256 Ca 0.25 0.99 -0.09 0.00 0.52 0.00 0.00 54.79 56.46 1xn0 n ASP 256 Cb 0.74 -1.45 -0.04 0.00 -0.72 0.00 0.00 41.12 39.66 1xn0 n ASP 256 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xn0 n ALA 257 N 5.73 -0.14 0.06 -1.67 0.00 -1.26 -4.89 120.51 118.35 1xn0 n ALA 257 Ca 0.20 0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.67 1xn0 n ALA 257 Cb 0.33 -1.46 -0.13 0.00 0.00 0.00 0.00 19.45 18.18 1xn0 n ALA 257 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xn0 h VAL 258 N 0.00 1.46 -3.14 0.00 2.07 -1.82 -3.46 116.25 111.36 1xn0 h VAL 258 Ca -0.19 -3.14 -0.65 0.00 0.82 0.00 0.00 66.70 63.54 1xn0 h VAL 258 Cb 0.92 2.82 -0.10 0.00 -1.52 0.00 0.00 31.29 33.41 1xn0 h VAL 258 CO 0.27 0.87 -0.59 -0.36 0.02 0.00 0.00 177.57 177.79 1xn0 s PHE 259 N -2.67 3.25 0.91 1.57 0.08 -1.26 -5.01 117.98 114.86 1xn0 s PHE 259 Ca -0.03 0.17 -0.12 0.00 0.12 0.00 0.00 56.93 57.07 1xn0 s PHE 259 Cb 0.08 -1.71 0.14 0.00 -0.57 0.00 0.00 43.02 40.97 1xn0 s PHE 259 CO 0.84 0.54 1.11 0.95 -0.10 0.00 0.00 175.22 178.56 1xn0 s THR 260 N -1.23 2.29 0.35 0.64 -4.23 -1.26 -4.89 115.64 107.30 1xn0 s THR 260 Ca 0.24 0.10 0.06 0.00 -1.18 0.00 0.00 61.69 60.91 1xn0 s THR 260 Cb -0.12 -2.74 0.15 0.00 1.34 0.00 0.00 72.50 71.13 1xn0 s THR 260 CO 0.16 -0.13 1.87 0.44 -0.54 0.00 0.00 174.62 176.42 1xn0 h ASP 261 N -1.54 0.40 0.15 3.99 3.32 -2.00 -2.60 116.42 118.15 1xn0 h ASP 261 Ca -0.51 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 56.37 1xn0 h ASP 261 Cb 1.31 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1xn0 h ASP 261 CO 0.59 0.52 -0.31 0.25 -1.72 0.00 0.00 179.24 178.58 1xn0 h LEU 262 N 0.41 0.25 -0.34 1.55 5.85 -1.99 -1.48 115.31 119.56 1xn0 h LEU 262 Ca 0.08 -0.09 -0.19 0.00 0.84 0.00 0.00 57.88 58.53 1xn0 h LEU 262 Cb 0.38 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1xn0 h LEU 262 CO 0.02 0.56 -0.83 -0.33 -0.34 0.00 0.00 178.44 177.52 1xn0 h GLU 263 N 0.22 0.23 -0.08 1.25 5.08 -1.88 -1.29 114.58 118.11 1xn0 h GLU 263 Ca 0.03 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1xn0 h GLU 263 Cb 0.66 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1xn0 h GLU 263 CO 0.05 0.94 -0.05 0.82 -1.00 0.00 0.00 179.01 179.76 1xn0 h ILE 264 N 0.14 1.34 -0.18 3.13 2.04 -1.24 -2.33 117.51 120.41 1xn0 h ILE 264 Ca -0.04 -1.13 0.04 0.00 1.00 0.00 0.00 64.86 64.73 1xn0 h ILE 264 Cb 1.44 1.92 -0.04 0.00 -0.74 0.00 0.00 36.82 39.40 1xn0 h ILE 264 CO 0.13 0.32 -0.07 0.25 0.00 0.00 0.00 178.15 178.78 1xn0 h LEU 265 N -0.22 -0.24 -0.63 1.44 5.85 -1.25 -2.34 115.31 117.92 1xn0 h LEU 265 Ca 0.02 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.87 1xn0 h LEU 265 Cb 0.53 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 1xn0 h LEU 265 CO 0.01 -0.09 0.31 0.00 -0.34 0.00 0.00 178.44 178.34 1xn0 h ALA 266 N 1.13 0.84 -0.45 1.25 0.00 -1.21 0.31 119.26 121.14 1xn0 h ALA 266 Ca 0.09 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1xn0 h ALA 266 Cb 0.18 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1xn0 h ALA 266 CO -0.21 -0.05 0.03 0.00 0.00 0.00 0.00 179.25 179.02 1xn0 h ALA 267 N 1.37 0.60 -0.14 0.00 0.00 -1.30 0.47 119.26 120.26 1xn0 h ALA 267 Ca 0.30 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1xn0 h ALA 267 Cb 0.26 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1xn0 h ALA 267 CO -0.22 0.36 -0.28 0.82 0.00 0.00 0.00 179.25 179.93 1xn0 h ILE 268 N 0.62 1.37 -0.83 0.00 2.04 -1.22 -2.25 117.51 117.24 1xn0 h ILE 268 Ca 0.13 -1.55 0.06 0.00 1.00 0.00 0.00 64.86 64.50 1xn0 h ILE 268 Cb 0.45 2.01 -0.06 0.00 -0.74 0.00 0.00 36.82 38.48 1xn0 h ILE 268 CO 0.02 0.46 0.51 0.15 0.00 0.00 0.00 178.15 179.29 1xn0 h PHE 269 N 0.05 0.95 -0.77 1.37 3.57 -0.86 -1.97 116.94 119.28 1xn0 h PHE 269 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1xn0 h PHE 269 Cb 0.88 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.28 1xn0 h PHE 269 CO 0.10 0.48 0.49 0.00 -2.23 0.00 0.00 178.31 177.15 1xn0 h ALA 270 N 1.39 0.97 -0.54 2.41 0.00 -0.87 -2.56 119.26 120.07 1xn0 h ALA 270 Ca 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1xn0 h ALA 270 Cb 0.17 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1xn0 h ALA 270 CO -0.17 0.41 0.31 0.00 0.00 0.00 0.00 179.25 179.80 1xn0 h ALA 271 N 1.26 0.69 -0.57 0.00 0.00 -0.74 -1.56 119.26 118.34 1xn0 h ALA 271 Ca 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1xn0 h ALA 271 Cb -0.08 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1xn0 h ALA 271 CO -0.06 0.19 0.31 0.00 0.00 0.00 0.00 179.25 179.69 1xn0 h ALA 272 N 1.15 0.73 -0.00 0.00 0.00 -1.15 -3.05 119.26 116.94 1xn0 h ALA 272 Ca 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xn0 h ALA 272 Cb 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1xn0 h ALA 272 CO -0.03 0.26 -0.41 0.44 0.00 0.00 0.00 179.25 179.51 1xn0 n ILE 273 N -4.59 0.00 0.33 0.00 -5.35 -0.99 -4.66 119.36 104.10 1xn0 n ILE 273 Ca 0.03 -0.04 0.20 0.00 -0.27 0.00 0.00 62.75 62.67 1xn0 n ILE 273 Cb 0.09 0.28 1.06 0.00 -1.74 0.00 0.00 39.64 39.33 1xn0 n ILE 273 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 1xn0 h HIS 274 N 0.39 0.00 0.00 4.28 2.07 -1.16 -1.93 115.15 118.79 1xn0 h HIS 274 Ca 0.00 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.47 1xn0 h HIS 274 Cb 0.50 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 30.38 1xn0 h HIS 274 CO 0.00 0.00 -0.51 -0.25 -3.07 0.00 0.00 177.93 174.10 1xn0 n ASP 275 N -3.06 1.24 -4.77 3.10 8.00 -1.26 -4.87 116.55 114.93 1xn0 n ASP 275 Ca -0.02 -2.72 -0.41 0.00 0.71 0.00 0.00 54.79 52.35 1xn0 n ASP 275 Cb 0.19 -0.36 -0.00 0.00 -0.02 0.00 0.00 41.12 40.93 1xn0 n ASP 275 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1xn0 s VAL 276 N -1.49 2.27 -1.62 2.53 0.11 -0.73 -2.23 120.40 119.24 1xn0 s VAL 276 Ca 0.26 0.26 0.00 0.00 -2.93 0.00 0.00 61.98 59.57 1xn0 s VAL 276 Cb 0.26 -3.16 0.00 0.00 -1.53 0.00 0.00 36.38 31.94 1xn0 s VAL 276 CO -0.05 0.06 0.00 -0.67 -3.33 0.00 0.00 175.10 171.10 1xn0 n ASP 277 N 0.41 -5.33 -4.71 3.54 2.03 -0.88 -4.34 116.55 107.27 1xn0 n ASP 277 Ca 0.02 0.04 -0.42 0.00 0.52 0.00 0.00 54.79 54.94 1xn0 n ASP 277 Cb 0.41 -4.40 -0.03 0.00 -0.72 0.00 0.00 41.12 36.38 1xn0 n ASP 277 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1xn0 s HIS 278 N -2.89 3.02 -1.40 -0.67 5.65 -0.95 -4.92 115.29 113.13 1xn0 s HIS 278 Ca 0.00 0.78 0.28 0.00 0.25 0.00 0.00 55.06 56.36 1xn0 s HIS 278 Cb 0.00 -3.77 1.01 0.00 -1.18 0.00 0.00 32.58 28.65 1xn0 s HIS 278 CO 0.00 -2.80 1.74 -0.35 -0.65 0.00 0.00 174.74 172.68 1xn0 n PRO 279 N 4.44 0.43 -0.38 2.88 -0.04 -1.26 -4.58 135.00 136.49 1xn0 n PRO 279 Ca 0.13 -0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1xn0 n PRO 279 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 1xn0 n PRO 279 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xn0 n GLY 280 N 1.37 0.77 3.13 0.55 0.00 -1.26 -5.00 105.19 104.75 1xn0 n GLY 280 Ca 0.11 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.65 1xn0 n GLY 280 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xn0 s VAL 281 N -2.00 0.64 0.61 1.61 -7.23 -1.26 -4.67 120.40 108.09 1xn0 s VAL 281 Ca 0.00 -1.59 -0.10 0.00 -1.81 0.00 0.00 61.98 58.48 1xn0 s VAL 281 Cb 0.00 -1.