#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xlx h ASP 164 N 0.00 0.08 0.07 1.62 3.32 -1.99 -3.01 116.42 116.50 1xlx h ASP 164 Ca 0.00 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 56.87 1xlx h ASP 164 Cb 0.00 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1xlx h ASP 164 CO 0.00 0.87 -0.40 0.45 -1.72 0.00 0.00 179.24 178.45 1xlx h HIS 165 N 0.03 0.51 -0.07 4.55 3.86 -1.99 -1.68 115.15 120.36 1xlx h HIS 165 Ca -0.02 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.04 1xlx h HIS 165 Cb 1.46 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 29.82 1xlx h HIS 165 CO 0.01 0.76 -0.00 1.25 0.86 0.00 0.00 177.93 180.81 1xlx h LEU 166 N 0.36 0.13 -0.58 2.43 5.85 -1.88 -0.89 115.31 120.73 1xlx h LEU 166 Ca 0.03 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1xlx h LEU 166 Cb 0.86 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 1xlx h LEU 166 CO 0.07 0.41 0.31 0.00 -0.34 0.00 0.00 178.44 178.89 1xlx h ALA 167 N 0.72 0.74 -0.64 1.25 0.00 -1.46 0.23 119.26 120.10 1xlx h ALA 167 Ca 0.02 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1xlx h ALA 167 Cb 0.35 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1xlx h ALA 167 CO 0.00 0.27 0.39 -0.22 0.00 0.00 0.00 179.25 179.70 1xlx h LYS 168 N 0.78 0.75 -0.50 0.00 3.64 -1.24 -2.67 116.57 117.33 1xlx h LYS 168 Ca 0.20 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.42 1xlx h LYS 168 Cb 0.07 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 1xlx h LYS 168 CO -0.03 0.49 -0.13 1.49 -2.27 0.00 0.00 179.45 179.00 1xlx h GLU 169 N 0.77 0.97 0.00 1.90 4.57 -0.55 -2.99 114.58 119.25 1xlx h GLU 169 Ca 0.26 -0.38 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 1xlx h GLU 169 Cb 0.04 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1xlx h GLU 169 CO -0.11 1.05 0.00 1.28 -1.18 0.00 0.00 179.01 180.04 1xlx n LEU 170 N -4.18 0.00 0.20 1.64 4.77 0.02 -2.19 117.00 117.25 1xlx n LEU 170 Ca 0.00 0.07 0.05 0.00 -0.03 0.00 0.00 56.01 56.11 1xlx n LEU 170 Cb 0.41 -0.07 0.41 0.00 -2.33 0.00 0.00 43.42 41.84 1xlx n LEU 170 CO 0.45 -0.03 0.75 -0.33 -1.33 0.00 0.00 177.39 176.90 1xlx h GLU 171 N 0.00 0.00 -0.13 3.23 5.08 -1.34 -2.65 114.58 118.77 1xlx h GLU 171 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1xlx h GLU 171 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1xlx h GLU 171 CO 0.00 0.34 0.00 -0.25 -1.00 0.00 0.00 179.01 178.10 1xlx n ASP 172 N -3.78 0.84 -0.34 1.42 8.00 -0.93 -4.58 116.55 117.17 1xlx n ASP 172 Ca -0.01 -1.83 0.18 0.00 0.71 0.00 0.00 54.79 53.84 1xlx n ASP 172 Cb 0.42 -0.09 0.41 0.00 -0.02 0.00 0.00 41.12 41.84 1xlx n ASP 172 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1xlx h LEU 173 N 0.98 0.63 -1.71 0.64 5.85 -1.65 0.57 115.31 120.62 1xlx h LEU 173 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1xlx h LEU 173 Cb 0.22 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1xlx h LEU 173 CO 0.00 0.12 0.00 0.59 -0.34 0.00 0.00 178.44 178.81 1xlx n ASN 174 N -4.80 2.50 -4.54 1.25 3.02 -1.26 -4.83 115.26 106.60 1xlx n ASN 174 Ca 0.26 -1.95 -0.30 0.00 -0.03 0.00 0.00 54.58 52.56 1xlx n ASN 174 Cb 0.76 -0.28 -0.11 0.00 -0.61 0.00 0.00 39.78 39.54 1xlx n ASN 174 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xlx s LYS 175 N -1.44 2.06 0.38 3.52 -0.14 0.19 -4.81 119.74 119.50 1xlx s LYS 175 Ca 0.33 -1.03 0.08 0.00 -1.36 0.00 0.00 55.97 53.98 1xlx s LYS 175 Cb 0.17 -2.25 0.75 0.00 -1.68 0.00 0.00 37.83 34.82 1xlx s LYS 175 CO 0.23 0.51 1.92 2.35 -0.76 0.00 0.00 175.35 179.61 1xlx h TRP 176 N 3.85 0.36 0.00 3.18 -0.00 -1.92 -2.53 115.95 118.90 1xlx h TRP 176 Ca -0.49 -0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.37 1xlx h TRP 176 Cb 1.17 -0.11 0.00 0.00 -0.00 0.00 0.00 29.16 30.22 1xlx h TRP 176 CO 0.59 0.41 0.00 0.41 -0.00 0.00 0.00 178.44 179.85 1xlx n GLY 177 N -0.95 -0.60 3.59 2.65 0.00 -1.26 -4.85 105.19 103.76 1xlx n GLY 177 Ca 0.00 -0.08 -0.46 0.00 0.00 0.00 0.00 46.02 45.48 1xlx n GLY 177 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xlx n LEU 178 N -1.12 1.75 -4.24 0.99 7.94 -0.95 -4.95 117.00 116.41 1xlx n LEU 178 Ca 0.10 1.16 -0.40 0.00 -1.11 0.00 0.00 56.01 55.76 1xlx n LEU 178 Cb 0.08 -1.27 -0.10 0.00 0.53 0.00 0.00 43.42 42.66 1xlx n LEU 178 CO 0.10 -1.32 -0.11 0.21 -1.11 0.00 0.00 177.39 175.16 1xlx s ASN 179 N -0.30 5.58 0.38 1.96 3.84 -1.26 -4.96 114.94 120.17 1xlx s ASN 179 Ca 0.65 -1.61 0.18 0.00 0.21 0.00 0.00 52.86 52.29 1xlx s ASN 179 Cb -0.75 -1.96 0.72 0.00 -0.55 0.00 0.00 41.25 38.70 1xlx s ASN 179 CO 0.56 -0.55 1.76 -0.29 -2.79 0.00 0.00 177.10 175.79 1xlx h ILE 180 N 6.13 0.95 -0.14 -5.21 6.09 -1.97 -3.15 117.51 120.19 1xlx h ILE 180 Ca -0.22 -1.46 -0.01 0.00 -1.37 0.00 0.00 64.86 61.80 1xlx h ILE 180 Cb 1.08 1.87 -0.01 0.00 0.47 0.00 0.00 36.82 40.23 1xlx h ILE 180 CO 0.76 0.37 0.06 -0.26 -3.07 0.00 0.00 178.15 176.00 1xlx h PHE 181 N 0.00 0.22 -0.73 2.19 0.04 -1.95 -2.07 116.94 114.64 1xlx h PHE 181 Ca -0.00 -0.02 0.08 0.00 2.80 0.00 0.00 57.97 60.83 1xlx h PHE 181 Cb 0.84 -0.07 -0.07 0.00 2.20 0.00 0.00 35.95 38.86 1xlx h PHE 181 CO 0.00 0.30 0.39 -0.91 -0.60 0.00 0.00 178.31 177.49 1xlx h ASN 182 N 0.07 0.54 -0.28 2.17 4.21 -1.99 -1.11 115.58 119.20 1xlx h ASN 182 Ca 0.05 0.05 -0.10 0.00 1.21 0.00 0.00 56.30 57.51 1xlx h ASN 182 Cb 0.18 -0.05 -0.02 0.00 -1.12 0.00 0.00 38.32 37.31 1xlx h ASN 182 CO -0.00 0.32 -0.17 -0.37 -1.29 0.00 0.00 177.43 175.91 1xlx h VAL 183 N 0.67 1.26 -0.70 2.81 -1.51 -1.47 -1.51 116.25 115.80 1xlx h VAL 183 Ca 0.35 -1.24 0.01 0.00 -1.23 0.00 0.00 66.70 64.59 1xlx h VAL 183 Cb 0.32 1.15 -0.04 0.00 -2.13 0.00 0.00 31.29 30.59 1xlx h VAL 183 CO -0.24 0.41 0.46 0.00 -1.23 0.00 0.00 177.57 176.97 1xlx h ALA 184 N 1.16 0.89 -0.24 5.19 0.00 -0.67 -1.92 119.26 123.67 1xlx h ALA 184 Ca 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1xlx h ALA 184 Cb 0.65 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1xlx h ALA 184 CO 0.05 0.30 0.01 0.78 0.00 0.00 0.00 179.25 180.39 1xlx h GLY 185 N 0.94 0.37 -2.45 0.00 0.00 -0.53 -2.49 103.07 98.92 1xlx h GLY 185 Ca 0.26 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1xlx h GLY 185 CO -0.06 0.18 0.00 -1.72 0.00 0.00 0.00 176.54 174.94 1xlx n TYR 186 N -4.35 0.93 -1.82 5.60 4.01 -0.63 -4.42 117.16 116.47 1xlx n TYR 186 Ca 0.00 -0.45 0.05 0.00 -0.16 0.00 0.00 57.90 57.35 1xlx n TYR 186 Cb 0.19 -0.03 0.10 0.00 -0.31 0.00 0.00 39.34 39.29 1xlx n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1xlx n SER 187 N 1.35 1.32 -2.69 7.72 3.41 -0.77 -4.38 113.62 119.58 1xlx n SER 187 Ca 0.22 -2.83 -0.22 0.00 -0.26 0.00 0.00 58.87 55.78 1xlx n SER 187 Cb 0.58 -0.38 0.01 0.00 -0.26 0.00 0.00 64.21 64.17 1xlx n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1xlx n HIS 188 N -0.51 -1.49 -3.38 7.33 8.25 -1.25 -2.43 115.22 121.74 1xlx n HIS 188 Ca 0.11 0.27 -0.18 0.00 -0.26 0.00 0.00 57.72 57.66 1xlx n HIS 188 Cb 0.81 -4.24 0.08 0.00 1.12 0.00 0.00 29.99 27.76 1xlx n HIS 188 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1xlx n ASN 189 N -2.24 -3.77 -2.75 0.41 4.13 -0.97 -4.98 115.26 105.09 1xlx n ASN 189 Ca -0.18 -0.53 -0.22 0.00 1.68 0.00 0.00 54.58 55.33 1xlx n ASN 189 Cb 0.65 -4.65 -0.01 0.00 -1.54 0.00 0.00 39.78 34.23 1xlx n ASN 189 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1xlx n ARG 190 N -4.16 2.53 -0.28 3.52 1.74 -1.02 -4.93 116.66 114.06 1xlx n ARG 190 Ca -0.14 -4.17 0.10 0.00 -0.77 0.00 0.00 57.85 52.86 1xlx n ARG 190 Cb 0.61 -1.96 0.25 0.00 -1.02 0.00 0.00 32.46 30.34 1xlx n ARG 190 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1xlx h PRO 191 N 2.84 0.34 -0.26 5.56 0.13 -1.85 -2.61 132.00 136.15 1xlx h PRO 191 Ca 0.14 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 65.18 1xlx h PRO 191 Cb 0.87 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 1xlx h PRO 191 CO 0.72 0.23 -0.12 1.25 -0.23 0.00 0.00 178.00 179.84 1xlx h LEU 192 N 0.35 0.56 -0.75 1.56 5.85 -1.92 0.84 115.31 121.79 1xlx h LEU 192 Ca 0.49 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1xlx h LEU 192 Cb 0.89 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1xlx h LEU 192 CO -0.52 0.84 0.00 0.41 -0.34 0.00 0.00 178.44 178.83 1xlx n THR 193 N -4.47 0.00 0.00 1.05 -1.04 -0.98 -1.08 114.28 107.76 1xlx n THR 193 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1xlx n THR 193 Cb 0.35 -0.15 0.00 0.00 -1.82 0.00 0.00 70.33 68.71 1xlx n THR 193 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xlx n ILE 195 N 0.21 0.00 -0.20 12.58 0.13 0.29 -1.49 119.36 130.88 1xlx n ILE 195 Ca 0.00 0.00 -0.08 0.00 -1.10 0.00 0.00 62.75 61.57 1xlx n ILE 195 Cb 0.02 0.00 0.02 0.00 -0.84 0.00 0.00 39.64 38.84 1xlx n ILE 195 CO 0.00 0.00 0.00 0.24 2.80 0.00 0.00 176.55 179.59 1xlx h MET 196 N 0.00 0.86 -0.43 9.51 2.86 -1.33 0.43 114.93 126.83 1xlx h MET 196 Ca 0.00 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 1xlx h MET 196 Cb 0.00 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 1xlx h MET 196 CO 0.00 0.77 0.17 -0.92 1.06 0.00 0.00 176.91 178.00 1xlx h TYR 197 N 0.77 0.65 -0.36 -0.22 3.20 -1.49 0.48 116.97 120.00 1xlx h TYR 197 Ca 0.18 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 1xlx h TYR 197 Cb 0.27 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 1xlx h TYR 197 CO 0.02 0.56 0.07 0.00 -1.64 0.00 0.00 178.16 177.16 1xlx h ALA 198 N 1.02 0.48 -0.60 1.82 0.00 -1.67 -1.99 119.26 118.32 1xlx h ALA 198 Ca 0.14 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1xlx h ALA 198 Cb 0.18 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1xlx h ALA 198 CO -0.01 0.17 0.39 0.82 0.00 0.00 0.00 179.25 180.62 1xlx h ILE 199 N 0.44 1.12 -0.03 0.00 2.04 0.04 0.01 117.51 121.13 1xlx h ILE 199 Ca 0.11 -0.27 -0.14 0.00 1.00 0.00 0.00 64.86 65.56 1xlx h ILE 199 Cb 0.34 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 1xlx h ILE 199 CO 0.01 0.14 -0.64 -0.26 0.00 0.00 0.00 178.15 177.39 1xlx h PHE 200 N 0.78 0.14 -0.03 1.37 -1.00 -0.76 -0.57 116.94 116.87 1xlx h PHE 200 Ca 0.23 -0.06 -0.18 0.00 2.81 0.00 0.00 57.97 60.78 1xlx h PHE 200 Cb -0.04 -0.02 0.01 0.00 3.61 0.00 0.00 35.95 39.51 1xlx h PHE 200 CO -0.04 0.72 -0.67 1.96 -1.61 0.00 0.00 178.31 178.66 1xlx h GLN 201 N 0.07 0.50 -0.83 1.51 4.20 -1.19 -0.70 115.11 118.67 1xlx h GLN 201 Ca -0.01 -0.51 0.08 0.00 0.06 0.00 0.00 58.65 58.28 1xlx h GLN 201 Cb 1.15 0.14 -0.07 0.00 0.30 0.00 0.00 27.48 29.00 1xlx h GLN 201 CO 0.09 1.14 0.49 1.49 -0.67 0.00 0.00 178.83 181.37 1xlx h GLU 202 N 0.06 0.81 -0.03 1.46 4.57 -0.82 -2.10 114.58 118.53 1xlx h GLU 202 Ca -0.08 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1xlx h GLU 202 Cb 1.36 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1xlx h GLU 202 CO 0.13 0.54 0.00 0.54 -1.18 0.00 0.00 179.01 179.04 1xlx n ARG 203 N -4.71 1.66 -1.58 1.92 1.74 -0.24 -4.94 116.66 110.51 1xlx n ARG 203 Ca 0.13 -0.97 -0.19 0.00 -0.77 0.00 0.00 57.85 56.05 1xlx n ARG 203 Cb 0.25 -1.47 -0.08 0.00 -1.02 0.00 0.00 32.46 30.13 1xlx n ARG 203 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1xlx n ASP 204 N 0.18 -5.32 0.14 0.55 8.00 -0.72 -4.86 116.55 114.51 1xlx n ASP 204 Ca 0.19 0.46 0.04 0.00 0.71 0.00 0.00 54.79 56.19 1xlx n ASP 204 Cb 0.35 -4.51 0.46 0.00 -0.02 0.00 0.00 41.12 37.40 1xlx n ASP 204 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1xlx h LEU 205 N 0.00 0.18 -0.23 0.64 3.38 -1.45 -2.26 115.31 115.57 1xlx h LEU 205 Ca -0.40 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.45 1xlx h LEU 205 Cb 1.26 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1xlx h LEU 205 CO 0.58 0.27 -0.24 -0.07 0.09 0.00 0.00 178.44 179.06 1xlx h LEU 206 N 0.20 0.61 0.63 1.67 3.38 -1.87 -1.98 115.31 117.95 1xlx h LEU 206 Ca 0.05 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 1xlx h LEU 206 Cb 0.22 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.81 1xlx h LEU 206 CO 0.01 0.97 -0.30 0.11 0.09 0.00 0.00 178.44 179.31 1xlx h LYS 207 N 0.27 -0.82 -1.07 1.13 1.57 -1.79 -1.50 116.57 114.36 1xlx h LYS 207 Ca 0.04 0.06 0.29 0.00 -1.87 0.00 0.00 60.65 59.16 1xlx h LYS 207 Cb 0.80 0.19 -0.09 0.00 0.08 0.00 0.00 32.23 33.20 1xlx h LYS 207 CO 0.06 -0.52 0.70 1.15 -0.57 0.00 0.00 179.45 180.27 1xlx h THR 208 N -0.94 0.49 -0.10 -0.16 2.02 -1.46 -2.06 112.91 110.69 1xlx h THR 208 Ca -0.09 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1xlx h THR 208 Cb 0.68 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1xlx h THR 208 CO 0.14 0.06 0.00 0.49 0.37 0.00 0.00 175.52 176.58 1xlx n PHE 209 N -4.57 0.25 -4.05 3.16 3.72 -0.74 -5.00 117.46 110.22 1xlx n PHE 209 Ca 0.26 -0.76 -0.27 0.00 -0.05 0.00 0.00 57.45 56.63 1xlx n PHE 209 Cb 0.96 -0.13 -0.04 0.00 -0.94 0.00 0.00 39.48 39.32 1xlx n PHE 209 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1xlx n ARG 210 N -0.69 -2.55 -3.35 -1.08 1.74 -0.64 -4.51 116.66 105.57 1xlx n ARG 210 Ca 0.12 0.31 -0.41 0.00 -0.77 0.00 0.00 57.85 57.10 1xlx n ARG 210 Cb 0.54 -4.23 -0.09 0.00 -1.02 0.00 0.00 32.46 27.67 1xlx n ARG 210 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xlx s ILE 211 N -4.07 5.12 0.36 0.55 1.01 -0.76 -4.62 121.20 118.79 1xlx s ILE 211 Ca 0.01 0.05 -0.27 0.00 0.00 0.00 0.00 60.65 60.45 1xlx s ILE 211 Cb -0.01 -3.89 -0.12 0.00 0.01 0.00 0.00 42.46 38.45 1xlx s ILE 211 CO 0.92 -0.18 1.13 -0.24 0.00 0.00 0.00 174.94 176.57 1xlx n SER 212 N 5.50 1.90 -0.07 3.58 2.88 -1.26 -4.76 113.62 121.39 1xlx n SER 212 Ca -0.08 1.14 -0.10 0.00 -1.33 0.00 0.00 58.87 58.50 1xlx n SER 212 Cb 0.49 -1.40 -0.03 0.00 -0.75 0.00 0.00 64.21 62.52 1xlx n SER 212 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1xlx h SER 213 N 2.04 0.33 -0.30 -3.46 0.02 -1.96 -2.42 113.55 107.78 1xlx h SER 213 Ca -0.44 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.37 1xlx h SER 213 Cb 1.32 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 1xlx h SER 213 CO 0.60 0.37 0.18 0.44 -1.14 0.00 0.00 176.83 177.28 1xlx h ASP 214 N 0.26 0.37 -0.64 3.07 5.19 -1.99 -0.91 116.42 121.77 1xlx h ASP 214 Ca 0.08 -0.06 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 1xlx h ASP 214 Cb 0.13 -0.09 -0.03 0.00 0.18 0.00 0.00 39.33 39.52 1xlx h ASP 214 CO -0.01 0.31 0.33 0.74 -3.12 0.00 0.00 179.24 177.49 1xlx h THR 215 N 0.39 1.21 -0.17 0.35 2.02 -1.81 -0.84 112.91 114.06 1xlx h THR 215 Ca 0.11 -0.58 -0.14 0.00 0.77 0.00 0.00 66.41 66.57 1xlx h THR 215 Cb 0.02 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 1xlx h THR 215 CO -0.02 0.25 -0.43 0.15 0.37 0.00 0.00 175.52 175.83 1xlx h PHE 216 N 0.93 0.77 -0.32 3.16 3.57 -1.15 -2.49 116.94 121.41 1xlx h PHE 216 Ca 0.23 -0.29 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 1xlx h PHE 216 Cb 0.08 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1xlx h PHE 216 CO 0.01 1.06 0.12 0.82 -2.23 0.00 0.00 178.31 178.08 1xlx h ILE 217 N 0.26 1.19 -0.99 1.41 1.08 -0.50 -1.19 117.51 118.77 1xlx h ILE 217 Ca -0.01 -0.60 0.02 0.00 -0.39 0.00 0.00 64.86 63.88 1xlx h ILE 217 Cb 1.04 0.99 -0.05 0.00 -3.07 0.00 0.00 36.82 35.73 1xlx h ILE 217 CO 0.09 0.21 0.65 0.74 -0.69 0.00 0.00 178.15 179.15 1xlx h THR 218 N 0.36 1.23 -0.38 -0.27 2.02 -1.23 0.24 112.91 114.88 1xlx h THR 218 Ca 0.10 -0.45 -0.05 0.00 0.77 0.00 0.00 66.41 66.79 1xlx h THR 218 Cb 0.21 -0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.41 1xlx h THR 218 CO -0.01 0.24 0.05 0.22 0.37 0.00 0.00 175.52 176.39 1xlx h TYR 219 N 1.31 0.69 -0.49 3.16 3.20 -1.12 -1.70 116.97 122.02 1xlx h TYR 219 Ca 0.37 -0.10 -0.11 0.00 3.14 0.00 0.00 58.73 62.03 1xlx h TYR 219 Cb -0.10 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 37.96 1xlx h TYR 219 CO -0.00 0.69 -0.14 0.52 -1.64 0.00 0.00 178.16 177.59 1xlx h MET 220 N 0.48 0.92 -0.05 1.82 2.86 -0.63 -0.09 114.93 120.25 1xlx h MET 220 Ca 0.11 -0.34 -0.00 0.00 -2.06 0.00 0.00 59.70 57.41 1xlx h MET 220 Cb 0.39 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 1xlx h MET 220 CO 0.01 1.00 0.01 0.52 1.06 0.00 0.00 176.91 179.51 1xlx h MET 221 N 0.82 0.08 -0.82 1.72 2.86 -0.93 -1.05 114.93 117.62 1xlx h MET 221 Ca 0.13 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.79 1xlx h MET 221 Cb 0.68 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.28 1xlx h MET 221 CO 0.05 0.29 0.54 1.15 1.06 0.00 0.00 176.91 179.99 1xlx h THR 222 N -0.14 1.10 -0.31 2.22 2.02 -0.96 -1.39 112.91 115.44 1xlx h THR 222 Ca 0.02 -0.33 -0.10 0.00 0.77 0.00 0.00 66.41 66.77 1xlx h THR 222 Cb 0.24 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 1xlx h THR 222 CO 0.00 0.18 -0.18 0.25 0.37 0.00 0.00 175.52 176.14 1xlx h LEU 223 N 0.97 0.70 -0.70 2.58 5.85 -0.75 -1.96 115.31 121.99 1xlx h LEU 223 Ca 0.33 -0.42 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1xlx h LEU 223 Cb 0.10 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1xlx h LEU 223 CO -0.11 0.97 0.38 -0.08 -0.34 0.00 0.00 178.44 179.26 1xlx h GLU 224 N 0.43 0.99 0.00 1.25 4.81 -0.97 -2.23 114.58 118.86 1xlx h GLU 224 Ca 0.07 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1xlx h GLU 224 Cb 0.72 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 1xlx h GLU 224 CO 0.05 0.75 -0.14 0.22 -0.73 0.00 0.00 179.01 179.15 1xlx h ASP 225 N 0.97 0.00 1.46 1.04 -0.00 -1.08 -2.23 116.42 116.58 1xlx h ASP 225 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.28 1xlx h ASP 225 Cb 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.38 1xlx h ASP 225 CO -0.04 0.14 0.00 0.45 -0.00 0.00 0.00 179.24 179.79 1xlx h HIS 226 N 0.00 0.00 -3.93 0.28 3.86 -0.74 -3.43 115.15 111.19 1xlx h HIS 226 Ca -0.00 0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.73 1xlx h HIS 226 Cb 0.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1xlx h HIS 226 CO 0.00 0.00 0.39 0.71 0.86 0.00 0.00 177.93 179.89 1xlx s TYR 227 N -3.28 3.45 -0.23 2.45 1.51 -0.84 -1.78 117.35 118.63 1xlx s TYR 227 Ca 0.07 1.70 -0.16 0.00 -1.01 0.00 0.00 57.07 57.66 1xlx s TYR 227 Cb 0.09 -3.05 -0.04 0.00 -0.11 0.00 0.00 41.96 38.85 1xlx s TYR 227 CO 0.58 -0.29 0.43 -1.01 -1.11 0.00 0.00 175.55 174.15 1xlx s HIS 228 N -1.64 3.32 -0.19 2.71 3.76 -1.26 -4.79 115.29 117.20 1xlx s HIS 228 Ca 0.54 0.58 0.29 0.00 -0.15 0.00 0.00 55.06 56.32 1xlx s HIS 228 Cb -0.21 -2.59 1.19 0.00 1.11 0.00 0.00 32.58 32.08 1xlx s HIS 228 CO 0.26 -0.12 1.85 0.66 -0.85 0.00 0.00 174.74 176.54 1xlx h SER 229 N 7.70 0.00 -0.54 1.40 4.64 -1.92 -3.07 113.55 121.76 1xlx h SER 229 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1xlx h SER 229 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1xlx h SER 229 CO 0.70 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.76 1xlx n ASP 230 N -2.66 4.10 -4.56 4.97 3.85 -1.26 -4.82 116.55 116.18 1xlx n ASP 230 Ca 0.01 -2.39 -0.36 0.00 -0.71 0.00 0.00 54.79 51.34 1xlx n ASP 230 Cb 0.26 -0.53 -0.11 0.00 -1.35 0.00 0.00 41.12 39.39 1xlx n ASP 230 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1xlx s VAL 231 N -1.83 4.77 0.17 2.12 1.01 -1.16 -5.03 120.40 120.44 1xlx s VAL 231 Ca 0.43 -0.02 -0.15 0.00 0.00 0.00 0.00 61.98 62.23 1xlx s VAL 231 Cb 0.28 -3.21 0.05 0.00 0.00 0.00 0.00 36.38 33.50 1xlx s VAL 231 CO 0.20 0.36 1.75 0.00 0.00 0.00 0.00 175.10 177.41 1xlx h ALA 232 N 7.69 0.49 0.00 5.51 0.00 -1.87 -3.38 119.26 127.69 1xlx h ALA 232 Ca -0.37 0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.35 1xlx h ALA 232 Cb 1.18 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1xlx h ALA 232 CO 0.62 -0.24 -1.83 0.98 0.00 0.00 0.00 179.25 178.78 1xlx n TYR 233 N -5.01 0.00 -1.40 0.00 9.36 -1.25 -4.77 117.16 114.10 1xlx n TYR 233 Ca 0.03 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 61.00 1xlx n TYR 233 Cb 0.15 -0.54 -0.08 0.00 -0.63 0.00 0.00 39.34 38.24 1xlx n TYR 233 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1xlx n HIS 234 N -3.42 1.28 -3.32 2.98 8.25 -1.26 -4.40 115.22 115.33 1xlx n HIS 234 Ca -0.28 -1.95 -0.05 0.00 -0.26 0.00 0.00 57.72 55.18 1xlx n HIS 234 Cb 0.73 -1.53 0.01 0.00 1.12 0.00 0.00 29.99 30.32 1xlx n HIS 234 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1xlx n ASN 235 N 1.51 0.97 0.28 0.41 0.23 -1.26 -4.49 115.26 112.90 1xlx n ASN 235 Ca 0.50 -1.39 0.18 0.00 -0.53 0.00 0.00 54.58 53.34 1xlx n ASN 235 Cb 0.61 -0.05 0.84 0.00 -2.08 0.00 0.00 39.78 39.10 1xlx n ASN 235 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1xlx h SER 236 N 0.09 0.00 -0.50 0.53 4.64 -1.85 -2.68 113.55 113.79 1xlx h SER 236 Ca -0.07 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.17 1xlx h SER 236 Cb 0.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 1xlx h SER 236 CO 0.11 0.00 -0.01 0.25 -0.87 0.00 0.00 176.83 176.30 1xlx h LEU 237 N 0.00 0.87 -0.08 5.97 5.85 -1.95 -1.51 115.31 124.45 1xlx h LEU 237 Ca 0.00 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 1xlx h LEU 237 Cb 0.29 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 1xlx h LEU 237 CO 0.00 0.97 -0.01 -0.74 -0.34 0.00 0.00 178.44 178.32 1xlx h HIS 238 N 0.74 0.16 -0.84 1.25 2.76 -1.68 -0.10 115.15 117.45 1xlx h HIS 238 Ca 0.14 -0.03 0.07 0.00 -2.20 0.00 0.00 60.37 58.35 1xlx h HIS 238 Cb 0.53 -0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.40 1xlx h HIS 238 CO 0.04 0.45 0.55 0.00 -1.30 0.00 0.00 177.93 177.67 1xlx h ALA 239 N 0.69 1.61 -0.36 5.26 0.00 -1.49 -0.38 119.26 124.58 1xlx h ALA 239 Ca 0.02 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1xlx h ALA 239 Cb 0.39 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1xlx h ALA 239 CO 0.01 0.26 -0.30 0.00 0.00 0.00 0.00 179.25 179.22 1xlx h ALA 240 N 1.55 0.79 -0.19 0.00 0.00 -0.95 -1.22 119.26 119.25 1xlx h ALA 240 Ca 0.37 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1xlx h ALA 240 Cb 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1xlx h ALA 240 CO -0.14 0.65 0.05 0.22 0.00 0.00 0.00 179.25 180.03 1xlx h ASP 241 N 0.66 0.28 -0.54 0.00 3.58 -0.16 -1.58 116.42 118.66 1xlx h ASP 241 Ca 0.08 -0.22 -0.10 0.00 0.42 0.00 0.00 57.03 57.20 1xlx h ASP 241 Cb 0.83 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 1xlx h ASP 241 CO 0.07 0.43 -0.04 0.58 -2.88 0.00 0.00 179.24 177.41 1xlx h VAL 242 N 0.12 1.26 -0.31 2.25 2.07 -1.00 0.33 116.25 120.97 1xlx h VAL 242 Ca 0.06 -1.17 -0.07 0.00 0.82 0.00 0.00 66.70 66.34 1xlx h VAL 242 Cb 0.26 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1xlx h VAL 242 CO -0.00 0.42 -0.11 0.00 0.02 0.00 0.00 177.57 177.90 1xlx h ALA 243 N 1.04 1.24 0.09 1.67 0.00 -1.12 0.09 119.26 122.27 1xlx h ALA 243 Ca 0.16 -0.26 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 1xlx h ALA 243 Cb 0.58 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.25 1xlx h ALA 243 CO 0.03 0.50 -0.82 0.37 0.00 0.00 0.00 179.25 179.33 1xlx h GLN 244 N 0.48 0.40 -0.75 0.00 -0.00 -0.39 -1.68 115.11 