#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xm6 h ASP 164 N 0.00 0.32 -0.06 -1.84 3.04 -1.99 -2.07 116.42 113.82 1xm6 h ASP 164 Ca 0.00 -0.06 -0.14 0.00 -3.24 0.00 0.00 57.03 53.59 1xm6 h ASP 164 Cb 0.00 -0.08 -0.01 0.00 -1.04 0.00 0.00 39.33 38.20 1xm6 h ASP 164 CO 0.00 0.28 -0.43 0.45 -2.04 0.00 0.00 179.24 177.50 1xm6 h HIS 165 N 0.33 0.71 -0.16 4.15 3.86 -1.99 -2.31 115.15 119.74 1xm6 h HIS 165 Ca 0.09 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 59.08 1xm6 h HIS 165 Cb 0.02 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1xm6 h HIS 165 CO -0.04 0.92 0.06 1.25 0.86 0.00 0.00 177.93 180.98 1xm6 h LEU 166 N 0.48 0.23 -1.45 2.43 5.85 -1.89 -1.45 115.31 119.52 1xm6 h LEU 166 Ca 0.04 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1xm6 h LEU 166 Cb 0.94 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1xm6 h LEU 166 CO 0.08 0.34 0.03 0.00 -0.34 0.00 0.00 178.44 178.55 1xm6 h ALA 167 N 0.90 1.56 -0.34 1.25 0.00 -1.32 -0.03 119.26 121.28 1xm6 h ALA 167 Ca 0.05 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1xm6 h ALA 167 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1xm6 h ALA 167 CO -0.00 0.33 -0.15 -0.22 0.00 0.00 0.00 179.25 179.20 1xm6 h LYS 168 N 0.38 0.71 -0.33 0.00 3.64 -1.02 -2.92 116.57 117.02 1xm6 h LYS 168 Ca 0.09 -0.30 -0.13 0.00 -1.27 0.00 0.00 60.65 59.03 1xm6 h LYS 168 Cb 0.21 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1xm6 h LYS 168 CO 0.00 0.90 -0.32 1.49 -2.27 0.00 0.00 179.45 179.25 1xm6 h GLU 169 N 0.49 0.73 0.00 1.90 4.57 -0.84 -2.92 114.58 118.51 1xm6 h GLU 169 Ca 0.08 -0.34 0.00 0.00 -1.18 0.00 0.00 59.36 57.92 1xm6 h GLU 169 Cb 0.68 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.26 1xm6 h GLU 169 CO 0.05 0.95 0.00 1.28 -1.18 0.00 0.00 179.01 180.11 1xm6 n LEU 170 N -4.07 0.00 0.26 1.64 4.77 -0.06 -1.99 117.00 117.54 1xm6 n LEU 170 Ca -0.01 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 1xm6 n LEU 170 Cb 0.49 -0.35 0.70 0.00 -2.33 0.00 0.00 43.42 41.93 1xm6 n LEU 170 CO 0.46 -0.17 0.97 -0.33 -1.33 0.00 0.00 177.39 176.99 1xm6 h GLU 171 N 0.00 0.00 -0.82 3.23 5.08 -1.32 -2.12 114.58 118.63 1xm6 h GLU 171 Ca 0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1xm6 h GLU 171 Cb 0.18 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.37 1xm6 h GLU 171 CO 0.00 0.12 0.15 -0.25 -1.00 0.00 0.00 179.01 178.03 1xm6 n ASP 172 N -3.75 3.91 -0.36 1.42 8.00 -0.84 -4.64 116.55 120.28 1xm6 n ASP 172 Ca -0.02 -2.76 0.06 0.00 0.71 0.00 0.00 54.79 52.78 1xm6 n ASP 172 Cb 0.23 -0.66 0.23 0.00 -0.02 0.00 0.00 41.12 40.90 1xm6 n ASP 172 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1xm6 h LEU 173 N 2.08 0.94 -1.59 0.64 5.85 -1.57 -1.58 115.31 120.09 1xm6 h LEU 173 Ca 0.14 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1xm6 h LEU 173 Cb 1.73 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1xm6 h LEU 173 CO 0.46 0.52 0.00 0.59 -0.34 0.00 0.00 178.44 179.67 1xm6 n ASN 174 N -4.60 2.32 -4.43 1.25 3.02 -1.26 -4.82 115.26 106.75 1xm6 n ASN 174 Ca 0.18 -2.08 -0.28 0.00 -0.03 0.00 0.00 54.58 52.37 1xm6 n ASN 174 Cb 0.33 -0.32 -0.12 0.00 -0.61 0.00 0.00 39.78 39.06 1xm6 n ASN 174 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xm6 s LYS 175 N -1.55 1.53 0.42 3.52 1.02 -0.59 -4.85 119.74 119.25 1xm6 s LYS 175 Ca 0.27 -1.41 0.18 0.00 0.02 0.00 0.00 55.97 55.03 1xm6 s LYS 175 Cb 0.15 -1.91 0.94 0.00 -0.52 0.00 0.00 37.83 36.49 1xm6 s LYS 175 CO 0.16 0.43 1.89 2.35 -0.92 0.00 0.00 175.35 179.26 1xm6 h TRP 176 N 3.48 0.00 -0.02 3.18 2.91 -1.91 -2.98 115.95 120.62 1xm6 h TRP 176 Ca -0.48 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.54 1xm6 h TRP 176 Cb 1.19 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.84 1xm6 h TRP 176 CO 0.64 0.29 0.00 0.41 -1.03 0.00 0.00 178.44 178.75 1xm6 n GLY 177 N -0.42 -0.86 3.69 2.65 0.00 -1.26 -4.87 105.19 104.12 1xm6 n GLY 177 Ca -0.02 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1xm6 n GLY 177 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xm6 n LEU 178 N -0.62 4.00 -4.16 0.99 0.00 -1.13 -4.95 117.00 111.13 1xm6 n LEU 178 Ca 0.12 1.09 -0.39 0.00 0.00 0.00 0.00 56.01 56.83 1xm6 n LEU 178 Cb 0.08 -1.49 -0.09 0.00 0.00 0.00 0.00 43.42 41.92 1xm6 n LEU 178 CO 0.09 -0.74 0.00 0.21 0.00 0.00 0.00 177.39 176.95 1xm6 s ASN 179 N -0.59 5.53 0.48 1.96 3.84 -1.26 -4.95 114.94 119.95 1xm6 s ASN 179 Ca 0.62 -2.34 0.24 0.00 0.21 0.00 0.00 52.86 51.60 1xm6 s ASN 179 Cb -0.50 -1.93 1.19 0.00 -0.55 0.00 0.00 41.25 39.46 1xm6 s ASN 179 CO 0.57 -0.54 1.97 -0.29 -2.79 0.00 0.00 177.10 176.02 1xm6 h ILE 180 N 5.77 0.67 -0.68 -5.21 6.09 -1.98 -2.28 117.51 119.90 1xm6 h ILE 180 Ca -0.09 -0.81 -0.03 0.00 -1.37 0.00 0.00 64.86 62.55 1xm6 h ILE 180 Cb 1.02 1.51 -0.03 0.00 0.47 0.00 0.00 36.82 39.79 1xm6 h ILE 180 CO 0.76 0.18 0.30 -0.26 -3.07 0.00 0.00 178.15 176.06 1xm6 h PHE 181 N 0.00 1.01 -0.63 2.19 0.04 -1.96 -1.20 116.94 116.39 1xm6 h PHE 181 Ca -0.00 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 1xm6 h PHE 181 Cb 0.50 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.31 1xm6 h PHE 181 CO 0.00 0.77 0.22 -0.91 -0.60 0.00 0.00 178.31 177.79 1xm6 h ASN 182 N 0.95 0.91 -0.38 2.17 2.35 -1.85 -2.10 115.58 117.63 1xm6 h ASN 182 Ca 0.23 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 1xm6 h ASN 182 Cb 0.17 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1xm6 h ASN 182 CO -0.02 0.86 0.21 0.58 -1.65 0.00 0.00 177.43 177.41 1xm6 h VAL 183 N 0.91 1.14 -0.63 2.81 2.07 -1.23 -2.34 116.25 118.98 1xm6 h VAL 183 Ca 0.21 -0.37 0.07 0.00 0.82 0.00 0.00 66.70 67.43 1xm6 h VAL 183 Cb 0.27 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.67 1xm6 h VAL 183 CO -0.01 0.15 0.32 0.00 0.02 0.00 0.00 177.57 178.04 1xm6 h ALA 184 N 1.07 0.84 -0.10 1.67 0.00 -1.01 -2.33 119.26 119.40 1xm6 h ALA 184 Ca 0.13 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1xm6 h ALA 184 Cb 0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1xm6 h ALA 184 CO -0.02 -0.05 0.01 0.78 0.00 0.00 0.00 179.25 179.97 1xm6 h GLY 185 N 0.58 0.15 -2.32 0.00 0.00 -0.86 -2.70 103.07 97.92 1xm6 h GLY 185 Ca 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1xm6 h GLY 185 CO -0.22 0.06 0.00 -1.72 0.00 0.00 0.00 176.54 174.66 1xm6 n TYR 186 N -4.46 0.72 -1.94 5.60 4.01 -0.92 -4.43 117.16 115.73 1xm6 n TYR 186 Ca -0.01 -0.40 0.05 0.00 -0.16 0.00 0.00 57.90 57.38 1xm6 n TYR 186 Cb 0.13 -0.00 0.12 0.00 -0.31 0.00 0.00 39.34 39.27 1xm6 n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1xm6 n SER 187 N 1.42 1.38 -3.69 7.72 3.41 -0.94 -4.48 113.62 118.42 1xm6 n SER 187 Ca 0.20 -2.99 -0.24 0.00 -0.26 0.00 0.00 58.87 55.59 1xm6 n SER 187 Cb 0.58 -0.41 0.05 0.00 -0.26 0.00 0.00 64.21 64.17 1xm6 n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1xm6 n HIS 188 N -0.44 -2.30 -3.22 7.33 8.25 -1.24 -1.79 115.22 121.81 1xm6 n HIS 188 Ca 0.13 0.92 -0.23 0.00 -0.26 0.00 0.00 57.72 58.27 1xm6 n HIS 188 Cb 0.87 -4.55 0.02 0.00 1.12 0.00 0.00 29.99 27.44 1xm6 n HIS 188 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1xm6 n ASN 189 N -3.00 -4.84 -2.86 0.41 5.15 -1.04 -4.93 115.26 104.15 1xm6 n ASN 189 Ca -0.13 -0.35 -0.27 0.00 -0.60 0.00 0.00 54.58 53.23 1xm6 n ASN 189 Cb 0.61 -3.94 -0.03 0.00 -0.53 0.00 0.00 39.78 35.88 1xm6 n ASN 189 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1xm6 n ARG 190 N -3.90 3.24 0.10 1.20 1.74 -0.74 -4.90 116.66 113.40 1xm6 n ARG 190 Ca -0.06 -4.78 0.02 0.00 -0.77 0.00 0.00 57.85 52.27 1xm6 n ARG 190 Cb 0.58 -2.23 0.39 0.00 -1.02 0.00 0.00 32.46 30.18 1xm6 n ARG 190 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1xm6 h PRO 191 N 2.91 0.28 -0.02 5.56 0.13 -1.86 -3.08 132.00 135.93 1xm6 h PRO 191 Ca 0.16 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1xm6 h PRO 191 Cb 0.59 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.67 1xm6 h PRO 191 CO 0.82 0.38 -0.02 1.25 -0.23 0.00 0.00 178.00 180.20 1xm6 h LEU 192 N 0.27 0.05 -0.16 1.56 5.85 -1.91 0.06 115.31 121.03 1xm6 h LEU 192 Ca 0.06 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1xm6 h LEU 192 Cb 0.33 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.34 1xm6 h LEU 192 CO 0.02 0.56 0.00 0.41 -0.34 0.00 0.00 178.44 179.08 1xm6 n THR 193 N -4.80 0.00 0.00 1.05 -1.04 -1.16 -1.12 114.28 107.21 1xm6 n THR 193 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1xm6 n THR 193 Cb 0.28 -0.42 0.00 0.00 -1.82 0.00 0.00 70.33 68.37 1xm6 n THR 193 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xm6 n ILE 195 N -0.24 0.00 0.04 12.58 0.13 0.01 -1.72 119.36 130.16 1xm6 n ILE 195 Ca 0.00 0.00 -0.08 0.00 -1.10 0.00 0.00 62.75 61.57 1xm6 n ILE 195 Cb 0.00 0.00 0.07 0.00 -0.84 0.00 0.00 39.64 38.87 1xm6 n ILE 195 CO 0.00 0.00 0.00 0.24 2.80 0.00 0.00 176.55 179.59 1xm6 h MET 196 N 0.00 0.43 -0.39 9.51 2.86 -1.34 0.13 114.93 126.13 1xm6 h MET 196 Ca 0.00 -0.30 -0.15 0.00 -2.06 0.00 0.00 59.70 57.20 1xm6 h MET 196 Cb 0.00 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1xm6 h MET 196 CO 0.00 0.91 -0.33 -0.92 1.06 0.00 0.00 176.91 177.63 1xm6 h TYR 197 N 0.32 1.09 -0.49 -0.22 3.20 -1.56 -0.49 116.97 118.82 1xm6 h TYR 197 Ca -0.01 -0.31 -0.05 0.00 3.14 0.00 0.00 58.73 61.50 1xm6 h TYR 197 Cb 1.14 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 1xm6 h TYR 197 CO 0.04 1.13 0.12 0.00 -1.64 0.00 0.00 178.16 177.81 1xm6 h ALA 198 N 0.78 0.65 -0.19 1.82 0.00 -1.75 -1.70 119.26 118.87 1xm6 h ALA 198 Ca 0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1xm6 h ALA 198 Cb 0.92 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1xm6 h ALA 198 CO 0.09 0.34 0.02 0.82 0.00 0.00 0.00 179.25 180.52 1xm6 h ILE 199 N 0.68 1.23 -0.55 0.00 2.04 -0.68 -0.90 117.51 119.32 1xm6 h ILE 199 Ca 0.15 -0.75 -0.06 0.00 1.00 0.00 0.00 64.86 65.20 1xm6 h ILE 199 Cb 0.33 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1xm6 h ILE 199 CO 0.00 0.23 0.10 -0.26 0.00 0.00 0.00 178.15 178.23 1xm6 h PHE 200 N 0.10 0.89 -0.39 1.37 -1.00 -1.06 -1.53 116.94 115.32 1xm6 h PHE 200 Ca 0.06 -0.09 -0.08 0.00 2.81 0.00 0.00 57.97 60.66 1xm6 h PHE 200 Cb 0.32 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.62 1xm6 h PHE 200 CO 0.02 0.76 -0.06 1.96 -1.61 0.00 0.00 178.31 179.38 1xm6 h GLN 201 N 0.82 0.73 -0.94 1.51 4.20 -1.24 -1.11 115.11 119.07 1xm6 h GLN 201 Ca 0.17 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1xm6 h GLN 201 Cb 0.34 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.03 1xm6 h GLN 201 CO 0.00 0.85 0.57 1.49 -0.67 0.00 0.00 178.83 181.08 1xm6 h GLU 202 N 0.54 1.28 -0.13 1.46 4.57 -0.79 -2.72 114.58 118.79 1xm6 h GLU 202 Ca 0.10 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1xm6 h GLU 202 Cb 0.57 -0.27 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 1xm6 h GLU 202 CO 0.03 0.89 0.00 0.54 -1.18 0.00 0.00 179.01 179.30 1xm6 n ARG 203 N -4.35 1.94 -2.08 1.92 1.74 -0.61 -4.94 116.66 110.28 1xm6 n ARG 203 Ca 0.11 -1.39 -0.19 0.00 -0.77 0.00 0.00 57.85 55.61 1xm6 n ARG 203 Cb 0.06 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 1xm6 n ARG 203 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1xm6 n ASP 204 N 0.65 -5.33 0.09 0.55 9.92 -0.67 -4.92 116.55 116.83 1xm6 n ASP 204 Ca 0.17 0.14 -0.01 0.00 -0.53 0.00 0.00 54.79 54.56 1xm6 n ASP 204 Cb 0.43 -4.42 0.26 0.00 -0.64 0.00 0.00 41.12 36.75 1xm6 n ASP 204 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1xm6 h LEU 205 N 0.00 0.28 -0.58 0.64 3.38 -1.53 -1.46 115.31 116.04 1xm6 h LEU 205 Ca -0.42 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 1xm6 h LEU 205 Cb 1.29 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 1xm6 h LEU 205 CO 0.53 0.59 0.20 -0.07 0.09 0.00 0.00 178.44 179.79 1xm6 h LEU 206 N 0.24 0.83 0.26 1.67 3.38 -1.86 -1.73 115.31 118.10 1xm6 h LEU 206 Ca 0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1xm6 h LEU 206 Cb 0.69 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1xm6 h LEU 206 CO 0.05 0.80 -0.13 0.11 0.09 0.00 0.00 178.44 179.37 1xm6 h LYS 207 N 0.81 -0.34 -0.74 1.13 1.57 -1.81 -0.17 116.57 117.04 1xm6 h LYS 207 Ca 0.19 0.02 0.12 0.00 -1.87 0.00 0.00 60.65 59.11 1xm6 h LYS 207 Cb 0.25 0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.56 1xm6 h LYS 207 CO -0.01 -0.02 0.33 1.15 -0.57 0.00 0.00 179.45 180.33 1xm6 h THR 208 N -0.70 0.74 -0.44 -0.16 2.02 -1.25 -2.51 112.91 110.62 1xm6 h THR 208 Ca -0.04 -0.18 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 1xm6 h THR 208 Cb 0.48 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 1xm6 h THR 208 CO 0.06 0.09 0.05 0.49 0.37 0.00 0.00 175.52 176.58 1xm6 n PHE 209 N -4.94 1.52 -4.21 3.16 3.72 -0.66 -4.97 117.46 111.09 1xm6 n PHE 209 Ca 0.13 -0.99 -0.32 0.00 -0.05 0.00 0.00 57.45 56.22 1xm6 n PHE 209 Cb 0.36 -0.45 -0.08 0.00 -0.94 0.00 0.00 39.48 38.37 1xm6 n PHE 209 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1xm6 n ARG 210 N -0.27 -0.82 -3.40 -1.08 1.74 -0.73 -4.55 116.66 107.56 1xm6 n ARG 210 Ca 0.28 0.07 -0.40 0.00 -0.77 0.00 0.00 57.85 57.04 1xm6 n ARG 210 Cb 1.08 -3.21 -0.09 0.00 -1.02 0.00 0.00 32.46 29.22 1xm6 n ARG 210 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xm6 s ILE 211 N -4.20 5.17 0.41 0.55 1.01 -0.15 -4.63 121.20 119.36 1xm6 s ILE 211 Ca 0.08 0.29 -0.25 0.00 0.00 0.00 0.00 60.65 60.77 1xm6 s ILE 211 Cb -0.05 -3.76 -0.08 0.00 0.01 0.00 0.00 42.46 38.58 1xm6 s ILE 211 CO 0.95 0.02 1.26 -0.94 0.00 0.00 0.00 174.94 176.23 1xm6 s SER 212 N 1.70 6.33 0.17 3.58 1.04 -1.26 -4.73 113.70 120.53 1xm6 s SER 212 Ca 0.13 2.55 -0.13 0.00 0.48 0.00 0.00 55.95 58.98 1xm6 s SER 212 Cb -0.16 -2.63 0.06 0.00 0.10 0.00 0.00 66.02 63.39 1xm6 s SER 212 CO 0.11 -0.83 1.76 0.28 0.98 0.00 0.00 173.24 175.54 1xm6 h SER 213 N 2.60 0.72 0.00 7.02 0.02 -1.97 -1.19 113.55 120.75 1xm6 h SER 213 Ca -0.49 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 1xm6 h SER 213 Cb 1.24 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 1xm6 h SER 213 CO 0.62 0.64 -0.02 0.44 -1.14 0.00 0.00 176.83 177.37 1xm6 h ASP 214 N 0.75 -0.07 -0.92 3.07 3.45 -1.99 -0.38 116.42 120.34 1xm6 h ASP 214 Ca 0.19 0.01 0.03 0.00 0.43 0.00 