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.65 1xn0 s VAL 281 CO 0.00 -0.67 1.00 -0.94 -0.31 0.00 0.00 175.10 174.18 1xn0 s SER 282 N -2.45 6.18 0.26 4.85 1.04 -1.26 -4.91 113.70 117.41 1xn0 s SER 282 Ca 0.03 1.33 -0.03 0.00 0.48 0.00 0.00 55.95 57.76 1xn0 s SER 282 Cb -0.01 -2.40 0.52 0.00 0.10 0.00 0.00 66.02 64.23 1xn0 s SER 282 CO -0.03 -0.86 1.67 0.78 0.98 0.00 0.00 173.24 175.78 1xn0 h ASN 283 N -0.27 -0.03 -0.84 7.02 2.35 -2.01 -1.74 115.58 120.06 1xn0 h ASN 283 Ca -0.44 0.17 -0.03 0.00 -0.55 0.00 0.00 56.30 55.44 1xn0 h ASN 283 Cb 1.20 0.23 -0.04 0.00 0.05 0.00 0.00 38.32 39.76 1xn0 h ASN 283 CO 0.62 -0.08 0.41 -0.61 -1.65 0.00 0.00 177.43 176.12 1xn0 h GLN 284 N 0.24 1.21 -0.33 0.81 5.75 -1.98 -1.26 115.11 119.55 1xn0 h GLN 284 Ca 0.45 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.76 1xn0 h GLN 284 Cb 0.81 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 29.13 1xn0 h GLN 284 CO -0.57 0.92 0.13 0.35 -2.65 0.00 0.00 178.83 177.02 1xn0 h PHE 285 N 1.20 0.50 -0.90 3.99 3.04 -1.72 -1.21 116.94 121.84 1xn0 h PHE 285 Ca 0.29 -0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.20 1xn0 h PHE 285 Cb 0.10 -0.15 -0.04 0.00 2.56 0.00 0.00 35.95 38.42 1xn0 h PHE 285 CO 0.01 0.46 0.55 -0.07 -2.02 0.00 0.00 178.31 177.25 1xn0 h LEU 286 N 0.38 1.07 -0.39 0.59 3.38 -0.78 -2.26 115.31 117.31 1xn0 h LEU 286 Ca 0.11 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1xn0 h LEU 286 Cb 0.18 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1xn0 h LEU 286 CO -0.01 0.82 -0.11 0.40 0.09 0.00 0.00 178.44 179.63 1xn0 h ILE 287 N 1.24 1.28 0.00 1.22 2.04 -1.09 -1.58 117.51 120.63 1xn0 h ILE 287 Ca 0.32 -1.20 -0.05 0.00 1.00 0.00 0.00 64.86 64.93 1xn0 h ILE 287 Cb -0.07 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1xn0 h ILE 287 CO -0.06 0.40 -0.26 0.78 0.00 0.00 0.00 178.15 179.01 1xn0 h ASN 288 N 0.56 0.00 -0.61 1.72 2.35 -1.07 -3.03 115.58 115.50 1xn0 h ASN 288 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1xn0 h ASN 288 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1xn0 h ASN 288 CO 0.04 0.26 0.00 0.35 -1.65 0.00 0.00 177.43 176.43 1xn0 n THR 289 N -3.29 0.90 -3.93 2.81 -2.24 -0.86 -4.95 114.28 102.71 1xn0 n THR 289 Ca 0.01 -0.84 -0.28 0.00 -2.27 0.00 0.00 64.05 60.67 1xn0 n THR 289 Cb 0.52 0.38 0.01 0.00 -2.10 0.00 0.00 70.33 69.13 1xn0 n THR 289 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1xn0 n ASN 290 N 1.27 -2.77 -4.71 3.42 3.02 -1.14 -4.92 115.26 109.43 1xn0 n ASN 290 Ca 0.21 -0.88 -0.31 0.00 -0.03 0.00 0.00 54.58 53.57 1xn0 n ASN 290 Cb 0.55 -3.54 0.14 0.00 -0.61 0.00 0.00 39.78 36.31 1xn0 n ASN 290 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1xn0 s SER 291 N -3.77 3.53 0.34 6.41 1.04 -0.60 -4.85 113.70 115.80 1xn0 s SER 291 Ca 0.39 1.89 0.05 0.00 0.48 0.00 0.00 55.95 58.76 1xn0 s SER 291 Cb -0.20 -2.47 0.63 0.00 0.10 0.00 0.00 66.02 64.08 1xn0 s SER 291 CO 0.86 -2.67 1.89 -0.33 0.98 0.00 0.00 173.24 173.97 1xn0 h GLU 292 N -1.57 0.52 -0.44 4.02 4.39 -1.91 -2.38 114.58 117.21 1xn0 h GLU 292 Ca -0.45 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.12 1xn0 h GLU 292 Cb 1.26 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 1xn0 h GLU 292 CO 0.48 0.53 0.18 -0.07 -1.16 0.00 0.00 179.01 178.97 1xn0 h LEU 293 N 0.50 0.60 -0.69 1.33 3.38 -1.92 -0.78 115.31 117.74 1xn0 h LEU 293 Ca 0.11 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1xn0 h LEU 293 Cb 0.29 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1xn0 h LEU 293 CO 0.01 0.60 -0.17 0.00 0.09 0.00 0.00 178.44 178.97 1xn0 h ALA 294 N 1.03 0.88 -0.76 1.53 0.00 -1.74 -1.33 119.26 118.88 1xn0 h ALA 294 Ca 0.15 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1xn0 h ALA 294 Cb 0.18 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1xn0 h ALA 294 CO -0.01 0.63 0.26 -0.07 0.00 0.00 0.00 179.25 180.06 1xn0 h LEU 295 N 0.73 1.07 -0.25 0.00 3.38 -1.32 0.42 115.31 119.34 1xn0 h LEU 295 Ca 0.11 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1xn0 h LEU 295 Cb 0.69 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1xn0 h LEU 295 CO 0.05 0.98 0.12 -0.03 0.09 0.00 0.00 178.44 179.65 1xn0 h MET 296 N 1.12 0.36 -0.67 1.13 4.05 -0.82 -3.24 114.93 116.85 1xn0 h MET 296 Ca 0.25 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.61 1xn0 h MET 296 Cb 0.27 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.00 1xn0 h MET 296 CO -0.01 0.37 0.00 0.66 0.23 0.00 0.00 176.91 178.15 1xn0 n TYR 297 N -4.82 1.26 -4.03 1.39 4.01 -0.53 -4.98 117.16 109.46 1xn0 n TYR 297 Ca -0.03 -0.53 -0.30 0.00 -0.16 0.00 0.00 57.90 56.88 1xn0 n TYR 297 Cb 0.10 -0.15 -0.01 0.00 -0.31 0.00 0.00 39.34 38.97 1xn0 n TYR 297 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1xn0 n ASN 298 N 1.25 -2.32 0.00 7.72 3.02 0.09 -2.45 115.26 122.58 1xn0 n ASN 298 Ca 0.24 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 1xn0 n ASN 298 Cb 0.76 -3.16 0.00 0.00 -0.61 0.00 0.00 39.78 36.78 1xn0 n ASN 298 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xn0 n ASP 299 N -2.84 -1.70 -4.57 6.41 8.00 -0.93 -4.96 116.55 115.96 1xn0 n ASP 299 Ca -0.10 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.03 1xn0 n ASP 299 Cb 0.58 -2.37 -0.11 0.00 -0.02 0.00 0.00 41.12 39.20 1xn0 n ASP 299 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1xn0 s GLU 300 N -1.09 3.90 -1.00 -1.24 2.56 -1.03 -4.53 118.70 116.26 1xn0 s GLU 300 Ca 0.00 -0.35 -0.22 0.00 0.00 0.00 0.00 54.97 54.40 1xn0 s GLU 300 Cb 0.00 -3.55 0.03 0.00 2.00 0.00 0.00 34.13 32.61 1xn0 s GLU 300 CO 0.00 -0.14 0.42 0.43 -0.56 0.00 0.00 175.26 175.41 1xn0 n SER 301 N 4.89 -2.36 0.25 -1.70 7.64 -1.26 -4.81 113.62 116.27 1xn0 n SER 301 Ca -0.15 -1.02 -0.17 0.00 1.01 0.00 0.00 58.87 58.54 1xn0 n SER 301 Cb 0.52 -1.23 -0.09 0.00 -1.01 0.00 0.00 64.21 62.39 1xn0 n SER 301 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1xn0 h VAL 302 N -1.36 0.00 -0.74 0.44 2.07 -1.90 -1.48 116.25 113.29 1xn0 h VAL 302 Ca -0.55 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.00 1xn0 h VAL 302 Cb 1.10 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 1xn0 h VAL 302 CO 0.44 0.00 0.46 -0.07 0.02 0.00 0.00 177.57 178.42 1xn0 h LEU 303 N -0.90 0.76 -0.24 2.57 3.38 -1.95 -2.43 115.31 116.49 1xn0 h LEU 303 Ca -0.05 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1xn0 h LEU 303 Cb 0.80 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1xn0 h LEU 303 CO -0.09 0.52 -0.12 -0.33 0.09 0.00 0.00 178.44 178.51 1xn0 h GLU 304 N 0.90 0.50 -0.99 1.13 3.07 -1.88 0.14 114.58 117.44 1xn0 h GLU 304 Ca 0.30 -0.22 0.06 0.00 -0.50 0.00 0.00 59.36 59.00 1xn0 h GLU 304 Cb 0.03 -0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 27.86 1xn0 h GLU 304 CO -0.12 0.77 0.64 -0.91 -1.40 0.00 0.00 179.01 178.00 1xn0 h ASN 305 N 0.22 1.04 -0.29 1.42 2.35 -1.26 -2.43 115.58 116.62 1xn0 h ASN 305 Ca 0.05 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1xn0 h ASN 305 Cb 0.62 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1xn0 h ASN 305 CO 0.04 0.67 0.05 -0.74 -1.65 0.00 0.00 177.43 175.79 1xn0 h HIS 306 N 1.18 0.52 -0.78 1.19 2.76 -0.57 -1.62 115.15 117.83 1xn0 h HIS 306 Ca 0.42 -0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.52 1xn0 h HIS 306 Cb 0.14 -0.14 -0.04 0.00 1.55 0.00 0.00 27.41 28.92 1xn0 h HIS 306 CO -0.00 0.58 0.50 0.45 -1.30 0.00 0.00 177.93 178.16 1xn0 h HIS 307 N 0.31 1.01 -0.79 5.26 3.86 -0.70 -1.05 115.15 123.04 1xn0 h HIS 307 Ca 0.09 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.27 1xn0 h HIS 307 Cb 0.34 -0.34 -0.04 0.00 1.06 0.00 0.00 27.41 28.44 1xn0 h HIS 307 CO 0.02 0.66 0.33 -0.07 0.86 0.00 0.00 177.93 179.73 1xn0 h LEU 308 N 1.07 1.06 -0.42 2.43 3.38 -1.33 -1.60 115.31 119.90 1xn0 h LEU 308 Ca 0.28 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1xn0 h LEU 308 Cb -0.