113.17 1xlx h GLN 244 Ca 0.09 -0.55 0.05 0.00 -0.00 0.00 0.00 58.65 58.24 1xlx h GLN 244 Cb 0.48 0.18 -0.05 0.00 0.00 0.00 0.00 27.48 28.09 1xlx h GLN 244 CO 0.03 1.22 0.45 0.77 0.00 0.00 0.00 178.83 181.30 1xlx h SER 245 N -0.16 0.72 -0.39 -0.69 0.02 -0.36 -2.30 113.55 110.39 1xlx h SER 245 Ca -0.13 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.76 1xlx h SER 245 Cb 1.58 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.97 1xlx h SER 245 CO 0.16 0.47 -0.03 0.74 -1.14 0.00 0.00 176.83 177.03 1xlx h THR 246 N 0.85 1.25 -0.26 -2.27 2.02 -0.92 -1.87 112.91 111.70 1xlx h THR 246 Ca 0.32 -1.05 -0.10 0.00 0.77 0.00 0.00 66.41 66.35 1xlx h THR 246 Cb 0.12 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1xlx h THR 246 CO -0.15 0.37 -0.27 -0.74 0.37 0.00 0.00 175.52 175.09 1xlx h HIS 247 N 0.73 0.58 -0.07 3.16 -0.00 -0.78 -1.71 115.15 117.07 1xlx h HIS 247 Ca 0.14 -0.13 -0.04 0.00 -0.00 0.00 0.00 60.37 60.34 1xlx h HIS 247 Cb 0.49 -0.14 -0.00 0.00 -0.00 0.00 0.00 27.41 27.76 1xlx h HIS 247 CO 0.03 0.74 -0.11 0.28 -0.00 0.00 0.00 177.93 178.86 1xlx h VAL 248 N 0.45 1.40 -0.65 5.26 2.07 -1.00 -3.24 116.25 120.54 1xlx h VAL 248 Ca 0.06 -1.38 0.05 0.00 0.82 0.00 0.00 66.70 66.26 1xlx h VAL 248 Cb 0.71 2.15 -0.04 0.00 -1.52 0.00 0.00 31.29 32.59 1xlx h VAL 248 CO 0.05 0.38 0.43 -0.07 0.02 0.00 0.00 177.57 178.39 1xlx h LEU 249 N -0.27 0.60 -2.14 2.57 3.38 -1.20 -0.93 115.31 117.30 1xlx h LEU 249 Ca 0.01 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1xlx h LEU 249 Cb 0.68 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1xlx h LEU 249 CO 0.03 0.39 -0.07 -0.07 0.09 0.00 0.00 178.44 178.81 1xlx h LEU 250 N 0.68 0.00 -1.60 1.67 3.38 -1.34 -2.37 115.31 115.74 1xlx h LEU 250 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1xlx h LEU 250 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1xlx h LEU 250 CO -0.08 0.07 0.00 -1.20 0.09 0.00 0.00 178.44 177.31 1xlx n SER 251 N -3.83 2.42 -4.73 -0.43 7.64 -0.37 -4.76 113.62 109.57 1xlx n SER 251 Ca -0.02 -1.82 -0.42 0.00 1.01 0.00 0.00 58.87 57.61 1xlx n SER 251 Cb 0.16 -0.13 -0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1xlx n SER 251 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1xlx n THR 252 N 0.83 1.97 -0.28 0.44 5.66 -0.89 -4.88 114.28 117.12 1xlx n THR 252 Ca 0.17 -0.49 0.02 0.00 -3.05 0.00 0.00 64.05 60.70 1xlx n THR 252 Cb 0.46 -1.72 0.16 0.00 -1.55 0.00 0.00 70.33 67.67 1xlx n THR 252 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 1xlx h PRO 253 N 2.75 0.76 -0.15 1.09 0.11 -1.93 -1.82 132.00 132.82 1xlx h PRO 253 Ca -0.48 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.63 1xlx h PRO 253 Cb 1.27 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1xlx h PRO 253 CO 0.63 0.50 0.17 0.00 -0.21 0.00 0.00 178.00 179.09 1xlx h ALA 254 N 1.44 1.75 -0.73 -0.75 0.00 -1.83 -2.03 119.26 117.11 1xlx h ALA 254 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1xlx h ALA 254 Cb 0.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1xlx h ALA 254 CO -0.24 -0.24 0.00 1.28 0.00 0.00 0.00 179.25 180.05 1xlx n LEU 255 N -3.80 4.09 0.00 0.00 4.77 -0.69 -2.04 117.00 119.33 1xlx n LEU 255 Ca 0.01 -2.05 0.00 0.00 -0.03 0.00 0.00 56.01 53.94 1xlx n LEU 255 Cb 0.28 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1xlx n LEU 255 CO 0.27 0.96 0.07 -0.67 -1.33 0.00 0.00 177.39 176.69 1xlx n ASP 256 N 1.58 0.00 -1.98 -1.43 -0.08 -0.76 -2.42 116.55 111.46 1xlx n ASP 256 Ca 0.25 0.14 -0.01 0.00 -1.51 0.00 0.00 54.79 53.67 1xlx n ASP 256 Cb 0.67 0.00 0.35 0.00 2.34 0.00 0.00 41.12 44.48 1xlx n ASP 256 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xlx n ALA 257 N -0.83 4.31 0.09 -1.67 0.00 -1.26 -4.55 120.51 116.60 1xlx n ALA 257 Ca 0.00 -2.15 -0.13 0.00 0.00 0.00 0.00 53.44 51.16 1xlx n ALA 257 Cb 0.00 -1.21 -0.10 0.00 0.00 0.00 0.00 19.45 18.14 1xlx n ALA 257 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xlx h VAL 258 N 3.26 1.52 -3.22 0.00 2.07 -1.83 -3.46 116.25 114.60 1xlx h VAL 258 Ca 0.16 -2.96 -0.64 0.00 0.82 0.00 0.00 66.70 64.07 1xlx h VAL 258 Cb 2.20 2.78 -0.15 0.00 -1.52 0.00 0.00 31.29 34.61 1xlx h VAL 258 CO 0.64 0.86 -0.58 -0.36 0.02 0.00 0.00 177.57 178.16 1xlx s PHE 259 N -2.84 3.24 0.85 1.57 0.08 -1.26 -5.03 117.98 114.60 1xlx s PHE 259 Ca -0.03 0.12 -0.10 0.00 0.12 0.00 0.00 56.93 57.03 1xlx s PHE 259 Cb 0.08 -1.96 0.11 0.00 -0.57 0.00 0.00 43.02 40.68 1xlx s PHE 259 CO 0.86 0.30 1.12 0.95 -0.10 0.00 0.00 175.22 178.35 1xlx s THR 260 N -0.17 2.60 0.28 0.64 -4.23 -1.26 -4.81 115.64 108.69 1xlx s THR 260 Ca 0.07 0.19 -0.01 0.00 -1.18 0.00 0.00 61.69 60.76 1xlx s THR 260 Cb -0.12 -2.41 0.27 0.00 1.34 0.00 0.00 72.50 71.58 1xlx s THR 260 CO 0.02 -0.25 1.91 0.44 -0.54 0.00 0.00 174.62 176.19 1xlx h ASP 261 N -1.55 0.98 -0.61 3.99 3.32 -1.99 -1.45 116.42 119.12 1xlx h ASP 261 Ca -0.43 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.64 1xlx h ASP 261 Cb 1.25 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 40.55 1xlx h ASP 261 CO 0.46 0.65 0.38 0.25 -1.72 0.00 0.00 179.24 179.25 1xlx h LEU 262 N 1.12 0.62 -0.56 1.55 5.85 -1.99 -0.55 115.31 121.35 1xlx h LEU 262 Ca 0.40 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 59.04 1xlx h LEU 262 Cb 0.13 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1xlx h LEU 262 CO -0.14 0.44 0.05 -0.33 -0.34 0.00 0.00 178.44 178.12 1xlx h GLU 263 N 0.75 0.96 -0.04 1.25 5.08 -1.84 0.45 114.58 121.18 1xlx h GLU 263 Ca 0.24 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1xlx h GLU 263 Cb 0.00 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 1xlx h GLU 263 CO -0.09 0.94 0.02 0.82 -1.00 0.00 0.00 179.01 179.70 1xlx h ILE 264 N 0.85 1.08 -0.48 3.13 2.04 -1.03 -1.77 117.51 121.33 1xlx h ILE 264 Ca 0.17 -0.23 0.07 0.00 1.00 0.00 0.00 64.86 65.86 1xlx h ILE 264 Cb 0.47 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.65 1xlx h ILE 264 CO 0.02 0.07 0.16 0.25 0.00 0.00 0.00 178.15 178.65 1xlx h LEU 265 N -0.02 0.15 -0.81 1.44 5.85 -0.95 -2.77 115.31 118.20 1xlx h LEU 265 Ca 0.02 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.80 1xlx h LEU 265 Cb 0.09 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1xlx h LEU 265 CO -0.00 0.12 0.53 0.00 -0.34 0.00 0.00 178.44 178.74 1xlx h ALA 266 N 1.33 1.03 -0.23 1.25 0.00 -0.71 -1.34 119.26 120.58 1xlx h ALA 266 Ca 0.23 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1xlx h ALA 266 Cb 0.25 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xlx h ALA 266 CO -0.24 0.45 0.03 0.00 0.00 0.00 0.00 179.25 179.48 1xlx h ALA 267 N 1.29 0.31 -0.33 0.00 0.00 -1.13 0.10 119.26 119.50 1xlx h ALA 267 Ca 0.30 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1xlx h ALA 267 Cb -0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1xlx h ALA 267 CO -0.06 -0.01 -0.40 0.82 0.00 0.00 0.00 179.25 179.61 1xlx h ILE 268 N 0.18 1.28 -0.45 0.00 2.04 -1.48 -0.51 117.51 118.57 1xlx h ILE 268 Ca 0.07 -1.57 -0.03 0.00 1.00 0.00 0.00 64.86 64.33 1xlx h ILE 268 Cb 0.34 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1xlx h ILE 268 CO 0.01 0.51 0.15 0.15 0.00 0.00 0.00 178.15 178.98 1xlx h PHE 269 N 0.66 0.71 0.35 1.37 3.57 -1.18 -0.74 116.94 121.67 1xlx h PHE 269 Ca 0.05 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1xlx h PHE 269 Cb 0.96 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.47 1xlx h PHE 269 CO 0.05 0.63 -0.35 0.00 -2.23 0.00 0.00 178.31 176.41 1xlx h ALA 270 N 1.00 -0.75 -0.84 2.41 0.00 -0.62 -1.93 119.26 118.54 1xlx h ALA 270 Ca 0.15 -0.12 0.17 0.00 0.00 0.00 0.00 54.91 55.11 1xlx h ALA 270 Cb 0.24 0.51 -0.11 0.00 0.00 0.00 0.00 17.79 18.43 1xlx h ALA 270 CO -0.01 -0.96 0.37 0.00 0.00 0.00 0.00 179.25 178.65 1xlx h ALA 271 N -0.26 1.26 -0.11 0.00 0.00 -0.97 -1.31 119.26 117.88 1xlx h ALA 271 Ca -0.02 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xlx h ALA 271 Cb 0.66 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1xlx h ALA 271 CO -0.07 -0.22 0.05 0.00 0.00 0.00 0.00 179.25 179.01 1xlx h ALA 272 N 1.61 0.12 -0.01 0.00 0.00 -0.39 -3.15 119.26 117.45 1xlx h ALA 272 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1xlx h ALA 272 Cb 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1xlx h ALA 272 CO -0.44 -0.41 -0.21 0.44 0.00 0.00 0.00 179.25 178.64 1xlx n ILE 273 N -5.05 0.00 0.30 0.00 -5.35 -0.85 -4.65 119.36 103.76 1xlx n ILE 273 Ca -0.05 -0.11 0.20 0.00 -0.27 0.00 0.00 62.75 62.52 1xlx n ILE 273 Cb 0.04 0.25 1.09 0.00 -1.74 0.00 0.00 39.64 39.29 1xlx n ILE 273 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 1xlx h HIS 274 N 1.05 0.00 0.00 4.28 2.07 -1.19 -1.29 115.15 120.07 1xlx h HIS 274 Ca 0.00 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.43 1xlx h HIS 274 Cb 0.46 0.00 -0.19 0.00 2.57 0.00 0.00 27.41 30.26 1xlx h HIS 274 CO 0.00 0.00 -0.73 -0.25 -3.07 0.00 0.00 177.93 173.88 1xlx n ASP 275 N -2.90 1.29 -4.77 3.10 8.00 -1.26 -4.85 116.55 115.16 1xlx n ASP 275 Ca -0.03 -2.82 -0.41 0.00 0.71 0.00 0.00 54.79 52.25 1xlx n ASP 275 Cb 0.06 -0.39 -0.02 0.00 -0.02 0.00 0.00 41.12 40.75 1xlx n ASP 275 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1xlx s VAL 276 N -1.45 2.75 -1.73 2.53 0.11 -0.49 -2.27 120.40 119.86 1xlx s VAL 276 Ca 0.33 0.75 0.00 0.00 -2.93 0.00 0.00 61.98 60.13 1xlx s VAL 276 Cb 0.35 -3.48 0.00 0.00 -1.53 0.00 0.00 36.38 31.72 1xlx s VAL 276 CO -0.11 0.18 0.00 -0.67 -3.33 0.00 0.00 175.10 171.17 1xlx n ASP 277 N 0.91 -5.04 -4.72 3.54 2.03 -0.74 -4.34 116.55 108.20 1xlx n ASP 277 Ca 0.00 0.32 -0.42 0.00 0.52 0.00 0.00 54.79 55.22 1xlx n ASP 277 Cb 0.42 -4.06 -0.03 0.00 -0.72 0.00 0.00 41.12 36.73 1xlx n ASP 277 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1xlx s HIS 278 N -2.68 2.93 -2.37 -0.67 5.65 -0.96 -4.94 115.29 112.26 1xlx s HIS 278 Ca 0.00 0.40 0.23 0.00 0.25 0.00 0.00 55.06 55.95 1xlx s HIS 278 Cb 0.00 -4.10 0.84 0.00 -1.18 0.00 0.00 32.58 28.14 1xlx s HIS 278 CO 0.00 -4.14 1.61 -0.35 -0.65 0.00 0.00 174.74 171.21 1xlx n PRO 279 N 3.95 1.73 -1.07 2.88 -0.04 -1.26 -4.59 135.00 136.61 1xlx n PRO 279 Ca 0.15 -1.09 0.00 0.00 -0.04 0.00 0.00 63.50 62.53 1xlx n PRO 279 Cb 0.36 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 1xlx n PRO 279 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xlx n GLY 280 N 1.16 0.50 3.05 0.55 0.00 -1.26 -5.00 105.19 104.18 1xlx n GLY 280 Ca 0.17 -0.90 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 1xlx n GLY 280 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xlx s VAL 281 N -2.00 0.16 0.83 1.61 -7.23 -1.26 -4.66 120.40 107.85 1xlx s VAL 281 Ca 0.00 -1.32 -0.12 0.00 -1.81 0.00 0.00 61.98 58.73 1xlx s VAL 281 Cb 0.00 -0.90 0.09 0.00 0.56 0.00 0.00 36.38 36.13 1xlx s VAL 281 CO 0.00 -0.73 1.14 -0.94 -0.31 0.00 0.00 175.10 174.26 1xlx s SER 282 N -2.19 4.32 0.17 4.85 1.04 -1.26 -4.93 113.70 115.70 1xlx s SER 282 Ca -0.04 0.96 -0.14 0.00 0.48 0.00 0.00 55.95 57.21 1xlx s SER 282 Cb -0.01 -1.55 0.08 0.00 0.10 0.00 0.00 66.02 64.64 1xlx s SER 282 CO -0.05 -2.04 1.82 0.78 0.98 0.00 0.00 173.24 174.73 1xlx h ASN 283 N -1.14 0.53 -0.60 7.02 2.35 -2.01 -2.61 115.58 119.12 1xlx h ASN 283 Ca -0.47 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1xlx h ASN 283 Cb 1.31 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 39.53 1xlx h ASN 283 CO 0.64 0.38 0.37 -0.61 -1.65 0.00 0.00 177.43 176.55 