0.00 57.03 57.70 1xm6 h ASP 214 Cb 0.10 0.03 -0.05 0.00 -0.56 0.00 0.00 39.33 38.85 1xm6 h ASP 214 CO -0.03 -0.04 0.59 0.74 -1.57 0.00 0.00 179.24 178.94 1xm6 h THR 215 N -0.04 1.16 -0.37 0.35 2.02 -1.85 -0.71 112.91 113.46 1xm6 h THR 215 Ca 0.01 -0.40 -0.07 0.00 0.77 0.00 0.00 66.41 66.73 1xm6 h THR 215 Cb 0.06 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.35 1xm6 h THR 215 CO -0.02 0.21 -0.03 0.15 0.37 0.00 0.00 175.52 176.20 1xm6 h PHE 216 N 1.16 0.73 -0.48 3.16 3.57 -0.84 -1.49 116.94 122.76 1xm6 h PHE 216 Ca 0.36 -0.14 -0.10 0.00 3.53 0.00 0.00 57.97 61.63 1xm6 h PHE 216 Cb -0.00 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 1xm6 h PHE 216 CO -0.01 0.78 -0.09 0.82 -2.23 0.00 0.00 178.31 177.58 1xm6 h ILE 217 N 0.47 1.27 -0.30 1.41 1.08 -0.71 -0.18 117.51 120.56 1xm6 h ILE 217 Ca 0.10 -1.21 -0.00 0.00 -0.39 0.00 0.00 64.86 63.36 1xm6 h ILE 217 Cb 0.50 1.07 -0.01 0.00 -3.07 0.00 0.00 36.82 35.31 1xm6 h ILE 217 CO 0.02 0.42 0.18 0.74 -0.69 0.00 0.00 178.15 178.82 1xm6 h THR 218 N 0.75 1.11 0.01 -0.27 2.02 -1.07 0.80 112.91 116.26 1xm6 h THR 218 Ca 0.12 -0.28 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1xm6 h THR 218 Cb 0.63 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1xm6 h THR 218 CO 0.04 0.11 -0.00 0.22 0.37 0.00 0.00 175.52 176.26 1xm6 h TYR 219 N 0.38 -0.01 -0.52 3.16 3.20 -1.07 -1.83 116.97 120.28 1xm6 h TYR 219 Ca 0.11 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 1xm6 h TYR 219 Cb 0.03 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1xm6 h TYR 219 CO -0.04 0.02 0.02 0.52 -1.64 0.00 0.00 178.16 177.05 1xm6 h MET 220 N -0.04 0.86 -0.53 1.82 2.86 -0.80 -0.41 114.93 118.69 1xm6 h MET 220 Ca -0.00 -0.23 -0.11 0.00 -2.06 0.00 0.00 59.70 57.30 1xm6 h MET 220 Cb 0.04 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 1xm6 h MET 220 CO 0.00 0.84 -0.09 0.52 1.06 0.00 0.00 176.91 179.25 1xm6 h MET 221 N 0.80 1.00 -0.33 1.72 2.86 -0.77 0.13 114.93 120.34 1xm6 h MET 221 Ca 0.16 -0.36 -0.05 0.00 -2.06 0.00 0.00 59.70 57.39 1xm6 h MET 221 Cb 0.45 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1xm6 h MET 221 CO 0.02 1.04 0.03 1.15 1.06 0.00 0.00 176.91 180.21 1xm6 h THR 222 N 0.87 1.25 -0.13 2.22 2.02 -1.05 -1.26 112.91 116.82 1xm6 h THR 222 Ca 0.14 -0.89 0.01 0.00 0.77 0.00 0.00 66.41 66.44 1xm6 h THR 222 Cb 0.65 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 1xm6 h THR 222 CO 0.04 0.29 0.06 0.25 0.37 0.00 0.00 175.52 176.53 1xm6 h LEU 223 N 0.38 0.08 -0.87 2.58 5.85 -0.91 -2.21 115.31 120.20 1xm6 h LEU 223 Ca 0.10 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.89 1xm6 h LEU 223 Cb 0.40 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.36 1xm6 h LEU 223 CO 0.01 0.07 0.54 -0.08 -0.34 0.00 0.00 178.44 178.64 1xm6 h GLU 224 N 0.13 0.95 0.00 1.25 4.81 -0.63 -0.81 114.58 120.28 1xm6 h GLU 224 Ca 0.05 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xm6 h GLU 224 Cb 0.02 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.18 1xm6 h GLU 224 CO -0.05 0.63 0.00 0.22 -0.73 0.00 0.00 179.01 179.08 1xm6 h ASP 225 N 0.98 0.00 0.45 1.04 -0.00 -0.71 -2.10 116.42 116.08 1xm6 h ASP 225 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.41 1xm6 h ASP 225 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.50 1xm6 h ASP 225 CO -0.17 0.00 -0.28 1.41 -0.00 0.00 0.00 179.24 180.20 1xm6 n HIS 226 N -2.43 0.00 -2.90 0.28 8.25 -0.32 -4.77 115.22 113.33 1xm6 n HIS 226 Ca 0.01 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.13 1xm6 n HIS 226 Cb 0.23 -0.22 -0.07 0.00 1.12 0.00 0.00 29.99 31.05 1xm6 n HIS 226 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1xm6 s TYR 227 N -2.73 3.45 -0.26 4.41 1.51 -0.79 -1.28 117.35 121.66 1xm6 s TYR 227 Ca 0.20 1.56 -0.18 0.00 -1.01 0.00 0.00 57.07 57.63 1xm6 s TYR 227 Cb 0.19 -2.79 -0.03 0.00 -0.11 0.00 0.00 41.96 39.23 1xm6 s TYR 227 CO 0.57 0.05 0.54 -1.01 -1.11 0.00 0.00 175.55 174.59 1xm6 s HIS 228 N -1.94 3.27 0.14 2.71 3.76 -1.26 -4.83 115.29 117.13 1xm6 s HIS 228 Ca 0.56 0.68 0.29 0.00 -0.15 0.00 0.00 55.06 56.43 1xm6 s HIS 228 Cb -0.12 -2.74 1.16 0.00 1.11 0.00 0.00 32.58 31.98 1xm6 s HIS 228 CO 0.17 -0.28 1.91 0.66 -0.85 0.00 0.00 174.74 176.35 1xm6 h SER 229 N 7.97 0.00 -0.27 1.40 4.64 -1.93 -2.85 113.55 122.50 1xm6 h SER 229 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1xm6 h SER 229 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1xm6 h SER 229 CO 0.73 0.12 0.00 -0.90 -0.87 0.00 0.00 176.83 175.90 1xm6 n ASP 230 N -3.28 1.67 -4.69 4.97 5.75 -1.26 -4.77 116.55 114.93 1xm6 n ASP 230 Ca 0.00 -1.89 -0.36 0.00 -0.01 0.00 0.00 54.79 52.53 1xm6 n ASP 230 Cb 0.36 -0.18 -0.08 0.00 -1.03 0.00 0.00 41.12 40.19 