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 1xn0 h LEU 308 CO -0.06 0.93 0.04 0.00 0.09 0.00 0.00 178.44 179.44 1xn0 h ALA 309 N 1.23 0.56 -0.17 1.53 0.00 -0.34 -1.74 119.26 120.33 1xn0 h ALA 309 Ca 0.27 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1xn0 h ALA 309 Cb 0.18 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1xn0 h ALA 309 CO -0.03 0.31 -0.05 0.28 0.00 0.00 0.00 179.25 179.76 1xn0 h VAL 310 N 0.56 1.29 -0.47 0.00 2.07 -1.10 -0.70 116.25 117.91 1xn0 h VAL 310 Ca 0.12 -1.04 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1xn0 h VAL 310 Cb 0.42 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1xn0 h VAL 310 CO 0.01 0.31 0.28 1.23 0.02 0.00 0.00 177.57 179.42 1xn0 h GLY 311 N 0.04 0.66 2.00 2.17 0.00 -1.22 -1.84 103.07 104.88 1xn0 h GLY 311 Ca 0.04 -0.21 -0.11 0.00 0.00 0.00 0.00 47.33 47.05 1xn0 h GLY 311 CO 0.02 0.19 -0.54 0.74 0.00 0.00 0.00 176.54 176.94 1xn0 h PHE 312 N 0.57 0.00 -0.60 5.60 0.04 -1.35 -3.16 116.94 118.04 1xn0 h PHE 312 Ca 0.18 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.93 1xn0 h PHE 312 Cb 0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.13 1xn0 h PHE 312 CO -0.07 0.54 0.27 -0.22 -0.60 0.00 0.00 178.31 178.24 1xn0 h LYS 313 N 0.00 0.88 0.00 1.51 3.11 -0.44 -2.90 116.57 118.72 1xn0 h LYS 313 Ca -0.01 -0.14 -0.03 0.00 -2.81 0.00 0.00 60.65 57.66 1xn0 h LYS 313 Cb 1.22 -0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 32.30 1xn0 h LYS 313 CO 0.07 0.73 -0.16 -0.07 -2.81 0.00 0.00 179.45 177.21 1xn0 h LEU 314 N 0.82 0.00 -1.07 5.20 3.38 -1.32 -1.69 115.31 120.64 1xn0 h LEU 314 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1xn0 h LEU 314 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1xn0 h LEU 314 CO -0.02 0.16 0.00 -0.07 0.09 0.00 0.00 178.44 178.60 1xn0 h LEU 315 N 0.00 0.00 -7.92 1.67 3.38 -1.55 -3.40 115.31 107.50 1xn0 h LEU 315 Ca -0.00 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.28 1xn0 h LEU 315 Cb 0.46 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.05 1xn0 h LEU 315 CO 0.02 0.00 1.17 -1.10 0.09 0.00 0.00 178.44 178.62 1xn0 s GLN 316 N -3.49 3.76 0.00 1.13 -1.52 -0.64 -3.88 119.66 115.03 1xn0 s GLN 316 Ca 0.03 -1.91 0.00 0.00 -1.95 0.00 0.00 55.36 51.52 1xn0 s GLN 316 Cb 0.09 -5.06 0.00 0.00 -0.22 0.00 0.00 33.01 27.82 1xn0 s GLN 316 CO 0.47 -1.87 0.00 0.39 -0.25 0.00 0.00 175.29 174.03 1xn0 n GLU 317 N 6.76 0.00 -0.17 2.91 1.02 -1.26 -5.05 120.64 124.85 1xn0 n GLU 317 Ca 0.30 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.43 1xn0 n GLU 317 Cb 0.47 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.95 1xn0 n GLU 317 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1xn0 h GLU 318 N 0.00 0.06 -1.86 3.49 5.08 -1.95 -2.24 114.58 117.16 1xn0 h GLU 318 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1xn0 h GLU 318 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1xn0 h GLU 318 CO 0.00 0.04 0.00 -2.39 -1.00 0.00 0.00 179.01 175.66 1xn0 n HIS 319 N -5.31 0.00 -2.86 4.33 1.44 -1.26 -4.88 115.22 106.68 1xn0 n HIS 319 Ca 0.06 -0.11 -0.01 0.00 -2.01 0.00 0.00 57.72 55.66 1xn0 n HIS 319 Cb 0.29 -0.16 -0.01 0.00 0.12 0.00 0.00 29.99 30.23 1xn0 n HIS 319 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1xn0 n ASP 321 N 1.12 -6.67 0.03 4.39 2.03 -0.85 -4.69 116.55 111.92 1xn0 n ASP 321 Ca 0.00 1.12 0.09 0.00 0.52 0.00 0.00 54.79 56.52 1xn0 n ASP 321 Cb 0.09 -4.07 0.39 0.00 -0.72 0.00 0.00 41.12 36.80 1xn0 n ASP 321 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1xn0 n ILE 322 N 1.11 0.81 -0.39 5.18 -5.35 -1.26 -2.94 119.36 116.52 1xn0 n ILE 322 Ca -0.05 0.19 0.09 0.00 -0.27 0.00 0.00 62.75 62.70 1xn0 n ILE 322 Cb 0.22 -0.94 0.25 0.00 -1.74 0.00 0.00 39.64 37.44 1xn0 n ILE 322 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1xn0 n PHE 323 N -1.65 0.86 0.30 4.28 3.72 -1.26 -4.67 117.46 119.03 1xn0 n PHE 323 Ca 0.04 -0.55 0.17 0.00 -0.05 0.00 0.00 57.45 57.06 1xn0 n PHE 323 Cb 0.22 -0.08 0.94 0.00 -0.94 0.00 0.00 39.48 39.61 1xn0 n PHE 323 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1xn0 h MET 324 N 3.11 0.00 -0.35 -1.08 -0.00 -1.90 -2.22 114.93 112.49 1xn0 h MET 324 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1xn0 h MET 324 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.61 1xn0 h MET 324 CO 0.06 0.04 0.00 0.09 -0.00 0.00 0.00 176.91 177.10 1xn0 n ASN 325 N -3.50 3.01 -4.90 -0.10 3.02 -1.26 -4.90 115.26 106.64 1xn0 n ASN 325 Ca -0.02 -1.93 -0.29 0.00 -0.03 0.00 0.00 54.58 52.31 1xn0 n ASN 325 Cb 0.14 -0.22 0.05 0.00 -0.61 0.00 0.00 39.78 39.14 1xn0 n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1xn0 s LEU 326 N -1.48 2.93 0.77 3.41 1.43 -0.84 -4.90 118.68 120.00 1xn0 s LEU 326 Ca 0.37 0.96 -0.12 0.00 -1.03 0.00 0.00 54.13 54.32 1xn0 s LEU 326 Cb 0.21 -3.73 0.05 0.00 0.03 0.00 0.00 46.19 42.76 1xn0 s LEU 326 CO 0.30 -1.35 1.14 0.42 0.23 0.00 0.00 176.35 177.09 1xn0 s THR 327 N -3.30 2.66 0.18 5.49 -4.23 -1.26 -4.85 115.64 110.33 1xn0 s THR 327 Ca 0.58 0.22 -0.14 0.00 -1.18 0.00 0.00 61.69 61.17 1xn0 s THR 327 Cb -0.11 -3.19 0.07 0.00 1.34 0.00 0.00 72.50 70.60 1xn0 s THR 327 CO 0.50 -0.28 1.79 0.50 -0.54 0.00 0.00 174.62 176.58 1xn0 h LYS 328 N -0.91 0.48 -0.54 3.99 3.64 -1.97 0.25 116.57 121.51 1xn0 h LYS 328 Ca -0.46 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 58.94 1xn0 h LYS 328 Cb 1.30 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 1xn0 h LYS 328 CO 0.65 0.32 0.28 -0.22 -2.27 0.00 0.00 179.45 178.20 1xn0 h LYS 329 N 0.49 0.53 -0.55 1.90 1.63 -2.00 -1.02 116.57 117.54 1xn0 h LYS 329 Ca 0.21 -0.03 -0.07 0.00 -0.85 0.00 0.00 60.65 59.91 1xn0 h LYS 329 Cb 0.11 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 1xn0 h LYS 329 CO -0.14 0.35 0.07 1.96 -3.45 0.00 0.00 179.45 178.24 1xn0 h GLN 330 N 0.54 0.93 -0.75 1.90 4.20 -1.74 -2.23 115.11 117.95 1xn0 h GLN 330 Ca 0.24 -0.26 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 1xn0 h GLN 330 Cb 0.14 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 1xn0 h GLN 330 CO -0.16 0.90 0.29 -0.09 -0.67 0.00 0.00 178.83 179.10 1xn0 h ARG 331 N 0.82 1.12 0.05 1.46 2.43 -0.55 -1.57 114.38 118.13 1xn0 h ARG 331 Ca 0.17 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1xn0 h ARG 331 Cb 0.44 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1xn0 h ARG 331 CO 0.01 0.91 -0.03 0.37 -1.51 0.00 0.00 179.97 179.73 1xn0 h GLN 332 N 1.09 -0.07 -0.71 0.20 4.15 -1.13 -0.52 115.11 118.12 1xn0 h GLN 332 Ca 0.25 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.66 1xn0 h GLN 332 Cb 0.22 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.89 1xn0 h GLN 332 CO -0.02 0.08 0.38 1.15 -1.93 0.00 0.00 178.83 178.49 1xn0 h THR 333 N -0.20 1.22 -0.36 2.39 2.02 -1.26 -1.49 112.91 115.23 1xn0 h THR 333 Ca -0.01 -0.57 -0.03 0.00 0.77 0.00 0.00 66.41 66.57 1xn0 h THR 333 Cb 0.18 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1xn0 h THR 333 CO 0.01 0.25 0.09 0.25 0.37 0.00 0.00 175.52 176.49 1xn0 h LEU 334 N 0.99 0.54 -0.64 2.58 6.46 -1.23 -1.17 115.31 122.84 1xn0 h LEU 334 Ca 0.25 -0.23 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 1xn0 h LEU 334 Cb 0.05 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 39.81 1xn0 h LEU 334 CO -0.04 0.63 0.41 -0.09 -0.62 0.00 0.00 178.44 178.73 1xn0 h ARG 335 N 0.43 0.85 -0.33 1.25 2.43 -0.83 0.11 114.38 118.28 1xn0 h ARG 335 Ca 0.11 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1xn0 h ARG 335 Cb 0.30 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1xn0 h ARG 335 CO 0.00 0.58 0.21 -0.22 -1.51 0.00 0.00 179.97 179.03 1xn0 h LYS 336 N 0.86 0.44 -0.46 0.20 3.64 -1.14 -1.71 116.57 118.42 1xn0 h LYS 336 Ca 0.23 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.52 1xn0 h LYS 336 Cb -0.07 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 1xn0 h LYS 336 CO -0.05 0.31 0.05 0.52 -2.27 0.00 0.00 179.45 178.01 1xn0 h MET 337 N 0.44 0.77 -0.00 1.90 2.86 -0.61 -2.30 114.93 117.99 1xn0 h MET 337 Ca 0.12 -0.22 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1xn0 h MET 337 Cb -0.02 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 1xn0 h MET 337 CO -0.02 0.81 0.00 0.28 1.06 0.00 0.00 176.91 179.03 1xn0 h VAL 338 N 0.63 1.20 -0.46 -2.22 2.07 -0.72 -0.71 116.25 116.05 1xn0 h VAL 338 Ca 0.13 -0.59 0.09 0.00 0.82 0.00 0.00 66.70 67.16 1xn0 h VAL 338 Cb 0.43 1.60 -0.09 0.00 -1.52 0.00 0.00 31.29 31.71 1xn0 h VAL 338 CO 0.01 0.15 -0.16 0.40 0.02 0.00 0.00 177.57 178.00 1xn0 h ILE 339 N -0.25 0.46 -0.09 4.57 2.04 -1.32 0.18 117.51 123.11 1xn0 h ILE 339 Ca 0.00 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1xn0 h ILE 339 Cb 0.25 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 1xn0 h ILE 339 CO 0.00 0.00 -0.13 -0.78 0.00 0.00 0.00 178.15 177.24 1xn0 h ASP 340 N -0.05 -0.39 -0.55 1.72 1.82 -1.24 -0.63 116.42 117.09 1xn0 h ASP 340 Ca 0.22 0.07 -0.04 0.00 -0.39 0.00 0.00 57.03 56.89 1xn0 h ASP 340 Cb 0.39 0.19 -0.02 0.00 0.68 0.00 0.00 39.33 40.56 1xn0 h ASP 340 CO -0.50 -0.17 0.17 0.24 -1.61 0.00 0.00 179.24 177.37 1xn0 h MET 341 N -0.17 0.85 -0.17 0.28 2.86 -0.40 -2.11 114.93 116.07 1xn0 h MET 341 Ca 0.08 -0.18 -0.16 0.00 -2.06 0.00 0.00 59.70 57.37 1xn0 h MET 341 Cb 0.28 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 1xn0 h MET 341 