1xlx h GLN 284 N 0.64 0.82 -0.19 0.81 5.75 -1.98 -1.61 115.11 119.34 1xlx h GLN 284 Ca 0.20 -0.07 -0.07 0.00 -0.15 0.00 0.00 58.65 58.56 1xlx h GLN 284 Cb -0.02 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 28.35 1xlx h GLN 284 CO -0.07 0.57 -0.15 0.35 -2.65 0.00 0.00 178.83 176.88 1xlx h PHE 285 N 0.83 0.53 -0.96 3.99 3.04 -1.85 -1.65 116.94 120.87 1xlx h PHE 285 Ca 0.22 -0.15 0.07 0.00 3.98 0.00 0.00 57.97 62.09 1xlx h PHE 285 Cb -0.04 -0.11 -0.07 0.00 2.56 0.00 0.00 35.95 38.29 1xlx h PHE 285 CO 0.00 0.78 0.61 -0.07 -2.02 0.00 0.00 178.31 177.62 1xlx h LEU 286 N 0.12 0.96 -0.16 0.59 3.38 -1.11 -1.28 115.31 117.82 1xlx h LEU 286 Ca 0.04 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1xlx h LEU 286 Cb 0.68 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1xlx h LEU 286 CO 0.04 0.60 0.01 0.40 0.09 0.00 0.00 178.44 179.59 1xlx h ILE 287 N 1.09 1.24 0.00 1.22 2.04 -1.21 -0.97 117.51 120.92 1xlx h ILE 287 Ca 0.42 -0.79 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 1xlx h ILE 287 Cb 0.20 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1xlx h ILE 287 CO -0.18 0.24 -0.32 0.78 0.00 0.00 0.00 178.15 178.67 1xlx h ASN 288 N 0.04 0.00 -0.14 1.72 2.35 -0.94 -2.85 115.58 115.76 1xlx h ASN 288 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1xlx h ASN 288 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1xlx h ASN 288 CO 0.01 0.32 0.00 0.35 -1.65 0.00 0.00 177.43 176.45 1xlx n THR 289 N -3.68 0.16 -2.95 2.81 -2.24 -0.51 -4.96 114.28 102.91 1xlx n THR 289 Ca -0.01 -0.40 -0.19 0.00 -2.27 0.00 0.00 64.05 61.18 1xlx n THR 289 Cb 0.42 0.67 0.03 0.00 -2.10 0.00 0.00 70.33 69.36 1xlx n THR 289 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1xlx n ASN 290 N 0.62 -5.47 -4.56 3.42 3.02 -1.08 -4.95 115.26 106.26 1xlx n ASN 290 Ca 0.17 -0.26 -0.37 0.00 -0.03 0.00 0.00 54.58 54.09 1xlx n ASN 290 Cb 0.42 -4.29 0.06 0.00 -0.61 0.00 0.00 39.78 35.36 1xlx n ASN 290 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1xlx n SER 291 N -1.90 0.01 -0.07 6.41 3.41 -0.39 -4.81 113.62 116.29 1xlx n SER 291 Ca -0.09 0.73 0.09 0.00 -0.26 0.00 0.00 58.87 59.35 1xlx n SER 291 Cb 0.60 -1.32 0.47 0.00 -0.26 0.00 0.00 64.21 63.70 1xlx n SER 291 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1xlx h GLU 292 N 0.15 0.45 -0.50 4.33 4.39 -1.92 -2.11 114.58 119.37 1xlx h GLU 292 Ca -0.47 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.09 1xlx h GLU 292 Cb 1.37 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.90 1xlx h GLU 292 CO 0.48 0.30 -0.14 -0.07 -1.16 0.00 0.00 179.01 178.42 1xlx h LEU 293 N 0.47 0.95 -0.59 1.33 3.38 -1.92 0.83 115.31 119.76 1xlx h LEU 293 Ca 0.25 -0.32 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 1xlx h LEU 293 Cb 0.37 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1xlx h LEU 293 CO -0.07 1.09 -0.08 0.00 0.09 0.00 0.00 178.44 179.47 1xlx h ALA 294 N 0.99 0.79 -0.37 1.53 0.00 -1.69 -2.10 119.26 118.41 1xlx h ALA 294 Ca 0.13 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 1xlx h ALA 294 Cb 0.69 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1xlx h ALA 294 CO 0.05 0.67 -0.08 -0.07 0.00 0.00 0.00 179.25 179.82 1xlx h LEU 295 N 0.93 0.71 -1.19 0.00 3.38 -1.23 -0.37 115.31 117.53 1xlx h LEU 295 Ca 0.15 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.81 1xlx h LEU 295 Cb 0.64 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1xlx h LEU 295 CO 0.04 0.90 0.56 -0.03 0.09 0.00 0.00 178.44 180.01 1xlx h MET 296 N 0.51 0.99 -0.54 1.13 4.05 -0.70 -3.20 114.93 117.17 1xlx h MET 296 Ca 0.09 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 1xlx h MET 296 Cb 0.59 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 31.16 1xlx h MET 296 CO 0.03 0.65 0.00 0.66 0.23 0.00 0.00 176.91 178.49 1xlx n TYR 297 N -4.46 0.99 -3.84 1.39 4.01 -0.80 -4.99 117.16 109.46 1xlx n TYR 297 Ca 0.12 -0.58 -0.30 0.00 -0.16 0.00 0.00 57.90 56.98 1xlx n TYR 297 Cb 0.15 -0.12 -0.02 0.00 -0.31 0.00 0.00 39.34 39.03 1xlx n TYR 297 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1xlx n ASN 298 N 0.92 -3.16 -0.66 7.72 3.02 -0.20 -2.48 115.26 120.42 1xlx n ASN 298 Ca 0.21 -0.71 -0.09 0.00 -0.03 0.00 0.00 54.58 53.96 1xlx n ASN 298 Cb 0.68 -2.62 -0.04 0.00 -0.61 0.00 0.00 39.78 37.20 1xlx n ASN 298 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xlx n ASP 299 N -2.42 -4.94 -4.17 6.41 8.00 -0.93 -4.99 116.55 113.51 1xlx n ASP 299 Ca 0.05 0.21 -0.32 0.00 0.71 0.00 0.00 54.79 55.44 1xlx n ASP 299 Cb 0.50 -3.20 -0.17 0.00 -0.02 0.00 0.00 41.12 38.24 1xlx n ASP 299 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1xlx s GLU 300 N -2.49 3.01 -0.73 -1.24 2.56 -1.04 -4.69 118.70 114.09 1xlx s GLU 300 Ca 0.00 -0.85 -0.14 0.00 0.00 0.00 0.00 54.97 53.97 1xlx s GLU 300 Cb 0.00 -2.41 0.02 0.00 2.00 0.00 0.00 34.13 33.74 1xlx s GLU 300 CO 0.00 0.01 0.27 0.43 -0.56 0.00 0.00 175.26 175.41 1xlx n SER 301 N 4.01 -1.48 0.07 -1.70 7.64 -1.26 -4.80 113.62 116.09 1xlx n SER 301 Ca -0.20 -0.73 -0.05 0.00 1.01 0.00 0.00 58.87 58.90 1xlx n SER 301 Cb 0.52 -0.88 -0.03 0.00 -1.01 0.00 0.00 64.21 62.81 1xlx n SER 301 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1xlx h VAL 302 N -0.23 0.00 -0.90 0.44 2.07 -1.88 0.26 116.25 116.01 1xlx h VAL 302 Ca -0.39 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.17 1xlx h VAL 302 Cb 0.78 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.50 1xlx h VAL 302 CO 0.32 0.00 0.59 -0.07 0.02 0.00 0.00 177.57 178.43 1xlx h LEU 303 N -0.28 0.96 -0.27 2.57 3.38 -1.93 -2.38 115.31 117.36 1xlx h LEU 303 Ca -0.01 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1xlx h LEU 303 Cb 0.25 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1xlx h LEU 303 CO -0.05 0.66 -0.11 -0.33 0.09 0.00 0.00 178.44 178.69 1xlx h GLU 304 N 1.12 0.56 -0.88 1.13 3.07 -1.86 0.30 114.58 118.02 1xlx h GLU 304 Ca 0.36 -0.24 -0.01 0.00 -0.50 0.00 0.00 59.36 58.97 1xlx h GLU 304 Cb 0.04 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 27.89 1xlx h GLU 304 CO -0.11 0.80 0.51 -0.91 -1.40 0.00 0.00 179.01 177.90 1xlx h ASN 305 N 0.30 1.08 -0.35 1.42 2.35 -0.85 -2.79 115.58 116.74 1xlx h ASN 305 Ca 0.06 -0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.68 1xlx h ASN 305 Cb 0.62 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1xlx h ASN 305 CO 0.04 0.84 -0.00 -0.74 -1.65 0.00 0.00 177.43 175.92 1xlx h HIS 306 N 1.23 0.67 -0.83 1.19 2.76 -0.61 -2.33 115.15 117.23 1xlx h HIS 306 Ca 0.32 -0.12 0.03 0.00 -2.20 0.00 0.00 60.37 58.40 1xlx h HIS 306 Cb -0.02 -0.17 -0.05 0.00 1.55 0.00 0.00 27.41 28.72 1xlx h HIS 306 CO 0.01 0.72 0.54 0.45 -1.30 0.00 0.00 177.93 178.35 1xlx h HIS 307 N 0.43 1.01 -0.68 5.26 3.86 -0.33 -1.06 115.15 123.64 1xlx h HIS 307 Ca 0.10 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.27 1xlx h HIS 307 Cb 0.46 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 28.56 1xlx h HIS 307 CO 0.04 0.59 0.17 -0.07 0.86 0.00 0.00 177.93 179.52 1xlx h LEU 308 N 1.06 1.01 -0.36 2.43 3.38 -1.41 -1.53 115.31 119.90 1xlx h LEU 308 Ca 0.33 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1xlx h LEU 308 Cb -0.02 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1xlx h LEU 308 CO -0.11 0.97 0.07 0.00 0.09 0.00 0.00 178.44 179.47 1xlx h ALA 309 N 1.16 0.47 -0.17 1.53 0.00 -0.79 -0.85 119.26 120.61 1xlx h ALA 309 Ca 0.22 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1xlx h ALA 309 Cb 0.35 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1xlx h ALA 309 CO 0.00 0.16 -0.02 0.28 0.00 0.00 0.00 179.25 179.66 1xlx h VAL 310 N 0.43 1.27 -0.66 0.00 2.07 -1.11 -1.75 116.25 116.50 1xlx h VAL 310 Ca 0.11 -0.95 -0.07 0.00 0.82 0.00 0.00 66.70 66.61 1xlx h VAL 310 Cb 0.33 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 1xlx h VAL 310 CO 0.00 0.28 0.12 1.23 0.02 0.00 0.00 177.57 179.23 1xlx h GLY 311 N 0.04 1.17 2.00 2.17 0.00 -1.12 -2.20 103.07 105.13 1xlx h GLY 311 Ca 0.05 -0.76 -0.06 0.00 0.00 0.00 0.00 47.33 46.56 1xlx h GLY 311 CO 0.01 0.70 -0.29 0.74 0.00 0.00 0.00 176.54 177.70 1xlx h PHE 312 N 1.02 0.00 -0.26 5.60 0.04 -1.21 -3.24 116.94 118.89 1xlx h PHE 312 Ca 0.20 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.92 1xlx h PHE 312 Cb 0.42 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.56 1xlx h PHE 312 CO 0.03 0.29 -0.05 -0.22 -0.60 0.00 0.00 178.31 177.76 1xlx h LYS 313 N 0.00 0.50 0.00 1.51 3.11 -0.78 -2.99 116.57 117.92 1xlx h LYS 313 Ca -0.00 -0.19 -0.00 0.00 -2.81 0.00 0.00 60.65 57.65 1xlx h LYS 313 Cb 1.03 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.23 1xlx h LYS 313 CO 0.04 0.71 -0.01 -0.07 -2.81 0.00 0.00 179.45 177.31 1xlx h LEU 314 N 0.25 0.00 -0.20 5.20 3.38 -1.44 -1.08 115.31 121.43 1xlx h LEU 314 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1xlx h LEU 314 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1xlx h LEU 314 CO 0.02 0.01 0.00 0.18 0.09 0.00 0.00 178.44 178.74 1xlx n LEU 315 N -3.11 0.57 -0.18 1.67 4.77 -1.13 -4.10 117.00 115.49 1xlx n LEU 315 Ca -0.01 0.58 -0.10 0.00 -0.03 0.00 0.00 56.01 56.45 1xlx n LEU 315 Cb 0.19 -0.44 0.01 0.00 -2.33 0.00 0.00 43.42 40.85 1xlx n LEU 315 CO 0.24 -0.26 0.80 1.56 -1.33 0.00 0.00 177.39 178.40 1xlx h GLN 316 N 0.00 0.92 -6.31 3.23 1.08 -1.29 -3.27 115.11 109.48 1xlx h GLN 316 Ca 0.00 -0.30 -0.57 0.00 -1.45 0.00 0.00 58.65 56.34 1xlx h GLN 316 Cb 0.55 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.86 1xlx h GLN 316 CO 0.00 0.95 1.03 -2.00 -0.95 0.00 0.00 178.83 177.85 1xlx s GLU 317 N -5.00 3.90 0.38 1.46 2.56 -1.26 -4.90 118.70 115.83 1xlx s GLU 317 Ca -0.12 1.45 0.30 0.00 0.00 0.00 0.00 54.97 56.60 1xlx s GLU 317 Cb 0.12 -3.93 1.24 0.00 2.00 0.00 0.00 34.13 33.56 1xlx s GLU 317 CO 0.83 -1.15 1.23 0.39 -0.56 0.00 0.00 175.26 176.01 1xlx n GLU 318 N 7.38 -0.02 0.27 4.30 1.02 -1.26 0.64 120.64 132.97 1xlx n GLU 318 Ca 0.16 0.95 0.13 0.00 -0.02 0.00 0.00 57.16 58.38 1xlx n GLU 318 Cb 0.46 -1.96 0.82 0.00 -0.02 0.00 0.00 31.44 30.74 1xlx n GLU 318 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1xlx h HIS 319 N 0.00 0.00 -0.18 -0.32 2.76 -1.92 -2.92 115.15 112.57 1xlx h HIS 319 Ca 0.71 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.88 1xlx h HIS 319 Cb 2.49 0.00 0.00 0.00 1.55 0.00 0.00 27.41 31.45 1xlx h HIS 319 CO -0.00 0.00 0.00 0.00 -1.30 0.00 0.00 177.93 176.63 1xlx n ASP 321 N -0.04 4.83 0.23 0.00 -0.08 -1.10 -4.46 116.55 115.93 1xlx n ASP 321 Ca 0.07 -2.96 0.10 0.00 -1.51 0.00 0.00 54.79 50.48 1xlx n ASP 321 Cb 0.38 -1.62 0.51 0.00 2.34 0.00 0.00 41.12 42.73 1xlx n ASP 321 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 1xlx h ILE 322 N 4.56 0.00 -0.50 5.18 3.07 -1.86 0.83 117.51 128.79 1xlx h ILE 322 Ca 0.43 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.84 1xlx h ILE 322 Cb 0.77 0.42 0.00 0.00 -0.27 0.00 0.00 36.82 37.73 1xlx h ILE 322 CO 1.53 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 179.12 1xlx n PHE 323 N -2.36 0.66 -0.29 0.16 3.72 -1.26 -4.60 117.46 113.49 1xlx n PHE 323 Ca -0.01 -0.33 0.17 0.00 -0.05 0.00 0.00 57.45 57.23 1xlx n PHE 323 Cb 0.36 0.00 0.32 0.00 -0.94 0.00 0.00 39.48 39.21 1xlx n PHE 323 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 1xlx n MET 324 N 1.51 -0.06 -0.02 -1.08 1.56 0.28 -0.85 117.12 118.47 1xlx n MET 324 Ca 0.21 1.25 0.13 0.00 -0.27 0.00 0.00 57.70 59.02 1xlx n MET 324 Cb 0.60 -2.05 0.45 0.00 2.15 0.00 0.00 33.22 34.37 1xlx n MET 324 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 1xlx n ASN 325 N -5.15 1.73 -4.68 6.12 3.02 -1.26 -4.91 115.26 110.13 1xlx n ASN 325 Ca 0.23 -1.60 -0.29 0.00 -0.03 0.00 0.00 54.58 52.89 1xlx n ASN 325 Cb 0.77 -0.03 0.17 0.00 -0.61 0.00 0.00 39.78 40.09 1xlx n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1xlx s LEU 326 N -1.91 1.74 0.68 3.41 1.43 -0.03 -4.90 118.68 119.11 1xlx s LEU 326 Ca 0.36 1.27 -0.12 0.00 -1.03 0.00 0.00 54.13 54.62 1xlx s LEU 326 Cb 0.20 -3.51 -0.00 0.00 0.03 0.00 0.00 46.19 42.91 1xlx s LEU 326 CO 0.32 -3.04 1.06 -0.89 0.23 0.00 0.00 176.35 174.02 1xlx s THR 327 N -2.94 4.01 0.08 5.49 2.01 -1.26 -4.87 115.64 118.16 1xlx s THR 327 Ca 0.65 0.70 -0.23 0.00 0.31 0.00 0.00 61.69 63.12 1xlx s THR 327 Cb -0.19 -3.41 -0.14 0.00 0.01 0.00 0.00 72.50 68.78 1xlx s THR 327 CO 0.58 -0.81 1.70 0.50 -0.69 0.00 0.00 174.62 175.90 1xlx h LYS 328 N -0.52 0.05 -0.16 4.92 3.64 -1.97 0.75 116.57 123.28 1xlx h LYS 328 Ca -0.44 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1xlx h LYS 328 Cb 1.