1xm6 n ASP 230 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1xm6 s VAL 231 N -1.65 5.33 0.19 2.12 1.01 -1.08 -5.00 120.40 121.32 1xm6 s VAL 231 Ca 0.25 0.37 -0.08 0.00 0.00 0.00 0.00 61.98 62.52 1xm6 s VAL 231 Cb 0.13 -3.57 0.03 0.00 0.00 0.00 0.00 36.38 32.98 1xm6 s VAL 231 CO 0.19 0.36 1.60 0.00 0.00 0.00 0.00 175.10 177.25 1xm6 h ALA 232 N 7.09 0.79 0.00 5.51 0.00 -1.86 -3.38 119.26 127.41 1xm6 h ALA 232 Ca -0.39 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.03 1xm6 h ALA 232 Cb 1.16 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1xm6 h ALA 232 CO 0.72 0.66 -1.19 0.98 0.00 0.00 0.00 179.25 180.41 1xm6 n TYR 233 N -4.13 0.00 -0.99 0.00 9.36 -1.26 -4.76 117.16 115.38 1xm6 n TYR 233 Ca 0.01 0.00 -0.17 0.00 3.32 0.00 0.00 57.90 61.06 1xm6 n TYR 233 Cb 0.42 -0.41 -0.13 0.00 -0.63 0.00 0.00 39.34 38.59 1xm6 n TYR 233 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1xm6 n HIS 234 N -3.87 0.54 -3.46 2.98 8.25 -1.26 -4.28 115.22 114.12 1xm6 n HIS 234 Ca -0.19 -1.76 -0.12 0.00 -0.26 0.00 0.00 57.72 55.40 1xm6 n HIS 234 Cb 0.50 -1.72 0.01 0.00 1.12 0.00 0.00 29.99 29.90 1xm6 n HIS 234 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1xm6 n ASN 235 N 2.82 1.58 0.30 0.41 0.23 -1.26 -4.49 115.26 114.85 1xm6 n ASN 235 Ca 0.48 -1.87 0.18 0.00 -0.53 0.00 0.00 54.58 52.84 1xm6 n ASN 235 Cb 0.70 -0.08 0.94 0.00 -2.08 0.00 0.00 39.78 39.26 1xm6 n ASN 235 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1xm6 h SER 236 N 0.23 0.00 -0.33 0.53 4.64 -1.86 -2.26 113.55 114.50 1xm6 h SER 236 Ca -0.16 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.06 1xm6 h SER 236 Cb 0.62 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 1xm6 h SER 236 CO 0.24 0.03 -0.15 0.25 -0.87 0.00 0.00 176.83 176.34 1xm6 h LEU 237 N 0.00 0.78 -0.51 5.97 5.85 -1.95 -0.72 115.31 124.73 1xm6 h LEU 237 Ca -0.00 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.39 1xm6 h LEU 237 Cb 0.21 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1xm6 h LEU 237 CO 0.00 0.94 -0.01 -0.74 -0.34 0.00 0.00 178.44 178.29 1xm6 h HIS 238 N 0.70 0.99 -0.51 1.25 2.76 -1.59 -1.83 115.15 116.93 1xm6 h HIS 238 Ca 0.11 -0.17 -0.02 0.00 -2.20 0.00 0.00 60.37 58.09 1xm6 h HIS 238 Cb 0.64 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 29.32 1xm6 h HIS 238 CO 0.03 0.92 0.24 0.00 -1.30 0.00 0.00 177.93 177.83 1xm6 h ALA 239 N 0.94 0.66 -0.82 5.26 0.00 -1.49 -0.73 119.26 123.08 1xm6 h ALA 239 Ca 0.14 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1xm6 h ALA 239 Cb 0.53 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1xm6 h ALA 239 CO 0.03 0.23 0.54 0.00 0.00 0.00 0.00 179.25 180.04 1xm6 h ALA 240 N 1.08 1.07 -0.22 0.00 0.00 -1.04 -0.19 119.26 119.95 1xm6 h ALA 240 Ca 0.17 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1xm6 h ALA 240 Cb 0.13 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1xm6 h ALA 240 CO -0.02 0.40 0.09 0.22 0.00 0.00 0.00 179.25 179.94 1xm6 h ASP 241 N 1.07 0.31 -0.64 0.00 3.58 -0.90 -0.91 116.42 118.93 1xm6 h ASP 241 Ca 0.32 -0.16 -0.07 0.00 0.42 0.00 0.00 57.03 57.53 1xm6 h ASP 241 Cb -0.06 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 40.89 1xm6 h ASP 241 CO -0.09 0.38 0.11 0.58 -2.88 0.00 0.00 179.24 177.35 1xm6 h VAL 242 N 0.21 1.26 -0.60 2.25 2.07 -0.82 0.06 116.25 120.68 1xm6 h VAL 242 Ca 0.07 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 1xm6 h VAL 242 Cb 0.17 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1xm6 h VAL 242 CO -0.01 0.38 0.26 0.00 0.02 0.00 0.00 177.57 178.22 1xm6 h ALA 243 N 1.04 0.78 -0.14 1.67 0.00 -0.92 -0.24 119.26 121.45 1xm6 h ALA 243 Ca 0.20 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 1xm6 h ALA 243 Cb 0.42 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1xm6 h ALA 243 CO 0.01 0.37 -0.66 0.37 0.00 0.00 0.00 179.25 179.34 1xm6 h GLN 244 N 0.83 0.56 -0.63 0.00 -0.00 -0.87 -1.03 115.11 113.97 1xm6 h GLN 244 Ca 0.20 -0.41 -0.09 0.00 -0.00 0.00 0.00 58.65 58.35 1xm6 h GLN 244 Cb 0.17 0.07 -0.02 0.00 0.00 0.00 0.00 27.48 27.69 1xm6 h GLN 244 CO -0.02 1.03 0.03 0.77 0.00 0.00 0.00 178.83 180.63 1xm6 h SER 245 N 0.40 1.06 -0.39 -0.69 0.02 -0.87 -1.54 113.55 111.54 1xm6 h SER 245 Ca -0.02 -0.30 -0.03 0.00 -0.84 0.00 0.00 61.79 60.61 1xm6 h SER 245 Cb 1.23 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.47 1xm6 h SER 245 CO 0.12 1.10 0.12 0.74 -1.14 0.00 0.00 176.83 177.77 1xm6 h THR 246 N 1.00 1.22 -0.89 -2.27 2.02 -0.86 -0.40 112.91 112.72 1xm6 h THR 246 Ca 0.18 -0.71 0.11 0.00 0.77 0.00 0.00 66.41 66.76 1xm6 h THR 246 Cb 0.54 0.94 -0.08 0.00 -1.74 0.00 0.00 68.15 67.80 1xm6 h THR 246 CO 0.03 0.25 0.53 -0.74 0.37 0.00 0.00 175.52 175.95 1xm6 h HIS 247 N 0.49 0.95 -0.29 3.16 -0.00 -0.98 -0.41 115.15 118.07 1xm6 h HIS 247 Ca 0.13 0.03 -0.17 0.00 -0.00 0.00 0.00 60.37 60.35 1xm6 h HIS 247 Cb 0.26 -0.29 -0.00 0.00 -0.00 0.00 0.00 27.41 27.38 1xm6 h HIS 247 CO 0.01 0.37 -0.51 0.28 -0.00 0.00 0.00 177.93 178.08 1xm6 h VAL 248 N 0.84 1.28 -0.12 5.26 2.07 -0.72 -3.25 116.25 121.62 1xm6 h VAL 248 Ca 0.44 -1.