CO -0.20 0.78 -0.58 0.28 1.06 0.00 0.00 176.91 178.25 1xn0 h VAL 342 N 0.76 1.33 -0.11 -2.22 2.07 -0.84 -2.62 116.25 114.63 1xn0 h VAL 342 Ca 0.18 -1.85 -0.03 0.00 0.82 0.00 0.00 66.70 65.82 1xn0 h VAL 342 Cb 0.28 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1xn0 h VAL 342 CO -0.01 0.57 -0.05 -0.07 0.02 0.00 0.00 177.57 178.03 1xn0 h LEU 343 N 0.40 0.15 0.00 2.57 3.38 -1.02 -1.88 115.31 118.91 1xn0 h LEU 343 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1xn0 h LEU 343 Cb 1.13 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1xn0 h LEU 343 CO 0.11 0.23 0.00 0.00 0.09 0.00 0.00 178.44 178.87 1xn0 n ALA 344 N -2.50 1.78 1.60 1.53 0.00 -0.80 -2.49 120.51 119.62 1xn0 n ALA 344 Ca -0.01 -0.06 0.15 0.00 0.00 0.00 0.00 53.44 53.51 1xn0 n ALA 344 Cb 0.19 -1.25 0.71 0.00 0.00 0.00 0.00 19.45 19.09 1xn0 n ALA 344 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xn0 n THR 345 N -1.42 0.00 -2.31 0.00 -2.24 -0.71 -4.82 114.28 102.79 1xn0 n THR 345 Ca 0.05 -0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.33 1xn0 n THR 345 Cb 0.16 -0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.23 1xn0 n THR 345 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xn0 s ASP 346 N -2.25 6.55 0.56 3.42 -1.08 -1.04 -4.90 116.67 117.94 1xn0 s ASP 346 Ca 0.36 1.34 0.26 0.00 -0.52 0.00 0.00 52.55 53.99 1xn0 s ASP 346 Cb 0.21 -2.54 1.54 0.00 -1.46 0.00 0.00 42.92 40.67 1xn0 s ASP 346 CO 0.42 -1.16 2.10 0.24 0.52 0.00 0.00 175.17 177.29 1xn0 h MET 347 N 9.86 0.00 0.00 4.34 2.86 -1.91 -1.20 114.93 128.88 1xn0 h MET 347 Ca -0.29 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 1xn0 h MET 347 Cb 1.12 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.78 1xn0 h MET 347 CO 1.02 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 177.86 1xn0 n SER 348 N -4.06 0.00 -0.90 1.22 3.41 -1.26 -1.60 113.62 110.43 1xn0 n SER 348 Ca 0.02 0.45 0.12 0.00 -0.26 0.00 0.00 58.87 59.21 1xn0 n SER 348 Cb 0.32 -0.47 0.16 0.00 -0.26 0.00 0.00 64.21 63.96 1xn0 n SER 348 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1xn0 n LYS 349 N -1.47 2.25 0.28 4.33 4.76 -0.45 -4.70 118.16 123.15 1xn0 n LYS 349 Ca 0.03 -1.81 -0.17 0.00 -2.87 0.00 0.00 58.31 53.49 1xn0 n LYS 349 Cb 0.13 -1.46 -0.09 0.00 -1.84 0.00 0.00 35.03 31.77 1xn0 n LYS 349 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1xn0 h HIS 350 N 4.40 -1.23 -0.98 2.13 -0.00 -1.42 -1.86 115.15 116.19 1xn0 h HIS 350 Ca 0.00 0.01 0.14 0.00 -0.00 0.00 0.00 60.37 60.52 1xn0 h HIS 350 Cb 0.94 0.47 -0.09 0.00 -0.00 0.00 0.00 27.41 28.73 1xn0 h HIS 350 CO 0.00 -0.61 0.60 0.52 -0.00 0.00 0.00 177.93 178.44 1xn0 h MET 351 N -0.92 0.88 -0.29 5.26 2.86 -1.84 -1.25 114.93 119.63 1xn0 h MET 351 Ca -0.05 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 1xn0 h MET 351 Cb 0.80 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 1xn0 h MET 351 CO -0.05 0.58 0.10 1.03 1.06 0.00 0.00 176.91 179.62 1xn0 h SER 352 N 0.90 0.42 -0.63 1.22 0.87 -1.83 -2.26 113.55 112.24 1xn0 h SER 352 Ca 0.51 -0.20 -0.08 0.00 -1.23 0.00 0.00 61.79 60.79 1xn0 h SER 352 Cb 0.60 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.42 1xn0 h SER 352 CO -0.30 0.50 0.08 0.25 -0.53 0.00 0.00 176.83 176.83 1xn0 h LEU 353 N 0.31 1.03 -0.30 2.23 5.85 -0.68 -2.64 115.31 121.11 1xn0 h LEU 353 Ca 0.09 -0.25 -0.09 0.00 0.84 0.00 0.00 57.88 58.47 1xn0 h LEU 353 Cb 0.23 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1xn0 h LEU 353 CO -0.00 1.03 -0.17 0.25 -0.34 0.00 0.00 178.44 179.21 1xn0 h LEU 354 N 1.00 0.67 -0.64 2.25 5.85 -1.16 -1.33 115.31 121.95 1xn0 h LEU 354 Ca 0.19 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.53 1xn0 h LEU 354 Cb 0.46 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 1xn0 h LEU 354 CO 0.02 0.95 0.39 0.00 -0.34 0.00 0.00 178.44 179.45 1xn0 h ALA 355 N 0.75 0.83 -0.20 1.25 0.00 -1.36 -0.58 119.26 119.95 1xn0 h ALA 355 Ca 0.06 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1xn0 h ALA 355 Cb 0.71 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1xn0 h ALA 355 CO 0.05 0.13 -0.40 -0.44 0.00 0.00 0.00 179.25 178.59 1xn0 h ASP 356 N 0.76 0.49 0.14 0.00 5.19 -1.33 -2.38 116.42 119.30 1xn0 h ASP 356 Ca 0.26 -0.21 -0.11 0.00 -0.62 0.00 0.00 57.03 56.34 1xn0 h ASP 356 Cb 0.05 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.41 1xn0 h ASP 356 CO -0.12 0.84 -0.40 0.25 -3.12 0.00 0.00 179.24 176.69 1xn0 h LEU 357 N 0.39 0.36 -0.94 1.55 5.85 -0.77 -2.28 115.31 119.47 1xn0 h LEU 357 Ca 0.04 -0.15 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 1xn0 h LEU 357 Cb 0.87 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 1xn0 h LEU 357 CO 0.07 0.73 -0.37 0.11 -0.34 0.00 0.00 178.44 178.65 1xn0 h LYS 358 N 0.29 0.31 -0.06 1.25 1.57 -0.76 -1.90 116.57 117.26 1xn0 h LYS 358 Ca 0.03 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.50 1xn0 h LYS 358 Cb 0.84 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1xn0 h LYS 358 CO 0.07 0.64 -0.71 1.15 -0.57 0.00 0.00 179.45 180.02 1xn0 h THR 359 N 0.27 1.40 -0.38 -0.16 2.02 -1.24 -2.39 112.91 112.42 1xn0 h THR 359 Ca 0.03 -2.17 -0.13 0.00 0.77 0.00 0.00 66.41 64.91 1xn0 h THR 359 Cb 0.77 2.13 -0.01 0.00 -1.74 0.00 0.00 68.15 69.30 1xn0 h THR 359 CO 0.06 0.64 -0.28 -0.03 0.37 0.00 0.00 175.52 176.29 1xn0 h MET 360 N 0.22 0.80 -0.01 6.66 1.85 -1.12 -3.00 114.93 120.32 1xn0 h MET 360 Ca -0.02 -0.35 -0.00 0.00 -0.61 0.00 0.00 59.70 58.71 1xn0 h MET 360 Cb 1.27 -0.02 -0.00 0.00 0.43 0.00 0.00 31.60 33.28 1xn0 h MET 360 CO 0.12 0.98 0.00 0.28 -0.40 0.00 0.00 176.91 177.88 1xn0 h VAL 361 N 0.68 1.20 -0.96 -5.77 2.07 -1.32 -2.74 116.25 109.41 1xn0 h VAL 361 Ca 0.08 -0.59 0.28 0.00 0.82 0.00 0.00 66.70 67.29 1xn0 h VAL 361 Cb 0.81 1.59 -0.17 0.00 -1.52 0.00 0.00 31.29 32.00 1xn0 h VAL 361 CO 0.07 0.15 0.14 -0.33 0.02 0.00 0.00 177.57 177.62 1xn0 h GLU 362 N -0.24 0.05 -0.76 1.57 5.08 -1.33 0.15 114.58 119.10 1xn0 h GLU 362 Ca 0.00 -0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 1xn0 h GLU 362 Cb 0.25 -0.01 -0.28 0.00 0.50 0.00 0.00 28.75 29.21 1xn0 h GLU 362 CO 0.00 0.03 0.13 0.25 -1.00 0.00 0.00 179.01 178.43 1xn0 n THR 363 N -5.40 2.99 -2.22 1.13 -2.24 -1.14 -5.02 114.28 102.38 1xn0 n THR 363 Ca 0.24 -3.11 -0.41 0.00 -2.27 0.00 0.00 64.05 58.50 1xn0 n THR 363 Cb 0.81 -0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 68.17 1xn0 n THR 363 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1xn0 s LYS 364 N -3.55 4.40 -0.04 -0.78 2.20 0.04 -5.02 119.74 116.98 1xn0 s LYS 364 Ca 0.55 2.06 0.03 0.00 -0.36 0.00 0.00 55.97 58.25 1xn0 s LYS 364 Cb 0.45 -3.18 0.00 0.00 -1.51 0.00 0.00 37.83 33.60 1xn0 s LYS 364 CO 0.02 -0.22 -0.13 0.15 -0.36 0.00 0.00 175.35 174.82 1xn0 s LYS 365 N -0.42 1.48 0.14 4.03 1.02 -1.26 -5.08 119.74 119.65 1xn0 s LYS 365 Ca 0.55 -0.44 0.08 0.00 0.02 0.00 0.00 55.97 56.18 1xn0 s LYS 365 Cb -0.37 -1.28 -0.04 0.00 -0.52 0.00 0.00 37.83 35.62 1xn0 s LYS 365 CO 0.40 0.13 -0.19 0.14 -0.92 0.00 0.00 175.35 174.91 1xn0 s VAL 366 N 0.30 1.76 1.10 3.17 -7.23 -1.26 -0.52 120.40 117.71 1xn0 s VAL 366 Ca -0.07 -1.79 -0.14 0.00 -1.81 0.00 0.00 61.98 58.17 1xn0 s VAL 366 Cb -0.12 -1.73 0.24 0.00 0.56 0.00 0.00 36.38 35.33 1xn0 s VAL 366 CO 0.02 -0.24 1.08 0.42 -0.31 0.00 0.00 175.10 176.07 1xn0 s THR 367 N -1.76 1.89 0.59 5.32 -4.23 0.02 -4.84 115.64 112.62 1xn0 s THR 367 Ca 0.12 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.92 1xn0 s THR 367 Cb -0.07 -2.39 0.39 0.00 1.34 0.00 0.00 72.50 71.77 1xn0 s THR 367 CO 0.06 0.00 1.79 0.77 -0.54 0.00 0.00 174.62 176.70 1xn0 h SER 368 N -2.27 0.00 -0.67 3.99 4.64 -2.01 -2.37 113.55 114.86 1xn0 h SER 368 Ca -0.54 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.45 1xn0 h SER 368 Cb 1.33 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.22 1xn0 h SER 368 CO 0.51 0.00 0.28 -1.54 -0.87 0.00 0.00 176.83 175.21 1xn0 n SER 369 N -3.63 3.27 -3.33 4.97 3.41 -1.26 -4.98 113.62 112.06 1xn0 n SER 369 Ca 0.12 -3.64 -0.16 0.00 -0.26 0.00 0.00 58.87 54.92 1xn0 n SER 369 Cb 0.84 -0.73 0.09 0.00 -0.26 0.00 0.00 64.21 64.14 1xn0 n SER 369 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xn0 n GLY 370 N -1.04 -0.33 3.03 5.00 0.00 -0.89 -5.03 105.19 105.92 1xn0 n GLY 370 Ca 0.45 0.08 -0.29 0.00 0.00 0.00 0.00 46.02 46.26 1xn0 n GLY 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xn0 s VAL 371 N -3.34 1.53 0.40 1.61 1.01 -1.26 -4.57 120.40 115.78 1xn0 s VAL 371 Ca 0.01 -0.62 -0.23 0.00 0.00 0.00 0.00 61.98 61.14 1xn0 s VAL 371 Cb -0.01 -1.42 -0.13 0.00 0.00 0.00 0.00 36.38 34.82 1xn0 s VAL 371 CO 0.70 0.45 0.57 0.18 0.00 0.00 0.00 175.10 177.00 1xn0 n LEU 372 N 4.58 -0.01 -4.27 3.92 4.77 -0.66 -0.80 117.00 124.53 1xn0 n LEU 372 Ca -0.17 0.94 -0.37 0.00 -0.03 0.00 0.00 56.01 56.38 1xn0 n LEU 372 Cb 0.50 -1.11 -0.13 0.00 -2.33 0.00 0.00 43.42 40.35 1xn0 n LEU 372 CO 0.22 -2.80 -0.29 -0.22 -1.33 0.00 0.00 177.39 172.98 1xn0 s LEU 373 N 1.77 4.06 -0.36 2.23 2.96 0.32 -4.75 118.68 124.91 1xn0 s LEU 373 Ca 0.63 -1.