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1xlx h LYS 328 CO 0.57 0.08 0.10 -0.22 -2.27 0.00 0.00 179.45 177.71 1xlx h LYS 329 N 0.00 0.21 -0.04 1.90 1.63 -1.99 -1.29 116.57 116.99 1xlx h LYS 329 Ca 0.01 -0.01 -0.23 0.00 -0.85 0.00 0.00 60.65 59.56 1xlx h LYS 329 Cb 0.04 -0.05 0.01 0.00 -0.60 0.00 0.00 32.23 31.63 1xlx h LYS 329 CO -0.00 0.14 -0.92 1.96 -3.45 0.00 0.00 179.45 177.18 1xlx h GLN 330 N 0.22 0.58 -0.24 1.90 4.20 -1.80 -2.73 115.11 117.24 1xlx h GLN 330 Ca 0.06 -0.57 -0.03 0.00 0.06 0.00 0.00 58.65 58.16 1xlx h GLN 330 Cb -0.02 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1xlx h GLN 330 CO -0.01 1.19 0.02 0.00 -0.67 0.00 0.00 178.83 179.35 1xlx h ARG 331 N 0.35 0.41 -0.11 1.46 2.47 -0.37 -2.36 114.38 116.23 1xlx h ARG 331 Ca -0.09 -0.12 -0.00 0.00 -1.26 0.00 0.00 59.98 58.51 1xlx h ARG 331 Cb 1.55 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.83 1xlx h ARG 331 CO 0.17 0.57 0.06 1.96 0.56 0.00 0.00 179.97 183.29 1xlx h GLN 332 N 0.20 0.16 -0.43 0.04 4.20 -1.34 0.55 115.11 118.49 1xlx h GLN 332 Ca 0.07 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 1xlx h GLN 332 Cb 0.38 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1xlx h GLN 332 CO 0.01 0.20 0.19 1.15 -0.67 0.00 0.00 178.83 179.71 1xlx h THR 333 N 0.07 1.16 -0.04 -0.54 2.02 -1.52 -0.53 112.91 113.52 1xlx h THR 333 Ca 0.04 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 1xlx h THR 333 Cb 0.10 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.13 1xlx h THR 333 CO -0.01 0.18 -0.07 0.25 0.37 0.00 0.00 175.52 176.25 1xlx h LEU 334 N 0.60 0.13 -0.43 2.58 6.46 -1.19 -1.61 115.31 121.86 1xlx h LEU 334 Ca 0.15 -0.55 0.08 0.00 -0.12 0.00 0.00 57.88 57.44 1xlx h LEU 334 Cb 0.10 -0.04 -0.07 0.00 -0.73 0.00 0.00 40.66 39.92 1xlx h LEU 334 CO -0.02 0.65 0.03 -0.09 -0.62 0.00 0.00 178.44 178.39 1xlx h ARG 335 N -0.38 0.14 -0.34 1.25 2.43 -0.63 0.41 114.38 117.26 1xlx h ARG 335 Ca 0.00 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1xlx h ARG 335 Cb 0.63 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 1xlx h ARG 335 CO 0.02 0.09 0.17 -0.22 -1.51 0.00 0.00 179.97 178.51 1xlx h LYS 336 N 0.14 0.34 -0.60 0.20 3.64 -1.10 -2.46 116.57 116.73 1xlx h LYS 336 Ca 0.22 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.52 1xlx h LYS 336 Cb 0.30 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 1xlx h LYS 336 CO -0.33 0.22 0.17 0.52 -2.27 0.00 0.00 179.45 177.76 1xlx h MET 337 N 0.35 0.94 -0.03 1.90 2.86 -0.27 -2.23 114.93 118.45 1xlx h MET 337 Ca 0.14 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1xlx h MET 337 Cb 0.05 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.58 1xlx h MET 337 CO -0.10 0.85 0.01 0.28 1.06 0.00 0.00 176.91 179.01 1xlx h VAL 338 N 0.86 1.19 -0.26 -2.22 2.07 -0.84 -1.66 116.25 115.39 1xlx h VAL 338 Ca 0.19 -0.58 0.06 0.00 0.82 0.00 0.00 66.70 67.20 1xlx h VAL 338 Cb 0.31 1.53 -0.08 0.00 -1.52 0.00 0.00 31.29 31.54 1xlx h VAL 338 CO -0.00 0.16 -0.29 0.40 0.02 0.00 0.00 177.57 177.85 1xlx h ILE 339 N -0.19 0.31 -0.75 4.57 2.04 -1.43 -0.55 117.51 121.50 1xlx h ILE 339 Ca 0.01 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.00 1xlx h ILE 339 Cb 0.25 0.31 -0.09 0.00 -0.74 0.00 0.00 36.82 36.55 1xlx h ILE 339 CO 0.00 0.00 0.33 -0.78 0.00 0.00 0.00 178.15 177.70 1xlx h ASP 340 N -0.29 0.36 -0.03 1.72 1.82 -1.25 -1.34 116.42 117.41 1xlx h ASP 340 Ca 0.14 0.09 -0.20 0.00 -0.39 0.00 0.00 57.03 56.67 1xlx h ASP 340 Cb 0.51 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.57 1xlx h ASP 340 CO -0.43 0.16 -0.71 0.24 -1.61 0.00 0.00 179.24 176.90 1xlx h MET 341 N 0.51 0.67 -0.27 0.28 2.86 -0.46 -2.31 114.93 116.20 1xlx h MET 341 Ca 0.40 -0.51 -0.18 0.00 -2.06 0.00 0.00 59.70 57.35 1xlx h MET 341 Cb 0.57 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.32 1xlx h MET 341 CO -0.36 1.13 -0.54 0.28 1.06 0.00 0.00 176.91 178.48 1xlx h VAL 342 N 0.47 1.28 -0.63 -2.22 2.07 -1.00 -2.97 116.25 113.26 1xlx h VAL 342 Ca -0.03 -1.73 0.01 0.00 0.82 0.00 0.00 66.70 65.78 1xlx h VAL 342 Cb 1.31 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 32.73 1xlx h VAL 342 CO 0.14 0.56 0.42 -0.07 0.02 0.00 0.00 177.57 178.64 1xlx h LEU 343 N 0.61 0.71 -0.07 2.57 3.38 -1.22 -1.11 115.31 120.17 1xlx h LEU 343 Ca 0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xlx h LEU 343 Cb 1.15 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1xlx h LEU 343 CO 0.12 0.51 0.00 0.00 0.09 0.00 0.00 178.44 179.15 1xlx n ALA 344 N -2.44 1.61 1.89 1.53 0.00 -0.87 -2.42 120.51 119.81 1xlx n ALA 344 Ca 0.07 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1xlx n ALA 344 Cb 0.06 -1.23 0.75 0.00 0.00 0.00 0.00 19.45 19.02 1xlx n ALA 344 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xlx n THR 345 N -1.57 0.00 -2.59 0.00 -2.24 -0.42 -4.83 114.28 102.63 1xlx n THR 345 Ca 0.03 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.38 1xlx n THR 345 Cb 0.16 -0.44 -0.02 0.00 -2.10 0.00 0.00 70.33 67.93 1xlx n THR 345 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xlx s ASP 346 N -1.84 6.99 0.57 3.42 -1.08 -1.01 -4.90 116.67 118.81 1xlx s ASP 346 Ca 0.38 1.35 0.29 0.00 -0.52 0.00 0.00 52.55 54.05 1xlx s ASP 346 Cb 0.17 -2.54 1.71 0.00 -1.46 0.00 0.00 42.92 40.80 1xlx s ASP 346 CO 0.29 -0.77 2.20 0.24 0.52 0.00 0.00 175.17 177.65 1xlx h MET 347 N 7.91 0.00 0.00 4.34 2.86 -1.90 -2.05 114.93 126.08 1xlx h MET 347 Ca -0.21 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.42 1xlx h MET 347 Cb 1.07 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.73 1xlx h MET 347 CO 0.99 0.04 -0.03 0.66 1.06 0.00 0.00 176.91 179.63 1xlx h SER 348 N 0.00 0.00 -0.32 1.22 4.64 -1.97 -2.23 113.55 114.89 1xlx h SER 348 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xlx h SER 348 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1xlx h SER 348 CO 0.00 0.03 0.00 0.29 -0.87 0.00 0.00 176.83 176.29 1xlx n LYS 349 N -3.25 1.99 0.08 4.77 4.76 -0.77 -4.68 118.16 121.05 1xlx n LYS 349 Ca -0.02 -1.50 -0.13 0.00 -2.87 0.00 0.00 58.31 53.79 1xlx n LYS 349 Cb 0.18 -1.40 -0.08 0.00 -1.84 0.00 0.00 35.03 31.89 1xlx n LYS 349 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1xlx h HIS 350 N 2.76 -0.18 -0.95 2.13 -0.00 -1.53 -1.78 115.15 115.60 1xlx h HIS 350 Ca 0.00 -0.00 0.06 0.00 -0.00 0.00 0.00 60.37 60.43 1xlx h HIS 350 Cb 0.62 0.06 -0.07 0.00 -0.00 0.00 0.00 27.41 28.02 1xlx h HIS 350 CO 0.21 0.13 0.61 0.52 -0.00 0.00 0.00 177.93 179.39 1xlx h MET 351 N -0.49 1.08 -0.38 5.26 2.86 -1.83 0.15 114.93 121.56 1xlx h MET 351 Ca -0.02 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.45 1xlx h MET 351 Cb 0.39 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1xlx h MET 351 CO 0.03 0.71 -0.19 1.03 1.06 0.00 0.00 176.91 179.55 1xlx h SER 352 N 1.11 0.74 0.01 1.22 0.87 -1.85 -0.86 113.55 114.78 1xlx h SER 352 Ca 0.41 -0.25 -0.19 0.00 -1.23 0.00 0.00 61.79 60.53 1xlx h SER 352 Cb 0.17 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1xlx h SER 352 CO -0.17 0.93 -0.69 0.25 -0.53 0.00 0.00 176.83 176.61 1xlx h LEU 353 N 0.65 0.73 -0.50 2.23 5.85 -0.77 -2.48 115.31 121.03 1xlx h LEU 353 Ca 0.10 -0.45 -0.16 0.00 0.84 0.00 0.00 57.88 58.20 1xlx h LEU 353 Cb 0.68 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1xlx h LEU 353 CO 0.05 1.21 -0.57 0.25 -0.34 0.00 0.00 178.44 179.04 1xlx h LEU 354 N 0.45 0.61 -0.12 2.25 5.85 -0.84 -0.74 115.31 122.77 1xlx h LEU 354 Ca -0.03 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 1xlx h LEU 354 Cb 1.28 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 1xlx h LEU 354 CO 0.13 1.05 0.02 0.00 -0.34 0.00 0.00 178.44 179.31 1xlx h ALA 355 N 0.96 0.16 -0.27 1.25 0.00 -1.17 -1.59 119.26 118.59 1xlx h ALA 355 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1xlx h ALA 355 Cb 1.12 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1xlx h ALA 355 CO 0.11 -0.19 -0.02 -0.44 0.00 0.00 0.00 179.25 178.71 1xlx h ASP 356 N -0.03 0.38 -0.59 0.00 5.19 -1.28 -2.04 116.42 118.05 1xlx h ASP 356 Ca 0.04 -0.06 -0.08 0.00 -0.62 0.00 0.00 57.03 56.30 1xlx h ASP 356 Cb 0.29 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.68 1xlx h ASP 356 CO 0.00 0.46 0.04 0.25 -3.12 0.00 0.00 179.24 176.87 1xlx h LEU 357 N 0.40 0.99 -1.48 1.55 5.85 -0.93 -1.83 115.31 119.87 1xlx h LEU 357 Ca 0.09 -0.29 -0.05 0.00 0.84 0.00 0.00 57.88 58.47 1xlx h LEU 357 Cb 0.29 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1xlx h LEU 357 CO 0.01 1.03 -0.23 0.11 -0.34 0.00 0.00 178.44 179.02 1xlx h LYS 358 N 0.92 0.05 0.01 1.25 1.57 -0.59 -1.21 116.57 118.56 1xlx h LYS 358 Ca 0.17 -0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.69 1xlx h LYS 358 Cb 0.50 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.81 1xlx h LYS 358 CO 0.02 0.28 -1.00 1.15 -0.57 0.00 0.00 179.45 179.33 1xlx h THR 359 N 0.05 1.35 -0.33 -0.16 2.02 -1.23 -2.51 112.91 112.09 1xlx h THR 359 Ca 0.01 -2.38 -0.11 0.00 0.77 0.00 0.00 66.41 64.70 1xlx h THR 359 Cb 0.43 2.42 -0.01 0.00 -1.74 0.00 0.00 68.15 69.25 1xlx h THR 359 CO 0.03 0.72 -0.24 -0.03 0.37 0.00 0.00 175.52 176.37 1xlx h MET 360 N 0.30 0.65 -0.31 6.66 1.85 -0.83 -2.85 114.93 120.39 1xlx h MET 360 Ca -0.10 -0.26 -0.02 0.00 -0.61 0.00 0.00 59.70 58.70 1xlx h MET 360 Cb 1.65 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 33.63 1xlx h MET 360 CO 0.18 0.84 0.11 0.28 -0.40 0.00 0.00 176.91 177.92 1xlx h VAL 361 N 0.57 1.19 -0.73 -5.77 2.07 -1.26 -2.73 116.25 109.59 1xlx h VAL 361 Ca 0.08 -0.60 0.16 0.00 0.82 0.00 0.00 66.70 67.15 1xlx h VAL 361 Cb 0.72 1.