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.21 1xm6 h VAL 248 Cb 0.44 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1xm6 h VAL 248 CO -0.27 0.55 -0.20 -0.07 0.02 0.00 0.00 177.57 177.61 1xm6 h LEU 249 N 0.65 0.20 -2.06 2.57 3.38 -0.32 -2.37 115.31 117.35 1xm6 h LEU 249 Ca 0.03 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1xm6 h LEU 249 Cb 1.10 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1xm6 h LEU 249 CO 0.11 0.41 -0.03 -0.07 0.09 0.00 0.00 178.44 178.96 1xm6 h LEU 250 N 0.19 0.00 -2.57 1.67 3.38 -1.13 -2.62 115.31 114.23 1xm6 h LEU 250 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xm6 h LEU 250 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1xm6 h LEU 250 CO 0.03 0.03 0.00 -1.20 0.09 0.00 0.00 178.44 177.39 1xm6 n SER 251 N -3.19 3.77 -4.75 -0.43 7.64 -0.89 -4.80 113.62 110.97 1xm6 n SER 251 Ca -0.01 -2.00 -0.41 0.00 1.01 0.00 0.00 58.87 57.46 1xm6 n SER 251 Cb 0.22 -0.39 -0.02 0.00 -1.01 0.00 0.00 64.21 63.01 1xm6 n SER 251 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1xm6 s THR 252 N -1.22 2.08 0.39 0.44 -4.23 -0.99 -4.87 115.64 107.24 1xm6 s THR 252 Ca 0.45 0.07 0.16 0.00 -1.18 0.00 0.00 61.69 61.19 1xm6 s THR 252 Cb 0.25 -3.04 0.37 0.00 1.34 0.00 0.00 72.50 71.42 1xm6 s THR 252 CO 0.33 0.01 1.80 -0.65 -0.54 0.00 0.00 174.62 175.57 1xm6 h PRO 253 N 4.78 0.45 0.00 3.99 0.11 -1.93 -1.18 132.00 138.21 1xm6 h PRO 253 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1xm6 h PRO 253 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1xm6 h PRO 253 CO 0.79 0.29 0.00 0.00 -0.21 0.00 0.00 178.00 178.87 1xm6 h ALA 254 N 1.62 1.00 -0.37 -0.75 0.00 -1.83 -2.38 119.26 116.55 1xm6 h ALA 254 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1xm6 h ALA 254 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1xm6 h ALA 254 CO -0.27 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.26 1xm6 n LEU 255 N -2.65 3.19 -4.67 0.00 4.77 -0.45 -1.35 117.00 115.85 1xm6 n LEU 255 Ca -0.01 -2.15 -0.48 0.00 -0.03 0.00 0.00 56.01 53.33 1xm6 n LEU 255 Cb 0.12 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 40.86 1xm6 n LEU 255 CO 0.17 0.74 1.29 -0.67 -1.33 0.00 0.00 177.39 177.59 1xm6 n ASP 256 N 0.47 3.02 -0.10 -1.43 2.03 -0.90 -1.86 116.55 117.78 1xm6 n ASP 256 Ca 0.14 1.04 -0.01 0.00 0.52 0.00 0.00 54.79 56.48 1xm6 n ASP 256 Cb 0.52 -1.36 -0.01 0.00 -0.72 0.00 0.00 41.12 39.56 1xm6 n ASP 256 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xm6 n ALA 257 N 4.70 -0.02 0.09 -1.67 0.00 -1.26 -4.86 120.51 117.49 1xm6 n ALA 257 Ca 0.20 0.02 -0.13 0.00 0.00 0.00 0.00 53.44 53.53 1xm6 n ALA 257 Cb 0.27 -1.06 -0.11 0.00 0.00 0.00 0.00 19.45 18.55 1xm6 n ALA 257 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xm6 h VAL 258 N 0.00 1.53 -3.19 0.00 2.07 -1.73 -3.46 116.25 111.47 1xm6 h VAL 258 Ca -0.03 -3.01 -0.66 0.00 0.82 0.00 0.00 66.70 63.83 1xm6 h VAL 258 Cb 0.69 2.81 -0.11 0.00 -1.52 0.00 0.00 31.29 33.16 1xm6 h VAL 258 CO 0.04 0.88 -0.60 -0.36 0.02 0.00 0.00 177.57 177.54 1xm6 s PHE 259 N -2.81 3.20 0.80 1.57 0.08 -1.26 -5.02 117.98 114.55 1xm6 s PHE 259 Ca -0.03 0.15 -0.12 0.00 0.12 0.00 0.00 56.93 57.05 1xm6 s PHE 259 Cb 0.08 -1.70 0.07 0.00 -0.57 0.00 0.00 43.02 40.91 1xm6 s PHE 259 CO 0.86 0.52 1.12 0.95 -0.10 0.00 0.00 175.22 178.57 1xm6 s THR 260 N -1.19 2.82 0.31 0.64 -4.23 -1.26 -4.88 115.64 107.85 1xm6 s THR 260 Ca 0.23 0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 60.99 1xm6 s THR 260 Cb -0.12 -3.11 0.26 0.00 1.34 0.00 0.00 72.50 70.88 1xm6 s THR 260 CO 0.14 -0.35 1.98 0.44 -0.54 0.00 0.00 174.62 176.29 1xm6 h ASP 261 N -1.06 0.90 -0.69 3.99 3.32 -1.99 -1.77 116.42 119.13 1xm6 h ASP 261 Ca -0.47 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 1xm6 h ASP 261 Cb 1.29 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 1xm6 h ASP 261 CO 0.62 0.65 0.25 0.25 -1.72 0.00 0.00 179.24 179.29 1xm6 h LEU 262 N 1.07 0.99 -0.59 1.55 5.85 -1.99 -0.11 115.31 122.09 1xm6 h LEU 262 Ca 0.29 -0.16 -0.14 0.00 0.84 0.00 0.00 57.88 58.71 1xm6 h LEU 262 Cb -0.12 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.64 1xm6 h LEU 262 CO -0.06 0.91 -0.34 -0.33 -0.34 0.00 0.00 178.44 178.27 1xm6 h GLU 263 N 1.04 0.75 -0.44 1.25 5.08 -1.79 -0.33 114.58 120.14 1xm6 h GLU 263 Ca 0.23 -0.36 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 