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.53 1xn0 s LEU 373 Cb -0.63 -1.83 0.10 0.00 0.50 0.00 0.00 46.19 44.33 1xn0 s LEU 373 CO 0.58 -0.27 0.09 -0.76 -1.32 0.00 0.00 176.35 174.68 1xn0 s LEU 374 N 1.40 4.89 0.00 -0.68 1.43 -1.26 -4.69 118.68 119.77 1xn0 s LEU 374 Ca -0.01 -2.14 0.00 0.00 -1.03 0.00 0.00 54.13 50.95 1xn0 s LEU 374 Cb -0.19 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.35 1xn0 s LEU 374 CO 0.02 -0.42 0.68 0.47 0.23 0.00 0.00 176.35 177.33 1xn0 n ASP 375 N 4.32 0.00 -4.95 2.29 8.00 -1.26 -4.88 116.55 120.06 1xn0 n ASP 375 Ca 0.02 0.69 -0.23 0.00 0.71 0.00 0.00 54.79 55.99 1xn0 n ASP 375 Cb 0.42 -0.23 0.02 0.00 -0.02 0.00 0.00 41.12 41.31 1xn0 n ASP 375 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1xn0 s ASN 376 N -1.99 5.72 0.28 -2.24 -0.87 -1.26 -4.98 114.94 109.60 1xn0 s ASN 376 Ca 0.00 0.25 0.02 0.00 -1.57 0.00 0.00 52.86 51.56 1xn0 s ASN 376 Cb 0.00 -1.42 0.64 0.00 -0.02 0.00 0.00 41.25 40.45 1xn0 s ASN 376 CO 0.00 -0.80 1.77 0.22 -2.57 0.00 0.00 177.10 175.72 1xn0 h TYR 377 N 0.32 0.91 -0.60 2.20 3.20 -2.00 -2.45 116.97 118.55 1xn0 h TYR 377 Ca -0.45 0.03 0.12 0.00 3.14 0.00 0.00 58.73 61.58 1xn0 h TYR 377 Cb 1.26 -0.26 -0.11 0.00 1.54 0.00 0.00 36.73 39.16 1xn0 h TYR 377 CO 0.44 0.20 -0.07 1.15 -1.64 0.00 0.00 178.16 178.24 1xn0 h THR 378 N 0.69 0.45 -0.25 1.81 2.02 -1.99 -1.27 112.91 114.37 1xn0 h THR 378 Ca 0.52 -0.02 -0.17 0.00 0.77 0.00 0.00 66.41 67.51 1xn0 h THR 378 Cb 0.79 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1xn0 h THR 378 CO -0.38 0.01 -0.53 0.44 0.37 0.00 0.00 175.52 175.43 1xn0 h ASP 379 N 0.06 0.80 -0.20 4.18 3.32 -1.84 -2.61 116.42 120.13 1xn0 h ASP 379 Ca 0.30 -0.42 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1xn0 h ASP 379 Cb 0.48 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1xn0 h ASP 379 CO -0.56 1.18 0.04 0.03 -1.72 0.00 0.00 179.24 178.20 1xn0 h ARG 380 N 0.56 0.33 0.00 3.56 3.08 -1.03 -2.50 114.38 118.39 1xn0 h ARG 380 Ca 0.02 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 1xn0 h ARG 380 Cb 1.10 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 1xn0 h ARG 380 CO 0.11 0.48 -0.13 0.97 -1.07 0.00 0.00 179.97 180.33 1xn0 h ILE 381 N 0.13 0.29 -0.34 2.04 6.09 -1.34 -1.65 117.51 122.74 1xn0 h ILE 381 Ca 0.06 -0.96 -0.15 0.00 -1.37 0.00 0.00 64.86 62.45 1xn0 h ILE 381 Cb 0.30 1.75 -0.01 0.00 0.47 0.00 0.00 36.82 39.34 1xn0 h ILE 381 CO 0.00 0.13 -0.37 -0.61 -3.07 0.00 0.00 178.15 174.23 1xn0 h GLN 382 N 0.00 0.80 -0.13 2.19 4.15 -1.28 0.05 115.11 120.88 1xn0 h GLN 382 Ca -0.00 -0.40 -0.08 0.00 0.77 0.00 0.00 58.65 58.94 1xn0 h GLN 382 Cb 0.74 0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.44 1xn0 h GLN 382 CO 0.02 1.03 -0.22 0.28 -1.93 0.00 0.00 178.83 178.01 1xn0 h VAL 383 N 0.66 1.37 -0.29 2.39 2.07 -1.17 -2.75 116.25 118.53 1xn0 h VAL 383 Ca 0.06 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.12 1xn0 h VAL 383 Cb 0.93 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 1xn0 h VAL 383 CO 0.09 0.43 0.15 -0.07 0.02 0.00 0.00 177.57 178.19 1xn0 h LEU 384 N -0.01 0.24 -0.46 2.57 3.38 -1.26 0.44 115.31 120.21 1xn0 h LEU 384 Ca 0.01 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.07 1xn0 h LEU 384 Cb 0.80 -0.04 -0.10 0.00 0.09 0.00 0.00 40.66 41.41 1xn0 h LEU 384 CO 0.05 0.18 -0.36 0.03 0.09 0.00 0.00 178.44 178.43 1xn0 h ARG 385 N 0.32 -0.24 -0.09 1.13 3.08 -1.01 -1.77 114.38 115.79 1xn0 h ARG 385 Ca 0.11 0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 1xn0 h ARG 385 Cb 0.02 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1xn0 h ARG 385 CO -0.07 -0.16 -0.28 -0.91 -1.07 0.00 0.00 179.97 177.48 1xn0 h ASN 386 N -0.25 0.17 -0.30 7.04 2.35 -1.19 -2.45 115.58 120.94 1xn0 h ASN 386 Ca 0.18 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 1xn0 h ASN 386 Cb 0.56 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 1xn0 h ASN 386 CO -0.59 0.45 0.03 -0.03 -1.65 0.00 0.00 177.43 175.64 1xn0 h MET 387 N 0.15 0.52 -0.17 0.81 4.05 -0.22 -0.26 114.93 119.82 1xn0 h MET 387 Ca 0.02 -0.15 -0.10 0.00 -0.28 0.00 0.00 59.70 59.20 1xn0 h MET 387 Cb 0.58 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 1xn0 h MET 387 CO 0.04 0.64 -0.31 0.28 0.23 0.00 0.00 176.91 177.79 1xn0 h VAL 388 N 0.33 1.27 -0.18 -5.77 2.07 -1.20 -0.71 116.25 112.06 1xn0 h VAL 388 Ca 0.09 -1.33 -0.14 0.00 0.82 0.00 0.00 66.70 66.14 1xn0 h VAL 388 Cb 0.39 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1xn0 h VAL 388 CO 0.01 0.41 -0.49 -0.74 0.02 0.00 0.00 177.57 176.78 1xn0 h HIS 389 N 0.29 0.58 -0.31 1.57 6.17 -1.29 -0.70 115.15 121.47 1xn0 h HIS 389 Ca 0.04 -0.19 -0.13 0.00 0.71 0.00 0.00 60.37 60.80 1xn0 h HIS 389 Cb 0.70 -0.12 -0.00 0.00 2.52 0.00 0.00 27.41 30.51 1xn0 h HIS 389 CO 0.02 0.87 -0.31 0.00 0.71 0.00 0.00 177.93 179.22 1xn0 h ALA 391 N 0.72 1.16 -0.88 0.00 0.00 -0.88 -0.39 119.26 118.99 1xn0 h ALA 391 Ca 0.05 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xn0 h ALA 391 Cb 0.88 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1xn0 h ALA 391 CO 0.08 0.48 0.55 0.22 0.00 0.00 0.00 179.25 180.58 1xn0 h ASP 392 N 1.17 1.03 -0.97 0.00 -0.00 -0.99 -2.87 116.42 113.79 1xn0 h ASP 392 Ca 0.34 -0.05 -0.61 0.00 -0.00 0.00 0.00 57.03 56.72 1xn0 h ASP 392 Cb -0.07 -0.26 -0.30 0.00 -0.00 0.00 0.00 39.33 38.71 1xn0 h ASP 392 CO -0.09 0.78 0.70 0.18 -0.00 0.00 0.00 179.24 180.81 1xn0 n LEU 393 N -4.38 7.18 -0.24 2.28 4.77 -0.59 -4.59 117.00 121.43 1xn0 n LEU 393 Ca 0.10 -4.09 0.11 0.00 -0.03 0.00 0.00 56.01 52.10 1xn0 n LEU 393 Cb 0.05 -0.90 0.08 0.00 -2.33 0.00 0.00 43.42 40.32 1xn0 n LEU 393 CO 0.37 1.36 0.30 -1.54 -1.33 0.00 0.00 177.39 176.56 1xn0 n SER 394 N -0.99 1.32 -0.22 -1.43 3.41 -0.26 -4.53 113.62 110.92 1xn0 n SER 394 Ca 0.60 -1.07 0.03 0.00 -0.26 0.00 0.00 58.87 58.18 1xn0 n SER 394 Cb 1.00 0.52 0.14 0.00 -0.26 0.00 0.00 64.21 65.60 1xn0 n SER 394 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1xn0 h ASN 395 N 1.17 -0.15 0.45 4.04 -0.26 -1.82 -1.17 115.58 117.84 1xn0 h ASN 395 Ca 0.00 0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 1xn0 h ASN 395 Cb 0.60 0.24 0.00 0.00 -1.06 0.00 0.00 38.32 38.10 1xn0 h ASN 395 CO 0.00 -0.08 0.00 -2.65 -1.06 0.00 0.00 177.43 173.64 1xn0 n PRO 396 N -5.23 0.03 0.00 0.81 -0.02 -1.26 -2.62 135.00 126.72 1xn0 n PRO 396 Ca 0.11 0.32 0.13 0.00 -2.02 0.00 0.00 63.50 62.04 1xn0 n PRO 396 Cb 0.40 -1.57 0.31 0.00 -0.02 0.00 0.00 33.50 32.62 1xn0 n PRO 396 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1xn0 n THR 397 N -1.63 0.00 -2.64 3.45 -2.24 -0.44 -4.20 114.28 106.58 1xn0 n THR 397 Ca 0.03 -0.36 -0.22 0.00 -2.27 0.00 0.00 64.05 61.23 1xn0 n THR 397 Cb 0.15 0.98 0.06 0.00 -2.10 0.00 0.00 70.33 69.43 1xn0 n THR 397 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1xn0 s LYS 398 N -2.03 2.20 0.52 -0.78 -0.14 -1.08 -4.67 119.74 113.76 1xn0 s LYS 398 Ca 0.32 -0.96 -0.22 0.00 -1.36 0.00 0.00 55.97 53.75 1xn0 s LYS 398 Cb 0.20 -2.44 -0.07 0.00 -1.68 0.00 0.00 37.83 33.85 1xn0 s LYS 398 CO 0.33 -1.00 1.23 -1.13 -0.76 0.00 0.00 175.35 174.02 1xn0 n SER 399 N -2.52 2.14 -0.28 2.83 3.41 -1.26 -4.59 113.62 113.35 1xn0 n SER 399 Ca 0.11 0.98 0.09 0.00 -0.26 