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.38 1xlx h VAL 361 CO 0.06 0.21 0.15 -0.33 0.02 0.00 0.00 177.57 177.67 1xlx h GLU 362 N 0.35 0.23 -0.72 1.57 5.08 -1.23 -1.43 114.58 118.43 1xlx h GLU 362 Ca 0.10 -0.01 -0.24 0.00 -1.00 0.00 0.00 59.36 58.21 1xlx h GLU 362 Cb 0.21 -0.05 -0.14 0.00 0.50 0.00 0.00 28.75 29.27 1xlx h GLU 362 CO -0.01 0.15 0.29 0.25 -1.00 0.00 0.00 179.01 178.69 1xlx n THR 363 N -5.18 2.92 -1.75 1.13 -2.24 -1.10 -5.01 114.28 103.04 1xlx n THR 363 Ca 0.14 -1.77 -0.40 0.00 -2.27 0.00 0.00 64.05 59.75 1xlx n THR 363 Cb 0.46 -0.37 0.02 0.00 -2.10 0.00 0.00 70.33 68.34 1xlx n THR 363 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1xlx n LYS 364 N -0.38 2.08 -3.96 -0.78 4.81 -0.54 -5.04 118.16 114.36 1xlx n LYS 364 Ca 0.42 0.75 -0.10 0.00 -0.87 0.00 0.00 58.31 58.50 1xlx n LYS 364 Cb 1.38 -2.59 -0.12 0.00 0.02 0.00 0.00 35.03 33.72 1xlx n LYS 364 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1xlx s LYS 365 N -2.53 0.24 0.07 1.64 1.02 -1.26 -5.09 119.74 113.83 1xlx s LYS 365 Ca 0.64 -0.43 0.02 0.00 0.02 0.00 0.00 55.97 56.21 1xlx s LYS 365 Cb -0.45 0.04 -0.03 0.00 -0.52 0.00 0.00 37.83 36.87 1xlx s LYS 365 CO 0.56 -0.03 -0.06 0.14 -0.92 0.00 0.00 175.35 175.03 1xlx s VAL 366 N -1.01 0.56 -0.94 3.17 -7.23 -1.26 -0.93 120.40 112.76 1xlx s VAL 366 Ca -0.11 -1.58 0.19 0.00 -1.81 0.00 0.00 61.98 58.67 1xlx s VAL 366 Cb -0.07 -1.23 0.17 0.00 0.56 0.00 0.00 36.38 35.81 1xlx s VAL 366 CO -0.01 -0.70 1.61 0.35 -0.31 0.00 0.00 175.10 176.04 1xlx n THR 367 N 0.56 0.73 0.00 5.32 -2.24 0.54 -4.85 114.28 114.34 1xlx n THR 367 Ca -0.17 0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1xlx n THR 367 Cb 0.58 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 1xlx n THR 367 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1xlx n SER 368 N -1.59 0.00 -1.40 3.42 2.88 -1.26 -4.89 113.62 110.77 1xlx n SER 368 Ca 0.04 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.64 1xlx n SER 368 Cb 0.23 0.00 0.27 0.00 -0.75 0.00 0.00 64.21 63.96 1xlx n SER 368 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1xlx n SER 369 N 0.00 4.10 -1.14 -3.46 3.41 -1.26 -4.88 113.62 110.39 1xlx n SER 369 Ca 0.00 -2.56 -0.08 0.00 -0.26 0.00 0.00 58.87 55.97 1xlx n SER 369 Cb 0.00 -0.59 0.01 0.00 -0.26 0.00 0.00 64.21 63.36 1xlx n SER 369 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xlx n GLY 370 N 0.54 0.18 3.20 5.00 0.00 -1.26 -5.03 105.19 107.82 1xlx n GLY 370 Ca 0.19 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 1xlx n GLY 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xlx s VAL 371 N -2.64 2.15 0.42 1.61 1.01 -1.26 -4.35 120.40 117.34 1xlx s VAL 371 Ca 0.08 -0.96 -0.26 0.00 0.00 0.00 0.00 61.98 60.83 1xlx s VAL 371 Cb -0.03 -1.85 -0.09 0.00 0.00 0.00 0.00 36.38 34.41 1xlx s VAL 371 CO 0.09 0.55 1.40 -0.76 0.00 0.00 0.00 175.10 176.38 1xlx s LEU 372 N 0.62 4.19 -0.44 3.92 1.43 -0.87 -0.34 118.68 127.19 1xlx s LEU 372 Ca -0.11 2.86 -0.14 0.00 -1.03 0.00 0.00 54.13 55.70 1xlx s LEU 372 Cb -0.16 -3.87 0.06 0.00 0.03 0.00 0.00 46.19 42.24 1xlx s LEU 372 CO 0.03 -1.01 0.33 -0.76 0.23 0.00 0.00 176.35 175.17 1xlx s LEU 373 N -2.51 5.34 -0.47 1.79 1.43 -0.11 -4.78 118.68 119.38 1xlx s LEU 373 Ca 0.58 -1.21 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 1xlx s LEU 373 Cb -0.42 -2.14 0.12 0.00 0.03 0.00 0.00 46.19 43.79 1xlx s LEU 373 CO 0.55 -0.56 0.23 -0.76 0.23 0.00 0.00 176.35 176.04 1xlx s LEU 374 N 1.61 4.76 -0.37 1.79 1.43 -1.26 -4.63 118.68 122.02 1xlx s LEU 374 Ca 0.04 -2.60 -0.28 0.00 -1.03 0.00 0.00 54.13 50.26 1xlx s LEU 374 Cb -0.22 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 1xlx s LEU 374 CO 0.07 -0.35 1.73 1.51 0.23 0.00 0.00 176.35 179.54 1xlx s ASP 375 N 0.55 5.92 0.24 2.29 -4.77 -1.26 -4.75 116.67 114.89 1xlx s ASP 375 Ca 0.14 1.13 0.00 0.00 -3.30 0.00 0.00 52.55 50.52 1xlx s ASP 375 Cb -0.22 -2.53 0.00 0.00 -1.09 0.00 0.00 42.92 39.08 1xlx s ASP 375 CO -0.04 -1.72 0.00 -3.20 0.70 0.00 0.00 175.17 170.92 1xlx n ASN 376 N 10.22 -4.17 -0.18 2.11 5.15 -1.26 -4.27 115.26 122.86 1xlx n ASN 376 Ca 0.21 0.52 0.02 0.00 -0.60 0.00 0.00 54.58 54.74 1xlx n ASN 376 Cb 0.47 -3.07 0.05 0.00 -0.53 0.00 0.00 39.78 36.70 1xlx n ASN 376 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xlx n TYR 377 N -3.18 0.13 -0.09 1.20 9.36 -1.26 -2.22 117.16 121.09 1xlx n TYR 377 Ca -0.02 0.61 -0.06 0.00 3.32 0.00 0.00 57.90 61.75 1xlx n TYR 377 Cb 0.56 -0.75 0.01 0.00 -0.63 0.00 0.00 39.34 38.53 1xlx n TYR 377 CO 0.00 0.00 0.00 1.15 0.22 0.00 0.00 176.86 178.23 1xlx h THR 378 N 0.00 0.75 -0.14 2.97 2.02 -1.99 -1.63 112.91 114.88 1xlx h THR 378 Ca 0.22 -0.03 -0.18 0.00 0.77 0.00 0.00 66.41 67.19 1xlx h THR 378 Cb 0.34 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1xlx h THR 378 CO -0.50 0.02 -0.66 0.44 0.37 0.00 0.00 175.52 175.18 1xlx h ASP 379 N 0.08 0.65 -0.17 4.18 3.45 -1.63 -2.99 116.42 120.00 1xlx h ASP 379 Ca 0.16 -0.39 -0.01 0.00 0.43 0.00 0.00 57.03 57.21 1xlx h ASP 379 Cb 0.22 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.79 1xlx h ASP 379 CO -0.28 1.14 0.05 0.03 -1.57 0.00 0.00 179.24 178.61 1xlx h ARG 380 N 0.41 0.26 0.00 3.56 3.08 -1.38 -2.83 114.38 117.48 1xlx h ARG 380 Ca -0.02 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 1xlx h ARG 380 Cb 1.24 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.25 1xlx h ARG 380 CO 0.12 0.38 -0.15 0.97 -1.07 0.00 0.00 179.97 180.23 1xlx h ILE 381 N 0.09 0.41 -0.22 2.04 6.09 -1.36 -2.00 117.51 122.56 1xlx h ILE 381 Ca 0.05 -0.86 -0.13 0.00 -1.37 0.00 0.00 64.86 62.55 1xlx h ILE 381 Cb 0.23 1.62 -0.01 0.00 0.47 0.00 0.00 36.82 39.14 1xlx h ILE 381 CO -0.00 0.15 -0.42 -0.61 -3.07 0.00 0.00 178.15 174.20 1xlx h GLN 382 N 0.00 0.52 0.03 2.19 4.15 -1.36 -0.09 115.11 120.55 1xlx h GLN 382 Ca -0.00 -0.27 -0.19 0.00 0.77 0.00 0.00 58.65 58.96 1xlx h GLN 382 Cb 0.61 0.01 0.02 0.00 0.21 0.00 0.00 27.48 28.33 1xlx h GLN 382 CO 0.02 0.85 -0.75 0.28 -1.93 0.00 0.00 178.83 177.29 1xlx h VAL 383 N 0.43 1.40 -0.67 2.39 2.07 -1.21 -2.47 116.25 118.19 1xlx h VAL 383 Ca 0.03 -2.19 -0.03 0.00 0.82 0.00 0.00 66.70 65.33 1xlx h VAL 383 Cb 0.91 2.64 -0.03 0.00 -1.52 0.00 0.00 31.29 33.29 1xlx h VAL 383 CO 0.08 0.64 0.28 -0.07 0.02 0.00 0.00 177.57 178.52 1xlx h LEU 384 N -0.02 0.89 0.05 2.57 3.38 -1.29 0.13 115.31 121.01 1xlx h LEU 384 Ca -0.10 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1xlx h LEU 384 Cb 1.47 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1xlx h LEU 384 CO 0.15 0.78 -0.11 0.03 0.09 0.00 0.00 178.44 179.38 1xlx h ARG 385 N 0.96 -0.21 -0.03 1.13 3.08 -1.01 -1.75 114.38 116.54 1xlx h ARG 385 Ca 0.23 0.01 -0.13 0.00 0.07 0.00 0.00 59.98 60.17 1xlx h ARG 385 Cb 0.17 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1xlx h ARG 385 CO -0.02 -0.14 -0.57 -0.91 -1.07 0.00 0.00 179.97 177.26 1xlx h ASN 386 N -0.22 0.09 -0.16 7.04 2.35 -1.07 -2.30 115.58 121.31 1xlx h ASN 386 Ca 0.03 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1xlx h ASN 386 Cb 0.25 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1xlx h ASN 386 CO -0.08 0.64 0.04 -0.03 -1.65 0.00 0.00 177.43 176.35 1xlx h MET 387 N 0.06 0.25 -0.16 0.81 4.05 -0.54 0.23 114.93 119.64 1xlx h MET 387 Ca -0.00 -0.06 -0.10 0.00 -0.28 0.00 0.00 59.70 59.26 1xlx h MET 387 Cb 1.02 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.77 1xlx h MET 387 CO 0.08 0.39 -0.34 0.28 0.23 0.00 0.00 176.91 177.54 1xlx h VAL 388 N 0.07 1.29 -0.10 -5.77 2.07 -1.23 0.43 116.25 113.00 1xlx h VAL 388 Ca 0.05 -1.39 -0.13 0.00 0.82 0.00 0.00 66.70 66.05 1xlx h VAL 388 Cb 0.24 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1xlx h VAL 388 CO -0.00 0.43 -0.50 -0.74 0.02 0.00 0.00 177.57 176.77 1xlx h HIS 389 N 0.28 0.32 -0.22 1.57 6.17 -1.17 -0.85 115.15 121.25 1xlx h HIS 389 Ca 0.03 -0.10 -0.21 0.00 0.71 0.00 0.00 60.37 60.81 1xlx h HIS 389 Cb 0.75 -0.06 0.01 0.00 2.52 0.00 0.00 27.41 30.62 1xlx h HIS 389 CO 0.02 0.71 -0.67 0.00 0.71 0.00 0.00 177.93 178.70 1xlx h ALA 391 N 0.61 1.19 -0.06 0.00 0.00 -0.60 -1.50 119.26 118.90 1xlx h ALA 391 Ca -0.02 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 1xlx h ALA 391 Cb 1.29 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1xlx h ALA 391 CO 0.14 0.53 -0.41 0.22 0.00 0.00 0.00 179.25 179.73 1xlx h ASP 392 N 0.67 0.14 -1.38 0.00 -0.00 -0.99 -3.12 116.42 111.74 1xlx h ASP 392 Ca 0.14 -0.06 -0.65 0.00 -0.00 0.00 0.00 57.03 56.46 1xlx h ASP 392 Cb 0.41 -0.04 -0.35 0.00 -0.00 0.00 0.00 39.33 39.35 1xlx h ASP 392 CO 0.02 0.54 0.13 0.18 -0.00 0.00 0.00 179.24 180.11 1xlx n LEU 393 N -4.03 6.25 -0.47 2.28 4.77 -0.67 -4.60 117.00 120.52 1xlx n LEU 393 Ca -0.02 -4.80 0.08 0.00 -0.03 0.00 0.00 56.01 51.24 1xlx n LEU 393 Cb 0.47 -0.73 0.02 0.00 -2.33 0.00 0.00 43.42 40.85 1xlx n LEU 393 CO 0.41 1.90 0.35 -1.54 -1.33 0.00 0.00 177.39 177.18 1xlx n SER 394 N -0.64 1.89 -0.17 -1.43 3.41 -0.65 -4.68 113.62 111.35 1xlx n SER 394 Ca 0.50 -1.44 -0.01 0.00 -0.26 0.00 0.00 58.87 57.65 1xlx n SER 394 Cb 0.60 0.30 0.07 0.00 -0.26 0.00 0.00 64.21 64.92 1xlx n SER 394 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1xlx h ASN 395 N 2.31 -0.18 0.20 4.04 -0.26 -1.83 -2.37 115.58 117.48 1xlx h ASN 395 Ca 0.00 0.12 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 1xlx h ASN 395 Cb 0.59 0.21 0.00 0.00 -1.06 0.00 0.00 38.32 38.06 1xlx h ASN 395 CO 0.00 -0.06 0.00 -2.65 -1.06 0.00 0.00 177.43 173.66 1xlx n PRO 396 N -5.22 0.27 0.00 0.81 -0.02 -1.26 -1.94 135.00 127.63 1xlx n PRO 396 Ca 0.07 0.11 0.11 0.00 -2.02 0.00 0.00 63.50 61.77 1xlx n PRO 396 Cb 0.29 -1.50 0.09 0.00 -0.02 0.00 0.00 33.50 32.36 1xlx n PRO 396 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1xlx n THR 397 N -1.22 0.00 -2.29 3.45 -2.24 -0.89 -4.20 114.28 106.89 1xlx n THR 397 Ca 0.08 -0.12 -0.25 0.00 -2.27 0.00 0.00 64.05 61.48 1xlx n THR 397 Cb 0.10 0.84 0.07 0.00 -2.10 0.00 0.00 70.33 69.24 1xlx n THR 397 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1xlx s LYS 398 N -2.70 2.15 0.60 -0.78 -0.14 -0.82 -4.65 119.74 113.41 1xlx s LYS 398 Ca 0.16 -0.40 -0.19 0.00 -1.36 0.00 0.00 55.97 54.17 1xlx s LYS 398 Cb 0.18 -2.22 -0.03 0.00 -1.68 0.00 0.00 37.83 34.08 1xlx s LYS 398 CO 0.66 -1.22 1.21 -1.13 -0.76 0.00 0.00 175.35 174.10 1xlx n SER 399 N -2.86 1.82 -0.33 2.83 3.41 -1.26 -4.61 113.62 112.63 1xlx n SER 399 Ca 0.09 0.86 0.09 0.00 -0.26 0.00 0.00 58.87 59.65 1xlx n SER 399 Cb 0.60 -1.51 0.26 0.00 -0.26 0.00 0.00 64.21 63.30 1xlx n SER 399 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1xlx h LEU 400 N 0.76 0.70 -1.11 1.04 5.85 -1.95 -0.93 115.31 119.68 1xlx h LEU 400 Ca -0.50 0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.40 1xlx h LEU 400 Cb 1.34 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 42.25 1xlx h LEU 400 CO 0.53 0.30 0.61 -0.08 -0.34 0.00 0.00 178.44 179.46 1xlx h GLU 401 N 0.75 0.94 0.01 1.25 4.81 -2.01 -1.40 114.58 118.95 1xlx h GLU 401 Ca 0.51 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.68 1xlx h GLU 401 Cb 0.69 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1xlx h GLU 401 CO -0.35 0.62 -0.01 -0.07 -0.73 0.00 0.00 179.01 178.48 1xlx h LEU 402 N 0.97 -0.02 -1.03 1.64 3.38 -1.56 -3.19 115.31 115.51 1xlx h LEU 402 Ca 0.44 -0.73 0.14 0.00 0.09 0.00 0.00 57.88 57.82 1xlx h LEU 402 Cb 0.40 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.06 1xlx h LEU 402 CO -0.20 0.74 0.62 0.22 0.09 0.00 0.00 178.44 179.91 1xlx h TYR 403 N -0.80 1.10 -0.29 1.13 3.20 -1.02 -0.84 116.97 119.45 1xlx h TYR 403 Ca -0.00 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.74 1xlx h TYR 403 Cb 0.74 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 1xlx h TYR 403 CO 0.19 0.39 -0.46 0.00 -1.64 0.00 0.00 178.16 176.64 1xlx h ARG 404 N 0.92 0.77 -0.56 1.82 3.08 -1.35 0.20 114.38 119.25 1xlx h ARG 404 Ca 0.51 -0.43 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 1xlx h ARG 404 Cb 0.60 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 