1xm6 h GLU 263 Cb 0.25 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1xm6 h GLU 263 CO -0.01 0.98 0.01 0.82 -1.00 0.00 0.00 179.01 179.81 1xm6 h ILE 264 N 0.63 1.26 -0.51 3.13 2.04 -1.04 -1.80 117.51 121.22 1xm6 h ILE 264 Ca 0.06 -1.01 -0.03 0.00 1.00 0.00 0.00 64.86 64.89 1xm6 h ILE 264 Cb 0.88 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 1xm6 h ILE 264 CO 0.08 0.35 0.21 0.25 0.00 0.00 0.00 178.15 179.03 1xm6 h LEU 265 N 0.61 0.70 -0.51 1.44 5.85 -0.84 -2.60 115.31 119.96 1xm6 h LEU 265 Ca 0.13 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1xm6 h LEU 265 Cb 0.47 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1xm6 h LEU 265 CO 0.02 0.67 0.27 0.00 -0.34 0.00 0.00 178.44 179.06 1xm6 h ALA 266 N 1.05 0.66 -0.39 1.25 0.00 -0.92 -1.61 119.26 119.30 1xm6 h ALA 266 Ca 0.17 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1xm6 h ALA 266 Cb 0.19 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1xm6 h ALA 266 CO -0.01 0.20 0.09 0.00 0.00 0.00 0.00 179.25 179.52 1xm6 h ALA 267 N 1.10 0.52 -0.40 0.00 0.00 -1.16 0.30 119.26 119.61 1xm6 h ALA 267 Ca 0.18 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1xm6 h ALA 267 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1xm6 h ALA 267 CO -0.03 0.20 -0.30 0.82 0.00 0.00 0.00 179.25 179.94 1xm6 h ILE 268 N 0.49 1.27 -0.19 0.00 2.04 -1.43 -1.37 117.51 118.32 1xm6 h ILE 268 Ca 0.12 -1.47 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 1xm6 h ILE 268 Cb 0.32 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1xm6 h ILE 268 CO 0.00 0.49 0.10 0.15 0.00 0.00 0.00 178.15 178.89 1xm6 h PHE 269 N 0.74 0.27 -0.54 1.37 3.57 -1.23 -1.30 116.94 119.81 1xm6 h PHE 269 Ca 0.08 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.65 1xm6 h PHE 269 Cb 0.89 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.47 1xm6 h PHE 269 CO 0.06 0.26 0.16 0.00 -2.23 0.00 0.00 178.31 176.57 1xm6 h ALA 270 N 0.98 0.66 -0.45 2.41 0.00 -0.80 -1.60 119.26 120.46 1xm6 h ALA 270 Ca 0.07 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.11 1xm6 h ALA 270 Cb 0.09 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1xm6 h ALA 270 CO -0.01 -0.25 0.21 0.00 0.00 0.00 0.00 179.25 179.20 1xm6 h ALA 271 N 1.39 0.56 -0.73 0.00 0.00 -0.93 -0.22 119.26 119.32 1xm6 h ALA 271 Ca 0.27 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.22 1xm6 h ALA 271 Cb 0.34 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1xm6 h ALA 271 CO -0.31 -0.15 0.48 0.00 0.00 0.00 0.00 179.25 179.27 1xm6 h ALA 272 N 1.25 0.93 -0.01 0.00 0.00 -0.33 -3.08 119.26 118.02 1xm6 h ALA 272 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1xm6 h ALA 272 Cb 0.12 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xm6 h ALA 272 CO -0.15 0.33 -0.32 0.44 0.00 0.00 0.00 179.25 179.55 1xm6 n ILE 273 N -4.58 0.00 0.32 0.00 -5.35 -0.75 -4.64 119.36 104.36 1xm6 n ILE 273 Ca 0.07 -0.15 0.21 0.00 -0.27 0.00 0.00 62.75 62.61 1xm6 n ILE 273 Cb 0.02 0.58 1.10 0.00 -1.74 0.00 0.00 39.64 39.61 1xm6 n ILE 273 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 1xm6 h HIS 274 N 1.42 0.00 0.00 4.28 2.07 -0.94 -1.99 115.15 119.99 1xm6 h HIS 274 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 1xm6 h HIS 274 Cb 0.56 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.53 1xm6 h HIS 274 CO 0.00 0.00 -0.20 -0.25 -3.07 0.00 0.00 177.93 174.41 1xm6 n ASP 275 N -3.11 1.67 -4.77 3.10 8.00 -1.26 -4.85 116.55 115.32 1xm6 n ASP 275 Ca -0.02 -2.85 -0.41 0.00 0.71 0.00 0.00 54.79 52.21 1xm6 n ASP 275 Cb 0.12 -0.38 -0.01 0.00 -0.02 0.00 0.00 41.12 40.84 1xm6 n ASP 275 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1xm6 s VAL 276 N -2.10 2.17 -1.59 2.53 0.11 -0.75 -1.91 120.40 118.85 1xm6 s VAL 276 Ca 0.25 0.16 -0.00 0.00 -2.93 0.00 0.00 61.98 59.46 1xm6 s VAL 276 Cb 0.22 -3.10 0.00 0.00 -1.53 0.00 0.00 36.38 31.97 1xm6 s VAL 276 CO 0.01 0.04 0.02 -0.67 -3.33 0.00 0.00 175.10 171.17 1xm6 n ASP 277 N 0.90 -5.42 -4.71 3.54 2.03 -0.41 -4.38 116.55 108.10 1xm6 n ASP 277 Ca 0.02 -0.03 -0.42 0.00 0.52 0.00 0.00 54.79 54.89 1xm6 n ASP 277 Cb 0.39 -4.47 -0.03 0.00 -0.72 0.00 0.00 41.12 36.30 1xm6 n ASP 277 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1xm6 s HIS 278 N -2.94 3.23 -2.31 -0.67 5.65 -0.80 -4.93 115.29 112.52 1xm6 s HIS 278 Ca 0.01 0.99 0.28 0.00 0.25 0.00 0.00 55.06 56.59 1xm6 s HIS 278 Cb -0.00 -3.64 1.25 0.00 -1.18 0.00 0.00 32.58 29.00 1xm6 s HIS 278 CO 0.01 -2.21 1.85 -0.35 -0.65 0.00 0.00 174.74 173.39 1xm6 n PRO 279 N 4.09 1.46 -0.83 2.88 -0.04 -1.26 -4.54 135.00 136.76 1xm6 n PRO 279 Ca 0.11 -0.67 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 1xm6 n PRO 279 Cb 0.43 