0.00 0.00 58.87 59.80 1xn0 n SER 399 Cb 0.60 -1.50 0.23 0.00 -0.26 0.00 0.00 64.21 63.29 1xn0 n SER 399 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1xn0 h LEU 400 N 1.41 -0.07 -0.70 1.04 5.85 -1.95 0.01 115.31 120.90 1xn0 h LEU 400 Ca -0.49 0.18 0.10 0.00 0.84 0.00 0.00 57.88 58.52 1xn0 h LEU 400 Cb 1.32 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 42.54 1xn0 h LEU 400 CO 0.56 -0.13 0.33 -0.08 -0.34 0.00 0.00 178.44 178.78 1xn0 h GLU 401 N 0.21 0.53 -0.09 1.25 4.81 -2.01 -1.07 114.58 118.21 1xn0 h GLU 401 Ca 0.49 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.62 1xn0 h GLU 401 Cb 0.93 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1xn0 h GLU 401 CO -0.62 0.35 -0.21 -0.07 -0.73 0.00 0.00 179.01 177.73 1xn0 h LEU 402 N 0.54 0.33 -0.78 1.64 3.38 -1.41 -3.25 115.31 115.76 1xn0 h LEU 402 Ca 0.36 -0.58 0.08 0.00 0.09 0.00 0.00 57.88 57.83 1xn0 h LEU 402 Cb 0.42 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.00 1xn0 h LEU 402 CO -0.30 0.85 0.44 0.22 0.09 0.00 0.00 178.44 179.75 1xn0 h TYR 403 N -0.18 0.80 -0.19 1.13 3.20 -0.78 -2.31 116.97 118.65 1xn0 h TYR 403 Ca -0.00 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.81 1xn0 h TYR 403 Cb 0.81 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 1xn0 h TYR 403 CO 0.11 0.34 -0.26 0.00 -1.64 0.00 0.00 178.16 176.72 1xn0 h ARG 404 N 0.76 0.35 -0.21 1.82 3.08 -1.27 -0.37 114.38 118.54 1xn0 h ARG 404 Ca 0.37 -0.13 -0.17 0.00 0.07 0.00 0.00 59.98 60.13 1xn0 h ARG 404 Cb 0.31 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 1xn0 h ARG 404 CO -0.23 0.59 -0.55 1.96 -1.07 0.00 0.00 179.97 180.67 1xn0 h GLN 405 N 0.32 0.64 -0.49 0.04 4.20 -1.49 -1.15 115.11 117.17 1xn0 h GLN 405 Ca 0.05 -0.41 -0.09 0.00 0.06 0.00 0.00 58.65 58.26 1xn0 h GLN 405 Cb 0.62 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 1xn0 h GLN 405 CO 0.04 1.02 -0.06 -1.49 -0.67 0.00 0.00 178.83 177.67 1xn0 h TRP 406 N 0.49 0.95 -0.23 2.96 -0.00 -0.93 -2.18 115.95 117.02 1xn0 h TRP 406 Ca 0.01 -0.17 -0.03 0.00 -0.00 0.00 0.00 58.89 58.71 1xn0 h TRP 406 Cb 1.11 -0.25 -0.01 0.00 -0.00 0.00 0.00 29.16 30.02 1xn0 h TRP 406 CO 0.05 0.90 0.04 1.15 -0.00 0.00 0.00 178.44 180.58 1xn0 h THR 407 N 0.80 1.22 -1.00 1.49 2.02 -0.94 -1.35 112.91 115.15 1xn0 h THR 407 Ca 0.14 -0.73 0.14 0.00 0.77 0.00 0.00 66.41 66.73 1xn0 h THR 407 Cb 0.56 1.27 -0.09 0.00 -1.74 0.00 0.00 68.15 68.15 1xn0 h THR 407 CO 0.03 0.23 0.62 0.44 0.37 0.00 0.00 175.52 177.22 1xn0 h ASP 408 N 0.18 0.87 -0.05 4.18 3.32 -1.09 -1.86 116.42 121.98 1xn0 h ASP 408 Ca 0.07 0.06 -0.18 0.00 0.02 0.00 0.00 57.03 57.00 1xn0 h ASP 408 Cb 0.31 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.76 1xn0 h ASP 408 CO 0.00 0.42 -0.66 0.03 -1.72 0.00 0.00 179.24 177.32 1xn0 h ARG 409 N 0.91 0.53 -0.21 3.56 3.08 -0.91 -2.27 114.38 119.07 1xn0 h ARG 409 Ca 0.52 -0.51 -0.09 0.00 0.07 0.00 0.00 59.98 59.97 1xn0 h ARG 409 Cb 0.62 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 1xn0 h ARG 409 CO -0.29 1.14 -0.26 0.97 -1.07 0.00 0.00 179.97 180.45 1xn0 h ILE 410 N 0.11 1.26 -0.23 2.04 6.09 -1.11 -1.92 117.51 123.75 1xn0 h ILE 410 Ca -0.07 -1.25 -0.09 0.00 -1.37 0.00 0.00 64.86 62.08 1xn0 h ILE 410 Cb 1.33 1.39 -0.00 0.00 0.47 0.00 0.00 36.82 40.01 1xn0 h ILE 410 CO 0.13 0.39 -0.22 0.24 -3.07 0.00 0.00 178.15 175.62 1xn0 h MET 411 N 0.36 0.56 -0.43 2.19 2.86 -1.33 0.01 114.93 119.15 1xn0 h MET 411 Ca 0.05 -0.29 0.09 0.00 -2.06 0.00 0.00 59.70 57.49 1xn0 h MET 411 Cb 0.65 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 32.24 1xn0 h MET 411 CO 0.05 0.88 -0.12 1.49 1.06 0.00 0.00 176.91 180.27 1xn0 h GLU 412 N 0.26 -0.01 -0.19 1.72 4.81 -1.29 0.12 114.58 119.99 1xn0 h GLU 412 Ca 0.04 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1xn0 h GLU 412 Cb 0.77 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1xn0 h GLU 412 CO 0.05 -0.01 0.06 1.49 -0.73 0.00 0.00 179.01 179.87 1xn0 h GLU 413 N -0.02 0.30 -0.85 1.92 4.81 -1.12 -1.81 114.58 117.82 1xn0 h GLU 413 Ca 0.21 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1xn0 h GLU 413 Cb 0.33 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 1xn0 h GLU 413 CO -0.45 0.42 0.42 0.74 -0.73 0.00 0.00 179.01 179.40 1xn0 h PHE 414 N 0.14 1.22 -0.14 0.92 -1.00 -0.75 -2.15 116.94 115.18 1xn0 h PHE 414 Ca 0.06 -0.06 -0.13 0.00 2.81 0.00 0.00 57.97 60.66 1xn0 h PHE 414 Cb 0.24 -0.38 -0.01 0.00 3.61 0.00 0.00 35.95 39.41 1xn0 h PHE 414 CO 0.00 0.88 -0.47 0.74 -1.61 0.00 0.00 178.31 177.85 1xn0 h PHE 415 N 1.21 0.42 -0.68 -0.55 0.04 -0.69 -1.54 116.94 115.15 1xn0 h PHE 415 Ca 0.29 -0.13 -0.05 0.00 2.80 0.00 0.00 57.97 60.89 1xn0 h PHE 415 Cb 0.11 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 1xn0 h PHE 415 CO 0.01 0.76 0.24 0.37 -0.60 0.00 0.00 178.31 179.09 1xn0 h GLN 416 N 0.28 1.02 -0.38 1.51 4.15 -1.07 -0.49 115.11 120.13 1xn0 h GLN 416 Ca 0.02 -0.19 -0.05 0.00 0.77 0.00 0.00 58.65 59.20 1xn0 h GLN 416 Cb 0.94 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.45 1xn0 h GLN 416 CO 0.08 0.85 0.06 0.37 -1.93 0.00 0.00 178.83 178.26 1xn0 h GLN 417 N 0.99 0.64 -0.94 1.69 4.15 -1.10 -2.09 115.11 118.45 1xn0 h GLN 417 Ca 0.23 -0.17 0.05 0.00 0.77 0.00 0.00 58.65 59.52 1xn0 h GLN 417 Cb 0.23 -0.07 -0.06 0.00 0.21 0.00 0.00 27.48 27.79 1xn0 h GLN 417 CO -0.01 0.70 0.61 0.78 -1.93 0.00 0.00 178.83 178.97 1xn0 h GLY 418 N 0.48 1.40 1.08 2.39 0.00 -0.78 0.10 103.07 107.74 1xn0 h GLY 418 Ca 0.12 -0.45 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 1xn0 h GLY 418 CO 0.01 0.36 0.22 -0.55 0.00 0.00 0.00 176.54 176.58 1xn0 h ASP 419 N 1.15 1.07 -0.15 0.19 3.32 -0.84 -1.56 116.42 119.60 1xn0 h ASP 419 Ca 0.39 -0.21 -0.11 0.00 0.02 0.00 0.00 57.03 57.13 1xn0 h ASP 419 Cb 0.07 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1xn0 h ASP 419 CO -0.14 1.00 -0.25 0.11 -1.72 0.00 0.00 179.24 178.23 1xn0 h LYS 420 N 1.09 0.60 -0.07 3.56 1.57 -0.67 -0.71 116.57 121.95 1xn0 h LYS 420 Ca 0.24 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xn0 h LYS 420 Cb 0.32 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 1xn0 h LYS 420 CO -0.01 0.80 0.03 0.93 -0.57 0.00 0.00 179.45 180.64 1xn0 h GLU 421 N 0.53 0.10 -0.27 3.15 5.08 -0.62 -2.69 114.58 119.86 1xn0 h GLU 421 Ca 0.07 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1xn0 h GLU 421 Cb 0.72 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1xn0 h GLU 421 CO 0.06 0.21 0.18 -0.09 -1.00 0.00 0.00 179.01 178.37 1xn0 h ARG 422 N -0.04 0.36 -0.96 2.33 2.43 -1.15 -2.02 114.38 115.33 1xn0 h ARG 422 Ca 0.02 -0.02 0.19 0.00 -0.81 0.00 0.00 59.98 59.36 1xn0 h ARG 422 Cb 0.15 -0.08 -0.11 0.00 -0.42 0.00 0.00 29.97 29.51 1xn0 h ARG 422 CO -0.00 0.24 0.54 0.93 -1.51 0.00 0.00 179.97 180.17 1xn0 h GLU 423 N 0.37 0.64 -0.01 0.20 5.08 -1.00 -0.94 114.58 118.92 1xn0 h GLU 423 Ca 0.10 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1xn0 h GLU 423 Cb -0.04 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1xn0 h GLU 423 CO -0.02 0.43 -0.06 0.54 -1.00 0.00 0.00 179.01 178.89 1xn0 n ARG 424 N -4.84 1.26 -2.44 2.33 1.74 -1.01 -4.94 116.66 108.75 1xn0 n ARG 424 Ca 0.22 -0.62 -0.10 0.00 -0.77 0.00 0.00 57.85 56.59 1xn0 n ARG 424 Cb 0.57 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.54 1xn0 n ARG 424 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xn0 n GLY 425 N 1.19 0.09 3.96 -0.13 0.00 -0.36 -5.04 105.19 104.91 1xn0 n GLY 425 Ca 0.18 -0.42 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 1xn0 n GLY 425 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xn0 s MET 426 N -4.83 3.29 0.25 1.61 -1.94 -0.80 -5.05 119.30 111.83 1xn0 s MET 426 Ca 0.09 -0.61 -0.30 0.00 -1.71 0.00 0.00 55.69 53.16 1xn0 s MET 426 Cb -0.04 -2.72 -0.10 0.00 2.01 0.00 0.00 34.83 33.99 1xn0 s MET 426 CO 0.11 0.09 1.37 -1.21 -0.01 0.00 0.00 175.02 175.36 1xn0 s GLU 427 N -4.27 4.33 -0.05 2.03 2.02 -1.26 -4.46 118.70 117.03 1xn0 s GLU 427 Ca 0.42 2.20 -0.26 0.00 0.02 0.00 0.00 54.97 57.34 1xn0 s GLU 427 Cb -0.10 -3.13 -0.03 0.00 0.10 0.00 0.00 34.13 30.97 1xn0 s GLU 427 CO 0.34 -0.31 0.81 0.42 0.02 0.00 0.00 175.26 