1xlx h ARG 404 CO -0.29 1.06 0.02 1.96 -1.07 0.00 0.00 179.97 181.66 1xlx h GLN 405 N 0.61 0.98 -0.66 0.04 4.20 -1.35 0.15 115.11 119.08 1xlx h GLN 405 Ca 0.04 -0.30 -0.07 0.00 0.06 0.00 0.00 58.65 58.38 1xlx h GLN 405 Cb 1.02 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.68 1xlx h GLN 405 CO 0.10 0.97 0.13 -1.49 -0.67 0.00 0.00 178.83 177.86 1xlx h TRP 406 N 0.86 1.12 -0.48 2.96 -0.00 -1.02 -1.03 115.95 118.36 1xlx h TRP 406 Ca 0.16 -0.14 -0.08 0.00 -0.00 0.00 0.00 58.89 58.83 1xlx h TRP 406 Cb 0.51 -0.31 -0.02 0.00 -0.00 0.00 0.00 29.16 29.34 1xlx h TRP 406 CO 0.04 0.93 -0.01 1.15 -0.00 0.00 0.00 178.44 180.56 1xlx h THR 407 N 1.01 1.26 -0.64 1.49 2.02 -0.34 -2.06 112.91 115.65 1xlx h THR 407 Ca 0.20 -1.08 -0.05 0.00 0.77 0.00 0.00 66.41 66.26 1xlx h THR 407 Cb 0.40 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 1xlx h THR 407 CO 0.01 0.38 0.21 0.44 0.37 0.00 0.00 175.52 176.92 1xlx h ASP 408 N 0.71 0.89 -0.01 4.18 3.32 -0.51 -2.68 116.42 122.33 1xlx h ASP 408 Ca 0.14 -0.15 -0.16 0.00 0.02 0.00 0.00 57.03 56.88 1xlx h ASP 408 Cb 0.52 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1xlx h ASP 408 CO 0.03 0.83 -0.53 0.03 -1.72 0.00 0.00 179.24 177.88 1xlx h ARG 409 N 0.94 0.58 0.00 3.56 3.08 -0.97 -2.16 114.38 119.41 1xlx h ARG 409 Ca 0.21 -0.36 -0.09 0.00 0.07 0.00 0.00 59.98 59.81 1xlx h ARG 409 Cb 0.25 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1xlx h ARG 409 CO -0.01 0.97 -0.45 0.97 -1.07 0.00 0.00 179.97 180.38 1xlx h ILE 410 N 0.45 1.20 0.02 2.04 6.09 -1.27 -2.45 117.51 123.60 1xlx h ILE 410 Ca 0.01 -1.60 -0.22 0.00 -1.37 0.00 0.00 64.86 61.68 1xlx h ILE 410 Cb 1.07 1.89 -0.00 0.00 0.47 0.00 0.00 36.82 40.25 1xlx h ILE 410 CO 0.10 0.44 -0.97 0.24 -3.07 0.00 0.00 178.15 174.89 1xlx h MET 411 N 0.00 0.29 -0.69 2.19 2.86 -1.32 -2.18 114.93 116.07 1xlx h MET 411 Ca -0.00 -0.34 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 1xlx h MET 411 Cb 0.86 0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.59 1xlx h MET 411 CO 0.06 1.06 0.39 1.49 1.06 0.00 0.00 176.91 180.97 1xlx h GLU 412 N 0.15 0.96 -0.09 1.72 4.81 -1.28 -0.45 114.58 120.39 1xlx h GLU 412 Ca -0.07 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.04 1xlx h GLU 412 Cb 1.62 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.81 1xlx h GLU 412 CO 0.16 0.71 0.02 1.49 -0.73 0.00 0.00 179.01 180.66 1xlx h GLU 413 N 0.95 0.15 -0.46 1.92 4.81 -1.33 -2.38 114.58 118.25 1xlx h GLU 413 Ca 0.24 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1xlx h GLU 413 Cb 0.03 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 1xlx h GLU 413 CO -0.04 0.35 0.29 0.74 -0.73 0.00 0.00 179.01 179.62 1xlx h PHE 414 N -0.07 0.55 -0.71 0.92 -1.00 -1.35 -2.00 116.94 113.27 1xlx h PHE 414 Ca 0.03 0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.78 1xlx h PHE 414 Cb 0.27 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 39.62 1xlx h PHE 414 CO 0.01 0.33 0.27 0.74 -1.61 0.00 0.00 178.31 178.05 1xlx h PHE 415 N 0.59 1.08 -0.59 -0.55 0.04 -1.06 0.87 116.94 117.32 1xlx h PHE 415 Ca 0.17 -0.08 0.01 0.00 2.80 0.00 0.00 57.97 60.87 1xlx h PHE 415 Cb -0.04 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 37.76 1xlx h PHE 415 CO -0.05 0.83 0.39 1.96 -0.60 0.00 0.00 178.31 180.84 1xlx h GLN 416 N 1.03 0.78 -0.28 1.51 4.20 -1.13 0.15 115.11 121.36 1xlx h GLN 416 Ca 0.24 -0.05 -0.17 0.00 0.06 0.00 0.00 58.65 58.73 1xlx h GLN 416 Cb 0.22 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 1xlx h GLN 416 CO -0.02 0.51 -0.48 0.37 -0.67 0.00 0.00 178.83 178.55 1xlx h GLN 417 N 0.80 0.83 -0.86 1.46 4.15 -0.56 -1.46 115.11 119.47 1xlx h GLN 417 Ca 0.22 -0.51 0.01 0.00 0.77 0.00 0.00 58.65 59.14 1xlx h GLN 417 Cb -0.08 0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.62 1xlx h GLN 417 CO -0.05 1.14 0.57 0.78 -1.93 0.00 0.00 178.83 179.34 1xlx h GLY 418 N 0.60 1.22 0.70 2.39 0.00 -0.19 0.26 103.07 108.04 1xlx h GLY 418 Ca 0.02 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 1xlx h GLY 418 CO 0.11 0.45 -0.03 -0.55 0.00 0.00 0.00 176.54 176.52 1xlx h ASP 419 N 1.17 0.18 -0.63 0.19 5.19 -0.83 0.16 116.42 121.85 1xlx h ASP 419 Ca 0.32 -0.38 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1xlx h ASP 419 Cb -0.13 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 39.30 1xlx h ASP 419 CO -0.07 0.52 0.41 0.11 -3.12 0.00 0.00 179.24 177.09 1xlx h LYS 420 N -0.16 0.84 -0.20 3.56 1.57 -0.85 -1.36 116.57 119.98 1xlx h LYS 420 Ca 0.02 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1xlx h LYS 420 Cb 0.45 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1xlx h LYS 420 CO 0.01 0.57 0.03 0.93 -0.57 0.00 0.00 179.45 180.42 1xlx h GLU 421 N 0.87 0.33 -0.23 3.15 5.08 -0.26 -3.27 114.58 120.24 1xlx h GLU 421 Ca 0.23 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1xlx h GLU 421 Cb -0.08 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1xlx h GLU 421 CO -0.05 0.48 0.10 -0.09 -1.00 0.00 0.00 179.01 178.45 1xlx h ARG 422 N 0.12 0.34 -1.09 2.33 2.43 -0.04 -2.67 114.38 115.81 1xlx h ARG 422 Ca 0.06 -0.06 0.32 0.00 -0.81 0.00 0.00 59.98 59.49 1xlx h ARG 422 Cb 0.31 -0.06 -0.12 0.00 -0.42 0.00 0.00 29.97 29.68 1xlx h ARG 422 CO 0.00 0.38 0.67 0.93 -1.51 0.00 0.00 179.97 180.44 1xlx h GLU 423 N 0.23 0.32 -0.61 0.20 5.08 -1.36 -1.50 114.58 116.94 1xlx h GLU 423 Ca 0.08 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1xlx h GLU 423 Cb 0.16 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1xlx h GLU 423 CO -0.01 0.21 0.00 0.54 -1.00 0.00 0.00 179.01 178.76 1xlx n ARG 424 N -4.79 2.86 -1.44 2.33 1.74 -1.03 -4.96 116.66 111.37 1xlx n ARG 424 Ca 0.30 -2.24 -0.15 0.00 -0.77 0.00 0.00 57.85 54.99 1xlx n ARG 424 Cb 1.01 -1.64 -0.06 0.00 -1.02 0.00 0.00 32.46 30.75 1xlx n ARG 424 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xlx n GLY 425 N 1.18 1.49 3.90 -0.13 0.00 -0.56 -4.99 105.19 106.07 1xlx n GLY 425 Ca 0.20 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1xlx n GLY 425 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xlx s MET 426 N -3.22 2.85 0.02 1.61 -1.94 -1.05 -5.00 119.30 112.56 1xlx s MET 426 Ca 0.00 0.30 -0.30 0.00 -1.71 0.00 0.00 55.69 53.97 1xlx s MET 426 Cb 0.00 -2.10 -0.05 0.00 2.01 0.00 0.00 34.83 34.69 1xlx s MET 426 CO 0.00 -0.95 1.33 -1.21 -0.01 0.00 0.00 175.02 174.19 1xlx s GLU 427 N -5.25 4.32 -0.02 2.03 0.41 -1.26 -4.65 118.70 114.29 1xlx s GLU 427 Ca 0.57 1.90 -0.24 0.00 -0.41 0.00 0.00 54.97 56.80 1xlx s GLU 427 Cb -0.11 -3.49 -0.05 0.00 -1.78 0.00 0.00 34.13 28.71 1xlx s GLU 427 CO 0.49 -0.48 0.71 0.42 -0.49 0.00 0.00 175.26 175.91 1xlx s ILE 428 N 1.96 4.92 -0.04 -1.63 1.01 -1.26 -4.98 121.20 121.17 1xlx s ILE 428 Ca 0.62 1.49 -0.27 0.00 0.00 0.00 0.00 60.65 62.48 1xlx s ILE 428 Cb -0.31 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 1xlx s ILE 428 CO 0.27 0.31 0.87 -0.55 0.00 0.00 0.00 174.94 175.84 1xlx s SER 429 N 0.36 7.20 0.18 3.58 0.15 -1.26 -4.95 113.70 118.95 1xlx s SER 429 Ca 0.37 1.45 -0.02 0.00 0.70 0.00 0.00 55.95 58.45 1xlx s SER 429 Cb -0.19 -2.50 0.35 0.00 -1.71 0.00 0.00 66.02 61.97 1xlx s SER 429 CO 0.20 -0.23 0.93 -2.65 1.20 0.00 0.00 173.24 172.69 1xlx n PRO 430 N 4.02 -0.05 0.00 5.44 -0.02 -1.26 0.72 135.00 143.85 1xlx n PRO 430 Ca 0.03 0.92 0.16 0.00 -2.02 0.00 0.00 63.50 62.59 1xlx n PRO 430 Cb 0.51 -1.41 0.91 0.00 -0.02 0.00 0.00 33.50 33.49 1xlx n PRO 430 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1xlx n MET 431 N -4.88 0.90 -0.01 -0.52 2.81 -1.26 -2.45 117.12 111.71 1xlx n MET 431 Ca 0.12 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 56.07 1xlx n MET 431 Cb 0.37 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 31.44 1xlx n MET 431 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xlx s ASP 433 N -1.02 6.27 0.50 0.00 -1.08 -1.02 -3.62 116.67 116.71 1xlx s ASP 433 Ca 0.15 -0.65 0.28 0.00 -0.52 0.00 0.00 52.55 51.81 1xlx s ASP 433 Cb 0.10 -2.40 1.30 0.00 -1.46 0.00 0.00 42.92 40.47 1xlx s ASP 433 CO 0.15 -1.21 1.99 0.07 0.52 0.00 0.00 175.17 176.69 1xlx h LYS 434 N 9.31 0.00 -0.00 4.34 2.10 -1.88 -0.77 116.57 129.66 1xlx h LYS 434 Ca -0.27 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.38 1xlx h LYS 434 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1xlx h LYS 434 CO 1.09 0.14 -0.08 0.72 -2.00 0.00 0.00 179.45 179.31 1xlx n HIS 435 N -3.46 0.00 0.00 0.07 8.25 -1.26 -4.48 115.22 114.35 1xlx n HIS 435 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1xlx n HIS 435 Cb 0.31 -0.36 0.00 0.00 1.12 0.00 0.00 29.99 31.06 1xlx n HIS 435 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1xlx n THR 436 N -1.35 0.00 -2.38 1.59 -1.04 -1.09 -5.09 114.28 104.92 1xlx n THR 436 Ca 0.10 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.68 1xlx n THR 436 Cb 0.30 -0.14 -0.02 0.00 -1.82 0.00 0.00 70.33 68.65 1xlx n THR 436 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xlx s ALA 437 N -1.05 3.61 -0.22 2.41 0.00 -0.32 -4.99 121.76 121.20 1xlx s ALA 437 Ca 0.00 0.45 -0.29 0.00 0.00 0.00 0.00 51.96 52.12 1xlx s ALA 437 Cb 0.00 -3.66 -0.01 0.00 0.00 0.00 0.00 23.12 19.45 1xlx s ALA 437 CO 0.00 -1.30 1.27 0.45 0.00 0.00 0.00 175.76 176.18 1xlx s SER 438 N 2.27 6.85 0.52 0.00 0.15 -1.26 -4.91 113.70 117.32 1xlx s SER 438 Ca 0.57 1.49 0.18 0.00 0.70 0.00 0.00 55.95 58.90 1xlx s SER 438 Cb -0.22 -2.54 1.32 0.00 -1.71 0.00 0.00 66.02 62.88 1xlx s SER 438 CO 0.17 -0.88 2.14 0.58 1.20 0.00 0.00 173.24 176.45 1xlx h VAL 439 N 5.67 0.93 0.00 4.45 2.07 -1.99 -1.81 116.25 125.58 1xlx h VAL 439 Ca -0.26 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 1xlx h VAL 439 Cb 1.10 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1xlx h VAL 439 CO 0.99 0.04 -0.22 -0.33 0.02 0.00 0.00 177.57 178.07 1xlx h GLU 440 N 0.00 0.00 -0.45 1.57 3.07 -1.90 -2.54 114.58 114.33 1xlx h GLU 440 Ca -0.00 0.00 0.07 0.00 -0.50 0.00 0.00 59.36 58.93 1xlx h GLU 440 Cb 0.07 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.92 1xlx h GLU 440 CO 0.00 0.71 0.09 0.87 -1.40 0.00 0.00 179.01 179.29 1xlx h LYS 441 N -1.00 0.22 -0.88 2.33 1.57 -1.85 -1.37 116.57 115.59 1xlx h LYS 441 Ca -0.05 -0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.89 1xlx h LYS 441 Cb 0.79 -0.05 -0.10 0.00 0.08 0.00 0.00 32.23 32.94 1xlx h LYS 441 CO -0.03 0.15 0.44 0.77 -0.57 0.00 0.00 179.45 180.21 1xlx h SER 442 N 0.23 0.49 0.70 0.86 0.02 -1.38 -0.72 113.55 113.75 1xlx h SER 442 Ca 0.22 0.11 -0.18 0.00 -0.84 0.00 0.00 61.79 61.10 1xlx h SER 442 Cb 0.28 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 1xlx h SER 442 CO -0.29 0.16 -0.82 1.56 -1.14 0.00 0.00 176.83 176.30 1xlx h GLN 443 N 0.57 0.08 -0.30 3.45 1.08 -0.84 -2.53 115.11 116.62 1xlx h GLN 443 Ca 0.50 -0.09 -0.05 0.00 -1.45 0.00 0.00 58.65 57.57 1xlx h GLN 443 Cb 0.80 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.25 1xlx h GLN 443 CO -0.41 0.86 -0.01 0.28 -0.95 0.00 0.00 178.83 178.59 1xlx h VAL 444 N 0.05 1.26 -0.88 -0.54 2.07 -0.39 -1.00 116.25 116.82 1xlx h VAL 444 Ca -0.02 -0.96 0.03 0.00 0.82 0.00 0.00 66.70 66.57 1xlx h VAL 444 Cb 1.44 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 32.46 1xlx h VAL 444 CO 0.12 0.31 0.57 1.23 0.02 0.00 0.00 177.57 179.82 1xlx h GLY 445 N 0.32 1.27 1.23 2.17 0.00 -1.21 -0.21 103.07 106.64 1xlx h GLY 445 Ca 0.08 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 