176.54 1xn0 s ILE 428 N -0.17 4.97 0.09 -1.63 1.01 -1.26 -4.92 121.20 119.29 1xn0 s ILE 428 Ca 0.56 1.68 -0.31 0.00 0.00 0.00 0.00 60.65 62.59 1xn0 s ILE 428 Cb -0.39 -4.15 -0.09 0.00 0.01 0.00 0.00 42.46 37.84 1xn0 s ILE 428 CO 0.43 0.20 1.71 -0.44 0.00 0.00 0.00 174.94 176.84 1xn0 s SER 429 N 0.91 6.55 0.45 3.58 0.01 -1.26 -4.90 113.70 119.03 1xn0 s SER 429 Ca 0.43 2.57 0.18 0.00 1.31 0.00 0.00 55.95 60.43 1xn0 s SER 429 Cb -0.19 -2.56 1.12 0.00 0.21 0.00 0.00 66.02 64.60 1xn0 s SER 429 CO 0.21 -0.92 1.93 -0.65 0.41 0.00 0.00 173.24 174.22 1xn0 h PRO 430 N 8.40 0.33 -1.87 12.44 0.11 -2.02 -2.43 132.00 146.96 1xn0 h PRO 430 Ca -0.44 -0.02 -0.41 0.00 0.11 0.00 0.00 66.00 65.24 1xn0 h PRO 430 Cb 1.21 -0.07 -0.15 0.00 0.11 0.00 0.00 31.00 32.09 1xn0 h PRO 430 CO 0.94 0.22 0.31 -1.33 -0.21 0.00 0.00 178.00 177.92 1xn0 n MET 431 N -4.46 2.17 -2.25 1.05 2.81 -1.26 -4.38 117.12 110.80 1xn0 n MET 431 Ca 0.13 -1.95 0.00 0.00 -1.81 0.00 0.00 57.70 54.07 1xn0 n MET 431 Cb 0.54 -1.96 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 1xn0 n MET 431 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1xn0 n ASP 433 N 0.91 -3.09 0.22 7.83 -0.08 -0.92 -4.77 116.55 116.64 1xn0 n ASP 433 Ca 0.42 0.89 0.15 0.00 -1.51 0.00 0.00 54.79 54.75 1xn0 n ASP 433 Cb 0.60 -1.38 0.65 0.00 2.34 0.00 0.00 41.12 43.33 1xn0 n ASP 433 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1xn0 h LYS 434 N 4.30 0.00 0.00 -0.67 2.10 -1.89 -1.54 116.57 118.87 1xn0 h LYS 434 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xn0 h LYS 434 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1xn0 h LYS 434 CO 0.00 0.00 -0.19 0.45 -2.00 0.00 0.00 179.45 177.71 1xn0 h HIS 435 N 0.00 0.00 0.00 0.07 3.86 -2.01 -3.41 115.15 113.67 1xn0 h HIS 435 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1xn0 h HIS 435 Cb 0.36 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.83 1xn0 h HIS 435 CO 0.00 0.00 -0.55 2.41 0.86 0.00 0.00 177.93 180.65 1xn0 n THR 436 N -2.62 0.00 -2.15 2.45 -1.04 -1.15 -5.08 114.28 104.69 1xn0 n THR 436 Ca 0.04 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.63 1xn0 n THR 436 Cb 0.48 -0.38 -0.03 0.00 -1.82 0.00 0.00 70.33 68.58 1xn0 n THR 436 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xn0 s ALA 437 N -1.55 3.60 -0.16 2.41 0.00 -0.59 -4.99 121.76 120.48 1xn0 s ALA 437 Ca 0.00 1.00 -0.27 0.00 0.00 0.00 0.00 51.96 52.70 1xn0 s ALA 437 Cb 0.00 -3.60 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 1xn0 s ALA 437 CO 0.00 -0.87 0.89 0.45 0.00 0.00 0.00 175.76 176.23 1xn0 s SER 438 N 1.78 7.04 0.22 0.00 0.15 -1.26 -4.93 113.70 116.69 1xn0 s SER 438 Ca 0.66 1.28 -0.08 0.00 0.70 0.00 0.00 55.95 58.51 1xn0 s SER 438 Cb -0.34 -2.49 0.17 0.00 -1.71 0.00 0.00 66.02 61.65 1xn0 s SER 438 CO 0.28 -0.43 1.80 0.58 1.20 0.00 0.00 173.24 176.67 1xn0 h VAL 439 N 5.19 1.26 0.12 4.45 2.07 -1.99 -2.58 116.25 124.76 1xn0 h VAL 439 Ca -0.29 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1xn0 h VAL 439 Cb 1.13 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1xn0 h VAL 439 CO 0.85 0.32 -0.06 -0.33 0.02 0.00 0.00 177.57 178.38 1xn0 h GLU 440 N 1.17 -0.15 -0.90 1.57 3.07 -1.92 -2.63 114.58 114.79 1xn0 h GLU 440 Ca 0.28 0.01 0.06 0.00 -0.50 0.00 0.00 59.36 59.21 1xn0 h GLU 440 Cb 0.15 0.03 -0.06 0.00 -0.84 0.00 0.00 28.75 28.04 1xn0 h GLU 440 CO -0.03 0.25 0.59 0.87 -1.40 0.00 0.00 179.01 179.28 1xn0 h LYS 441 N -0.59 1.00 -0.23 2.33 1.57 -1.87 -2.01 116.57 116.77 1xn0 h LYS 441 Ca -0.02 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1xn0 h LYS 441 Cb 0.47 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1xn0 h LYS 441 CO 0.03 0.66 -0.20 0.77 -0.57 0.00 0.00 179.45 180.14 1xn0 h SER 442 N 1.03 0.39 -0.10 0.86 0.02 -1.36 -1.22 113.55 113.17 1xn0 h SER 442 Ca 0.38 -0.11 -0.21 0.00 -0.84 0.00 0.00 61.79 61.01 1xn0 h SER 442 Cb 0.18 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 62.62 1xn0 h SER 442 CO -0.14 0.60 -0.74 1.56 -1.14 0.00 0.00 176.83 176.97 1xn0 h GLN 443 N 0.36 0.68 -0.72 3.45 1.08 -1.04 -0.73 115.11 118.21 1xn0 h GLN 443 Ca 0.06 -0.60 0.00 0.00 -1.45 0.00 0.00 58.65 56.67 1xn0 h GLN 443 Cb 0.56 0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 28.09 1xn0 h GLN 443 CO 0.04 1.21 0.47 0.28 -0.95 0.00 0.00 178.83 179.87 1xn0 h VAL 444 N 0.36 1.19 -0.43 -0.54 2.07 -1.20 0.34 116.25 118.04 1xn0 h VAL 444 Ca -0.06 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1xn0 h VAL 444 Cb 1.39 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1xn0 h VAL 444 CO 0.15 0.19 0.20 1.23 0.02 0.00 0.00 177.57 179.35 1xn0 h GLY 445 N 0.97 0.67 1.01 2.17 0.00 -1.17 0.46 103.07 107.19 1xn0 h GLY 445 Ca 0.26 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1xn0 h GLY 445 CO -0.06 0.32 0.56 -2.75 0.00 0.00 0.00 176.54 174.62 1xn0 h PHE 446 N 0.55 1.16 -0.01 5.60 3.57 -0.65 -0.29 116.94 126.87 1xn0 h PHE 446 Ca 0.15 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 1xn0 h PHE 446 Cb 0.14 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 38.49 1xn0 h PHE 446 CO -0.01 0.75 -0.01 0.82 -2.23 0.00 0.00 178.31 177.64 1xn0 h ILE 447 N 1.22 1.42 -0.80 1.41 2.04 -0.65 -1.23 117.51 120.93 1xn0 h ILE 447 Ca 0.32 -1.24 -0.03 0.00 1.00 0.00 0.00 64.86 64.92 1xn0 h ILE 447 Cb -0.09 2.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 1xn0 h ILE 447 CO -0.06 0.32 0.39 0.44 0.00 0.00 0.00 178.15 179.24 1xn0 h ASP 448 N -0.50 1.03 0.06 1.72 3.32 -0.71 0.78 116.42 122.12 1xn0 h ASP 448 Ca 0.00 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1xn0 h ASP 448 Cb 0.53 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1xn0 h ASP 448 CO 0.00 0.87 -1.36 -1.22 -1.72 0.00 0.00 179.24 175.82 1xn0 n TYR 449 N -4.37 0.04 0.08 4.55 4.02 -0.14 -4.47 117.16 116.87 1xn0 n TYR 449 Ca 0.07 0.01 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 1xn0 n TYR 449 Cb 0.13 -0.24 0.00 0.00 -0.02 0.00 0.00 39.34 39.21 1xn0 n TYR 449 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1xn0 n ILE 450 N -1.83 0.30 0.12 -0.72 -0.00 -0.77 -4.82 119.36 111.64 1xn0 n ILE 450 Ca 0.01 0.10 -0.13 0.00 -0.00 0.00 0.00 62.75 62.73 1xn0 n ILE 450 Cb 0.43 -0.88 -0.08 0.00 -0.00 0.00 0.00 39.64 39.11 1xn0 n ILE 450 CO 0.00 0.00 0.00 0.58 -0.00 0.00 0.00 176.55 177.13 1xn0 h VAL 451 N 0.00 0.83 0.29 1.39 2.07 -1.26 -2.81 116.25 116.77 1xn0 h VAL 451 Ca 0.00 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 1xn0 h VAL 451 Cb 0.11 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1xn0 h VAL 451 CO 0.00 0.14 -0.18 -0.74 0.02 0.00 0.00 177.57 176.82 1xn0 h HIS 452 N -0.68 -0.46 -1.00 1.57 -0.00 -1.08 -1.08 115.15 112.42 1xn0 h HIS 452 Ca -0.03 -0.01 0.22 0.00 -0.00 0.00 0.00 60.37 60.55 1xn0 h HIS 452 Cb 0.48 0.16 -0.11 0.00 -0.00 0.00 0.00 27.41 27.94 1xn0 h HIS 452 CO 0.03 -0.28 0.62 -1.35 -0.00 0.00 0.00 177.93 176.96 1xn0 h PRO 453 N -0.45 0.59 -0.02 5.26 0.11 -1.75 0.65 132.00 136.38 1xn0 h PRO 453 Ca -0.03 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 1xn0 h PRO 453 Cb 0.37 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.35 1xn0 h PRO 453 CO 0.03 0.39 -0.02 1.25 -0.21 0.00 0.00 178.00 179.45 1xn0 h LEU 454 N 0.61 0.06 -0.65 2.35 5.85 -1.15 -3.09 115.31 119.28 1xn0 h LEU 454 Ca 0.59 -0.47 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 1xn0 h LEU 454 Cb 1.13 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 1xn0 h LEU 454 CO -0.37 0.52 -0.54 -0.50 -0.34 0.00 0.00 178.44 177.21 1xn0 h TRP 455 N -0.40 0.00 -0.84 1.25 4.06 -0.81 -1.27 115.95 117.93 1xn0 h TRP 455 Ca 0.00 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.92 1xn0 h TRP 455 Cb 0.50 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.62 1xn0 h TRP 455 CO 0.09 0.54 0.41 1.49 -3.56 0.00 0.00 178.44 177.40 1xn0 h GLU 456 N 0.00 1.21 -0.12 0.49 4.81 -0.96 0.23 114.58 120.23 1xn0 h GLU 456 Ca -0.01 -0.17 -0.23 0.00 -0.13 0.00 0.00 59.36 58.82 1xn0 h GLU 456 Cb 1.12 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 30.30 1xn0 h GLU 456 CO 0.07 0.92 -0.82 1.15 -0.73 0.00 0.00 179.01 179.60 1xn0 h THR 457 N 1.20 1.28 -0.38 