1xlx h GLY 445 CO 0.02 0.39 0.22 -2.75 0.00 0.00 0.00 176.54 174.41 1xlx h PHE 446 N 1.12 1.00 -0.04 5.60 3.57 -1.08 -0.07 116.94 127.04 1xlx h PHE 446 Ca 0.34 -0.08 -0.16 0.00 3.53 0.00 0.00 57.97 61.60 1xlx h PHE 446 Cb -0.03 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 38.43 1xlx h PHE 446 CO -0.02 0.79 -0.62 0.82 -2.23 0.00 0.00 178.31 177.06 1xlx h ILE 447 N 0.95 1.39 -0.02 1.41 2.04 -0.82 -0.48 117.51 121.98 1xlx h ILE 447 Ca 0.21 -2.01 -0.00 0.00 1.00 0.00 0.00 64.86 64.06 1xlx h ILE 447 Cb 0.25 2.43 -0.00 0.00 -0.74 0.00 0.00 36.82 38.76 1xlx h ILE 447 CO -0.01 0.60 -0.00 0.44 0.00 0.00 0.00 178.15 179.17 1xlx h ASP 448 N 0.03 0.03 0.83 1.72 3.32 -0.80 0.12 116.42 121.67 1xlx h ASP 448 Ca -0.07 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1xlx h ASP 448 Cb 1.30 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1xlx h ASP 448 CO 0.12 0.39 -0.87 -1.22 -1.72 0.00 0.00 179.24 175.95 1xlx n TYR 449 N -4.89 0.67 0.07 4.55 4.02 -0.06 -4.39 117.16 117.12 1xlx n TYR 449 Ca -0.08 0.19 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 1xlx n TYR 449 Cb 0.20 -0.74 0.00 0.00 -0.02 0.00 0.00 39.34 38.78 1xlx n TYR 449 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1xlx n ILE 450 N -2.31 0.60 -0.09 -0.72 5.41 -0.95 -4.82 119.36 116.47 1xlx n ILE 450 Ca 0.02 0.20 -0.11 0.00 1.00 0.00 0.00 62.75 63.86 1xlx n ILE 450 Cb 0.48 -1.07 -0.04 0.00 -0.71 0.00 0.00 39.64 38.31 1xlx n ILE 450 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1xlx h VAL 451 N 0.00 1.25 -0.18 1.39 2.07 -1.14 -2.99 116.25 116.66 1xlx h VAL 451 Ca 0.00 -0.91 -0.10 0.00 0.82 0.00 0.00 66.70 66.51 1xlx h VAL 451 Cb 0.00 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1xlx h VAL 451 CO 0.00 0.29 -0.29 -0.74 0.02 0.00 0.00 177.57 176.85 1xlx h HIS 452 N 0.27 0.63 -0.68 1.57 -0.00 -0.99 -0.58 115.15 115.37 1xlx h HIS 452 Ca 0.08 -0.22 0.15 0.00 -0.00 0.00 0.00 60.37 60.38 1xlx h HIS 452 Cb 0.41 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 27.66 1xlx h HIS 452 CO 0.03 0.93 0.46 -1.35 -0.00 0.00 0.00 177.93 178.00 1xlx h PRO 453 N 0.15 0.29 0.01 5.26 0.11 -1.75 0.19 132.00 136.26 1xlx h PRO 453 Ca 0.01 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1xlx h PRO 453 Cb 0.87 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.91 1xlx h PRO 453 CO 0.07 0.19 -0.15 1.25 -0.21 0.00 0.00 178.00 179.15 1xlx h LEU 454 N 0.30 0.02 -1.00 2.35 5.85 -1.33 -3.13 115.31 118.37 1xlx h LEU 454 Ca 0.33 -0.96 -0.09 0.00 0.84 0.00 0.00 57.88 58.01 1xlx h LEU 454 Cb 0.87 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1xlx h LEU 454 CO -0.08 1.06 -0.19 -0.50 -0.34 0.00 0.00 178.44 178.39 1xlx h TRP 455 N -0.97 0.54 -0.93 1.25 4.06 -1.04 -0.48 115.95 118.39 1xlx h TRP 455 Ca -0.04 -0.10 0.05 0.00 2.06 0.00 0.00 58.89 60.86 1xlx h TRP 455 Cb 1.06 -0.14 -0.06 0.00 -1.00 0.00 0.00 29.16 29.02 1xlx h TRP 455 CO 0.26 0.66 0.61 1.49 -3.56 0.00 0.00 178.44 177.90 1xlx h GLU 456 N 0.45 1.09 0.04 0.49 4.81 -0.75 0.12 114.58 120.83 1xlx h GLU 456 Ca 0.07 -0.07 -0.24 0.00 -0.13 0.00 0.00 59.36 59.00 1xlx h GLU 456 Cb 0.59 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1xlx h GLU 456 CO 0.04 0.72 -1.02 1.15 -0.73 0.00 0.00 179.01 179.17 1xlx h THR 457 N 1.12 1.44 -0.20 0.32 2.02 -1.37 -2.66 112.91 113.58 1xlx h THR 457 Ca 0.38 -2.64 -0.03 0.00 0.77 0.00 0.00 66.41 64.89 1xlx h THR 457 Cb 0.08 2.58 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 1xlx h THR 457 CO -0.13 0.78 0.02 -0.25 0.37 0.00 0.00 175.52 176.32 1xlx h TRP 458 N 0.17 0.36 -0.95 3.16 2.91 -0.73 -2.55 115.95 118.33 1xlx h TRP 458 Ca -0.09 -0.05 0.11 0.00 1.13 0.00 0.00 58.89 59.99 1xlx h TRP 458 Cb 1.68 -0.10 -0.08 0.00 -0.51 0.00 0.00 29.16 30.15 1xlx h TRP 458 CO 0.06 0.50 0.58 0.00 -1.03 0.00 0.00 178.44 178.55 1xlx h ALA 459 N 0.82 1.40 -0.39 2.65 0.00 -0.83 -0.94 119.26 121.97 1xlx h ALA 459 Ca 0.06 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1xlx h ALA 459 Cb 0.33 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1xlx h ALA 459 CO 0.01 0.20 0.23 -0.44 0.00 0.00 0.00 179.25 179.24 1xlx h ASP 460 N 0.94 0.48 -0.61 0.00 5.19 -1.31 0.19 116.42 121.30 1xlx h ASP 460 Ca 0.46 -0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.81 1xlx h ASP 460 Cb 0.43 -0.12 -0.03 0.00 0.18 0.00 0.00 39.33 39.79 1xlx h ASP 460 CO -0.26 0.41 0.39 0.25 -3.12 0.00 0.00 179.24 176.91 1xlx h LEU 461 N 0.51 0.72 -3.05 1.55 5.85 -0.78 -3.24 115.31 116.88 1xlx h LEU 461 Ca 0.14 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1xlx h LEU 461 Cb 0.03 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1xlx h LEU 461 CO -0.02 0.55 0.00 1.33 -0.34 0.00 0.00 178.44 179.95 1xlx n VAL 462 N -4.42 1.96 -1.69 1.05 0.24 -0.70 -4.98 118.33 109.79 1xlx n VAL 462 Ca 0.06 -2.20 -0.38 0.00 -2.04 0.00 0.00 64.34 59.78 1xlx n VAL 462 Cb 0.06 -0.24 0.05 0.00 -1.47 0.00 0.00 33.84 32.24 1xlx n VAL 462 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xlx n GLN 463 N -1.27 1.26 -1.15 7.34 10.64 0.64 -1.42 117.38 133.42 1xlx n GLN 463 Ca 0.17 0.48 -0.18 0.00 -1.83 0.00 0.00 57.00 55.63 1xlx n GLN 463 Cb 0.69 -2.39 0.22 0.00 -0.86 0.00 0.00 30.24 27.89 1xlx n GLN 463 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 1xlx n PRO 464 N -1.14 2.69 -0.20 2.61 -0.04 -1.26 -4.96 135.00 132.70 1xlx n PRO 464 Ca 0.13 -2.99 0.16 0.00 -0.04 0.00 0.00 63.50 60.76 1xlx n PRO 464 Cb 0.46 -2.18 0.50 0.00 -0.04 0.00 0.00 33.50 32.24 1xlx n PRO 464 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xlx h ASP 465 N 1.50 0.41 -0.41 3.54 3.32 -1.55 -2.87 116.42 120.36 1xlx h ASP 465 Ca 0.52 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.60 1xlx h ASP 465 Cb 2.70 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 42.20 1xlx h ASP 465 CO 0.99 0.20 0.00 0.00 -1.72 0.00 0.00 179.24 178.70 1xlx n ALA 466 N -2.52 2.83 -0.29 3.45 0.00 -1.26 -4.59 120.51 118.13 1xlx n ALA 466 Ca 0.16 -1.76 -0.02 0.00 0.00 0.00 0.00 53.44 51.82 1xlx n ALA 466 Cb 0.58 -0.74 0.14 0.00 0.00 0.00 0.00 19.45 19.44 1xlx n ALA 466 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1xlx h GLN 467 N 2.62 1.16 0.12 0.00 5.75 -1.87 -2.37 115.11 120.53 1xlx h GLN 467 Ca 0.00 -0.12 0.01 0.00 -0.15 0.00 0.00 58.65 58.39 1xlx h GLN 467 Cb 1.27 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 29.57 1xlx h GLN 467 CO 0.18 0.84 -0.18 -0.44 -2.65 0.00 0.00 178.83 176.57 1xlx h ASP 468 N 1.18 -0.50 -0.93 -0.69 3.45 -1.83 -1.46 116.42 115.64 1xlx h ASP 468 Ca 0.30 0.06 0.18 0.00 0.43 0.00 0.00 57.03 58.00 1xlx h ASP 468 Cb -0.00 0.19 -0.11 0.00 -0.56 0.00 0.00 39.33 38.85 1xlx h ASP 468 CO -0.05 -0.27 0.51 0.40 -1.57 0.00 0.00 179.24 178.27 1xlx h ILE 469 N -0.37 0.67 -0.38 0.35 2.04 -1.83 -0.20 117.51 117.79 1xlx h ILE 469 Ca 0.02 -0.22 -0.12 0.00 1.00 0.00 0.00 64.86 65.54 1xlx h ILE 469 Cb 0.37 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 1xlx h ILE 469 CO -0.09 0.12 -0.22 -0.07 0.00 0.00 0.00 178.15 177.89 1xlx h LEU 470 N 0.65 0.85 0.25 1.44 4.07 -1.09 -1.10 115.31 120.38 1xlx h LEU 470 Ca 0.54 -0.42 0.01 0.00 0.08 0.00 0.00 57.88 58.09 1xlx h LEU 470 Cb 0.85 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 42.32 1xlx h LEU 470 CO -0.40 1.08 -0.37 0.44 -1.08 0.00 0.00 178.44 178.11 1xlx h ASP 471 N 0.62 -1.05 -0.57 -0.43 3.32 -0.05 -0.23 116.42 118.03 1xlx h ASP 471 Ca 0.08 0.10 0.10 0.00 0.02 0.00 0.00 57.03 57.33 1xlx h ASP 471 Cb 0.78 0.37 -0.07 0.00 0.22 0.00 0.00 39.33 40.63 1xlx h ASP 471 CO 0.06 -0.49 0.16 0.74 -1.72 0.00 0.00 179.24 177.99 1xlx h THR 472 N -0.69 0.72 0.52 0.35 2.02 -1.09 -1.17 112.91 113.57 1xlx h THR 472 Ca -0.00 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 1xlx h THR 472 Cb 0.66 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1xlx h THR 472 CO -0.14 0.06 -0.44 0.25 0.37 0.00 0.00 175.52 175.61 1xlx h LEU 473 N 0.31 -1.19 -1.93 2.58 5.85 -1.01 0.23 115.31 120.15 1xlx h LEU 473 Ca 0.29 0.09 0.16 0.00 0.84 0.00 0.00 57.88 59.26 1xlx h LEU 473 Cb 0.39 0.38 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1xlx h LEU 473 CO -0.34 -0.62 0.41 -0.08 -0.34 0.00 0.00 178.44 177.47 1xlx h GLU 474 N -0.95 0.07 0.01 1.25 4.81 -0.79 -0.29 114.58 118.69 1xlx h GLU 474 Ca -0.06 -0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.05 1xlx h GLU 474 Cb 0.82 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.19 1xlx h GLU 474 CO -0.02 0.05 -0.44 -0.44 -0.73 0.00 0.00 179.01 177.42 1xlx h ASP 475 N 0.07 0.38 -0.39 1.04 3.32 -0.74 -3.01 116.42 117.09 1xlx h ASP 475 Ca 0.28 -0.78 -0.08 0.00 0.02 0.00 0.00 57.03 56.46 1xlx h ASP 475 Cb 1.00 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 1xlx h ASP 475 CO -0.02 1.11 -0.05 0.78 -1.72 0.00 0.00 179.24 179.34 1xlx h ASN 476 N -0.31 0.78 -0.55 6.45 2.35 -0.14 -2.25 115.58 121.91 1xlx h ASN 476 Ca -0.06 -0.21 0.09 0.00 -0.55 0.00 0.00 56.30 55.57 1xlx h ASN 476 Cb 1.19 -0.21 -0.07 0.00 0.05 0.00 0.00 38.32 39.28 1xlx h ASN 476 CO 0.09 0.88 0.17 -0.09 -1.65 0.00 0.00 177.43 176.83 1xlx h ARG 477 N 0.74 0.33 -0.11 0.81 2.43 -1.15 -2.27 114.38 115.16 1xlx h ARG 477 Ca 0.13 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.16 1xlx h ARG 477 Cb 0.53 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1xlx h ARG 477 CO 0.03 0.22 -0.47 -0.91 -1.51 0.00 0.00 179.97 177.33 1xlx h ASN 478 N 0.33 0.30 -0.23 -3.80 2.35 -1.29 -1.45 115.58 111.78 1xlx h ASN 478 Ca 0.28 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1xlx h ASN 478 Cb 0.34 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1xlx h ASN 478 CO -0.30 0.73 0.15 -0.25 -1.65 0.00 0.00 177.43 176.10 1xlx h TRP 479 N 0.23 0.30 -0.40 1.19 7.01 -1.01 0.19 115.95 123.46 1xlx h TRP 479 Ca 0.01 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.93 1xlx h TRP 479 Cb 0.91 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.86 1xlx h TRP 479 CO 0.02 0.21 -0.11 1.88 -2.79 0.00 0.00 178.44 177.65 1xlx h TYR 480 N 0.30 0.77 -0.07 2.65 0.05 -1.26 -2.24 116.97 117.16 1xlx h TYR 480 Ca 0.08 -0.13 -0.01 0.00 0.05 0.00 0.00 58.73 58.72 1xlx h TYR 480 Cb -0.01 -0.20 -0.00 0.00 1.01 0.00 0.00 36.73 37.53 1xlx h TYR 480 CO -0.05 0.79 0.00 0.37 -1.05 0.00 0.00 178.16 178.21 1xlx h GLN 481 N 0.64 0.13 0.00 4.88 5.75 -0.83 -2.83 115.11 122.86 1xlx h GLN 481 Ca 0.11 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 1xlx h GLN 481 Cb 0.57 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.10 1xlx h GLN 481 CO 0.04 0.40 0.00 -1.13 -2.65 0.00 0.00 178.83 175.48 1xlx n SER 482 N -4.85 0.48 0.02 -0.69 3.41 0.62 -1.51 113.62 111.10 1xlx n SER 482 Ca -0.07 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 1xlx n SER 482 Cb 0.19 -0.76 0.23 0.00 -0.26 0.00 0.00 64.21 63.61 1xlx n SER 482 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1xlx n MET 483 N -2.10 0.10 -3.69 4.33 2.81 -0.85 -4.83 117.12 112.88 1xlx n MET 483 Ca 0.00 0.03 -0.37 0.00 -1.81 0.00 0.00 57.70 55.55 1xlx n MET 483 Cb 0.10 -1.56 -0.06 0.00 -0.71 0.00 0.00 33.22 30.98 1xlx n MET 483 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1xlx s ILE 484 N -3.06 5.34 -2.00 2.02 1.01 -0.57 -5.04 121.20 118.90 1xlx s ILE 484 Ca 0.09 0.43 0.16 0.00 0.00 0.00 0.00 60.65 61.34 1xlx s ILE 484 Cb 0.16 -3.53 0.45 0.00 0.01 0.00 0.00 42.46 39.55 1xlx s ILE 484 CO 0.70 0.54 1.36 -2.65 0.00 0.00 0.00 174.94 174.89