0.32 2.02 -1.39 -2.44 112.91 113.52 1xn0 h THR 457 Ca 0.29 -2.02 -0.03 0.00 0.77 0.00 0.00 66.41 65.43 1xn0 h THR 457 Cb 0.11 2.06 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 1xn0 h THR 457 CO -0.04 0.64 0.13 -0.25 0.37 0.00 0.00 175.52 176.37 1xn0 h TRP 458 N 0.50 0.59 -0.89 3.16 2.91 -1.00 -2.31 115.95 118.91 1xn0 h TRP 458 Ca -0.07 -0.05 0.15 0.00 1.13 0.00 0.00 58.89 60.05 1xn0 h TRP 458 Cb 1.46 -0.17 -0.07 0.00 -0.51 0.00 0.00 29.16 29.86 1xn0 h TRP 458 CO 0.09 0.55 0.58 0.00 -1.03 0.00 0.00 178.44 178.63 1xn0 h ALA 459 N 0.98 1.84 -0.44 2.65 0.00 -0.49 -1.30 119.26 122.49 1xn0 h ALA 459 Ca 0.12 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1xn0 h ALA 459 Cb 0.23 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1xn0 h ALA 459 CO -0.01 -0.09 0.13 -0.44 0.00 0.00 0.00 179.25 178.84 1xn0 h ASP 460 N 0.68 0.66 -0.09 0.00 5.19 -0.92 -1.01 116.42 120.93 1xn0 h ASP 460 Ca 0.45 -0.22 -0.04 0.00 -0.62 0.00 0.00 57.03 56.60 1xn0 h ASP 460 Cb 0.74 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.06 1xn0 h ASP 460 CO -0.21 0.70 -0.05 0.25 -3.12 0.00 0.00 179.24 176.81 1xn0 h LEU 461 N 0.58 0.30 -2.93 1.55 5.85 -0.83 -3.24 115.31 116.58 1xn0 h LEU 461 Ca 0.14 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1xn0 h LEU 461 Cb 0.29 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 1xn0 h LEU 461 CO -0.00 0.39 -0.44 1.33 -0.34 0.00 0.00 178.44 179.38 1xn0 n VAL 462 N -4.31 1.68 -2.00 1.05 0.24 -0.98 -4.92 118.33 109.09 1xn0 n VAL 462 Ca 0.00 -2.48 -0.37 0.00 -2.04 0.00 0.00 64.34 59.45 1xn0 n VAL 462 Cb 0.23 -0.02 0.03 0.00 -1.47 0.00 0.00 33.84 32.60 1xn0 n VAL 462 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xn0 s GLN 463 N -2.49 3.17 -0.22 7.34 -2.07 -0.39 -1.00 119.66 124.00 1xn0 s GLN 463 Ca 0.33 1.93 0.06 0.00 -1.82 0.00 0.00 55.36 55.86 1xn0 s GLN 463 Cb 0.33 -2.11 0.47 0.00 -1.09 0.00 0.00 33.01 30.61 1xn0 s GLN 463 CO -0.05 -1.07 1.43 -0.35 -1.32 0.00 0.00 175.29 173.93 1xn0 n PRO 464 N -1.22 2.65 -0.21 9.60 -0.04 -1.26 -4.96 135.00 139.56 1xn0 n PRO 464 Ca 0.12 -1.95 0.08 0.00 -0.04 0.00 0.00 63.50 61.70 1xn0 n PRO 464 Cb 0.48 -1.87 0.35 0.00 -0.04 0.00 0.00 33.50 32.42 1xn0 n PRO 464 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xn0 h ASP 465 N 1.60 0.67 -0.54 3.54 3.32 -1.38 -2.94 116.42 120.70 1xn0 h ASP 465 Ca 0.20 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 1xn0 h ASP 465 Cb 1.81 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 41.18 1xn0 h ASP 465 CO 0.50 0.42 0.07 0.00 -1.72 0.00 0.00 179.24 178.51 1xn0 n ALA 466 N -2.44 3.91 -0.12 3.45 0.00 -1.26 -4.63 120.51 119.41 1xn0 n ALA 466 Ca 0.12 -2.18 -0.07 0.00 0.00 0.00 0.00 53.44 51.32 1xn0 n ALA 466 Cb 0.28 -1.05 0.10 0.00 0.00 0.00 0.00 19.45 18.78 1xn0 n ALA 466 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1xn0 h GLN 467 N 3.04 0.83 -0.45 0.00 5.75 -1.88 -2.39 115.11 120.02 1xn0 h GLN 467 Ca 0.08 -0.28 -0.10 0.00 -0.15 0.00 0.00 58.65 58.21 1xn0 h GLN 467 Cb 1.96 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 30.43 1xn0 h GLN 467 CO 0.50 0.90 -0.09 -0.44 -2.65 0.00 0.00 178.83 177.05 1xn0 h ASP 468 N 0.75 0.86 -0.90 -0.69 3.45 -1.85 -1.47 116.42 116.57 1xn0 h ASP 468 Ca 0.13 -0.36 0.11 0.00 0.43 0.00 0.00 57.03 57.34 1xn0 h ASP 468 Cb 0.60 -0.23 -0.08 0.00 -0.56 0.00 0.00 39.33 39.06 1xn0 h ASP 468 CO 0.04 1.01 0.53 0.40 -1.57 0.00 0.00 179.24 179.65 1xn0 h ILE 469 N 0.69 0.90 -0.32 0.35 2.04 -1.84 0.13 117.51 119.46 1xn0 h ILE 469 Ca 0.11 -0.29 -0.15 0.00 1.00 0.00 0.00 64.86 65.53 1xn0 h ILE 469 Cb 0.63 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1xn0 h ILE 469 CO 0.04 0.16 -0.41 0.25 0.00 0.00 0.00 178.15 178.19 1xn0 h LEU 470 N 0.86 0.83 -0.47 1.44 5.85 -1.16 -2.28 115.31 120.38 1xn0 h LEU 470 Ca 0.44 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1xn0 h LEU 470 Cb 0.43 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1xn0 h LEU 470 CO -0.26 1.13 0.13 0.44 -0.34 0.00 0.00 178.44 179.54 1xn0 h ASP 471 N 0.64 0.70 -0.58 1.25 3.32 -0.45 -1.44 116.42 119.85 1xn0 h ASP 471 Ca 0.05 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 1xn0 h ASP 471 Cb 0.97 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.30 1xn0 h ASP 471 CO 0.09 0.74 0.35 0.74 -1.72 0.00 0.00 179.24 179.44 1xn0 h THR 472 N 0.63 1.17 -0.10 0.35 2.02 -0.95 -1.78 112.91 114.26 1xn0 h THR 472 Ca 0.15 -0.40 0.02 0.00 0.77 0.00 0.00 66.41 66.95 1xn0 h THR 472 Cb 0.30 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1xn0 h THR 472 CO -0.00 0.18 -0.04 0.25 0.37 0.00 0.00 175.52 176.28 1xn0 h LEU 473 N 0.78 -0.12 -1.09 2.58 5.85 -1.18 0.11 115.31 122.24 1xn0 h LEU 473 Ca 0.21 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 1xn0 h LEU 473 Cb -0.01 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1xn0 h LEU 473 CO -0.04 -0.05 0.08 -0.33 -0.34 0.00 0.00 178.44 177.76 1xn0 h GLU 474 N -0.02 0.72 -0.34 1.25 5.08 -1.14 0.83 114.58 120.96 1xn0 h GLU 474 Ca 0.05 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 1xn0 h GLU 474 Cb 0.10 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1xn0 h GLU 474 CO -0.11 0.68 -0.03 -0.44 -1.00 0.00 0.00 179.01 178.12 1xn0 h ASP 475 N 0.70 0.62 -0.38 1.42 3.32 -0.96 -2.35 116.42 118.78 1xn0 h ASP 475 Ca 0.15 -0.33 -0.08 0.00 0.02 0.00 0.00 57.03 56.80 1xn0 h ASP 475 Cb 0.31 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1xn0 h ASP 475 CO 0.00 0.80 -0.02 0.78 -1.72 0.00 0.00 179.24 179.08 1xn0 h ASN 476 N 0.42 0.75 -0.75 6.45 2.35 -0.34 -1.86 115.58 122.60 1xn0 h ASN 476 Ca 0.09 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1xn0 h ASN 476 Cb 0.50 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 1xn0 h ASN 476 CO 0.02 0.83 0.45 -0.09 -1.65 0.00 0.00 177.43 176.99 1xn0 h ARG 477 N 0.72 1.02 -0.07 0.81 1.12 -0.77 -2.42 114.38 114.79 1xn0 h ARG 477 Ca 0.14 -0.09 -0.12 0.00 -1.11 0.00 0.00 59.98 58.80 1xn0 h ARG 477 Cb 0.47 -0.21 -0.01 0.00 -0.01 0.00 0.00 29.97 30.20 1xn0 h ARG 477 CO 0.02 0.72 -0.49 -0.91 -3.11 0.00 0.00 179.97 176.21 1xn0 h ASN 478 N 1.03 0.18 -0.09 -3.80 2.35 -1.08 -2.55 115.58 111.61 1xn0 h ASN 478 Ca 0.27 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.92 1xn0 h ASN 478 Cb -0.03 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.28 1xn0 h ASN 478 CO -0.05 0.64 0.01 -0.25 -1.65 0.00 0.00 177.43 176.14 1xn0 h TRP 479 N 0.14 0.16 -0.80 1.19 7.01 -0.94 -1.80 115.95 120.90 1xn0 h TRP 479 Ca 0.01 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.96 1xn0 h TRP 479 Cb 0.92 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.90 1xn0 h TRP 479 CO 0.01 0.35 0.42 1.88 -2.79 0.00 0.00 178.44 178.32 1xn0 h TYR 480 N -0.09 1.11 -0.61 2.65 0.05 -1.43 -2.37 116.97 116.29 1xn0 h TYR 480 Ca 0.03 -0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.82 1xn0 h TYR 480 Cb 0.28 -0.35 -0.04 0.00 1.01 0.00 0.00 36.73 37.62 1xn0 h TYR 480 CO 0.02 0.78 0.35 0.37 -1.05 0.00 0.00 178.16 178.62 1xn0 h GLN 481 N 1.12 0.66 0.00 4.88 5.75 -1.39 -2.42 115.11 123.71 1xn0 h GLN 481 Ca 0.28 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.74 1xn0 h GLN 481 Cb 0.05 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 28.45 1xn0 h GLN 481 CO -0.04 0.43 0.00 0.66 -2.65 0.00 0.00 178.83 177.23 1xn0 h SER 482 N 0.68 0.00 0.46 -0.69 4.64 -0.81 -2.39 113.55 115.43 1xn0 h SER 482 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1xn0 h SER 482 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1xn0 h SER 482 CO -0.13 0.00 -0.23 0.23 -0.87 0.00 0.00 176.83 175.83 1xn0 n MET 483 N -2.48 0.45 -3.27 4.77 2.81 -0.92 -4.78 117.12 113.70 1xn0 n MET 483 Ca 0.02 -0.20 -0.39 0.00 -1.81 0.00 0.00 57.70 55.32 1xn0 n MET 483 Cb 0.26 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.20 1xn0 n MET 483 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1xn0 s ILE 484 N -2.69 5.12 -2.00 2.02 1.01 -0.90 -5.02 121.20 118.75 1xn0 s ILE 484 Ca 0.21 0.90 0.20 0.00 0.00 0.00 0.00 60.65 61.97 1xn0 s ILE 484 Cb 0.19 -3.82 0.58 0.00 0.01 0.00 0.00 42.46 39.42 1xn0 s ILE 484 CO 0.55 0.19 1.60 -2.65 0.00 0.00 0.00 174.94 174.62