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 1xm6 n PRO 279 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xm6 n GLY 280 N 1.10 0.54 3.17 0.55 0.00 -1.26 -4.99 105.19 104.31 1xm6 n GLY 280 Ca 0.20 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.65 1xm6 n GLY 280 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xm6 s VAL 281 N -2.00 0.93 0.77 1.61 -7.23 -1.26 -4.68 120.40 108.53 1xm6 s VAL 281 Ca 0.00 -1.63 -0.12 0.00 -1.81 0.00 0.00 61.98 58.42 1xm6 s VAL 281 Cb 0.00 -1.35 0.05 0.00 0.56 0.00 0.00 36.38 35.64 1xm6 s VAL 281 CO 0.00 -0.56 1.12 -0.94 -0.31 0.00 0.00 175.10 174.41 1xm6 s SER 282 N -2.44 4.84 0.22 4.85 1.04 -1.26 -4.89 113.70 116.06 1xm6 s SER 282 Ca 0.05 1.06 -0.08 0.00 0.48 0.00 0.00 55.95 57.46 1xm6 s SER 282 Cb -0.03 -1.75 0.30 0.00 0.10 0.00 0.00 66.02 64.64 1xm6 s SER 282 CO -0.00 -1.72 1.76 0.78 0.98 0.00 0.00 173.24 175.03 1xm6 h ASN 283 N -0.92 0.31 -0.05 7.02 2.35 -1.96 -1.68 115.58 120.65 1xm6 h ASN 283 Ca -0.46 0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.29 1xm6 h ASN 283 Cb 1.28 0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.67 1xm6 h ASN 283 CO 0.63 0.18 -0.16 -0.61 -1.65 0.00 0.00 177.43 175.81 1xm6 h GLN 284 N 0.47 0.40 -0.40 0.81 5.75 -1.94 -0.79 115.11 119.42 1xm6 h GLN 284 Ca 0.33 -0.12 -0.05 0.00 -0.15 0.00 0.00 58.65 58.66 1xm6 h GLN 284 Cb 0.39 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 1xm6 h GLN 284 CO -0.30 0.56 0.04 0.35 -2.65 0.00 0.00 178.83 176.84 1xm6 h PHE 285 N 0.37 0.73 -0.59 3.99 3.04 -1.77 -0.19 116.94 122.51 1xm6 h PHE 285 Ca 0.07 -0.11 -0.02 0.00 3.98 0.00 0.00 57.97 61.89 1xm6 h PHE 285 Cb 0.51 -0.20 -0.03 0.00 2.56 0.00 0.00 35.95 38.79 1xm6 h PHE 285 CO 0.01 0.72 0.29 -0.07 -2.02 0.00 0.00 178.31 177.25 1xm6 h LEU 286 N 0.52 0.75 -0.07 0.59 3.38 -0.74 -1.48 115.31 118.26 1xm6 h LEU 286 Ca 0.12 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1xm6 h LEU 286 Cb 0.41 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1xm6 h LEU 286 CO 0.01 0.63 -0.10 0.40 0.09 0.00 0.00 178.44 179.48 1xm6 h ILE 287 N 0.83 1.40 0.00 1.22 2.04 -0.97 -1.71 117.51 120.32 1xm6 h ILE 287 Ca 0.21 -1.34 -0.05 0.00 1.00 0.00 0.00 64.86 64.67 1xm6 h ILE 287 Cb 0.08 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1xm6 h ILE 287 CO -0.03 0.37 -0.25 0.78 0.00 0.00 0.00 178.15 179.02 1xm6 h ASN 288 N -0.29 0.00 -0.56 1.72 2.35 -0.89 -2.44 115.58 115.47 1xm6 h ASN 288 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1xm6 h ASN 288 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1xm6 h ASN 288 CO 0.02 0.25 0.00 0.35 -1.65 0.00 0.00 177.43 176.41 1xm6 n THR 289 N -3.94 0.78 -3.90 2.81 -2.24 -0.57 -4.96 114.28 102.27 1xm6 n THR 289 Ca -0.02 -0.76 -0.27 0.00 -2.27 0.00 0.00 64.05 60.73 1xm6 n THR 289 Cb 0.33 0.36 0.01 0.00 -2.10 0.00 0.00 70.33 68.94 1xm6 n THR 289 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1xm6 n ASN 290 N 1.14 -2.41 -4.74 3.42 3.02 -0.92 -4.93 115.26 109.84 1xm6 n ASN 290 Ca 0.19 -0.88 -0.31 0.00 -0.03 0.00 0.00 54.58 53.55 1xm6 n ASN 290 Cb 0.49 -3.60 0.11 0.00 -0.61 0.00 0.00 39.78 36.17 1xm6 n ASN 290 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1xm6 s SER 291 N -3.89 4.07 0.31 6.41 1.04 -0.65 -4.85 113.70 116.14 1xm6 s SER 291 Ca 0.31 1.89 -0.00 0.00 0.48 0.00 0.00 55.95 58.63 1xm6 s SER 291 Cb -0.16 -2.52 0.50 0.00 0.10 0.00 0.00 66.02 63.94 1xm6 s SER 291 CO 0.85 -2.32 1.95 -0.33 0.98 0.00 0.00 173.24 174.37 1xm6 h GLU 292 N -1.33 0.95 -0.54 4.02 4.39 -1.91 -2.07 114.58 118.09 1xm6 h GLU 292 Ca -0.44 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.13 1xm6 h GLU 292 Cb 1.24 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.67 1xm6 h GLU 292 CO 0.49 0.67 0.14 -0.07 -1.16 0.00 0.00 179.01 179.08 1xm6 h LEU 293 N 0.97 0.81 -1.09 1.33 3.38 -1.92 -0.69 115.31 118.09 1xm6 h LEU 293 Ca 0.25 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1xm6 h LEU 293 Cb -0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1xm6 h LEU 293 CO -0.05 0.82 -0.32 0.00 0.09 0.00 0.00 178.44 178.98 1xm6 h ALA 294 N 1.02 1.24 -0.22 1.53 0.00 -1.69 -1.50 119.26 119.64 1xm6 h ALA 294 Ca 0.17 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1xm6 h ALA 294 Cb 0.32 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1xm6 h ALA 294 CO -0.00 0.51 -0.53 -0.07 0.00 0.00 0.00 179.25 179.16 1xm6 h LEU 295 N 0.20 0.72 -0.57 0.00 3.38 -1.03 -0.92 115.31 117.09 1xm6 h LEU 295 Ca 0.03 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.54 1xm6 h LEU 295 Cb 0.67 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1xm6 h LEU 295 CO 0.05 1.11 0.05 -0.03 0.09 0.00 0.00 178.44 179.72 1xm6 h MET 296 N 0.51 0.96 -0.59 1.13 4.05 -0.73 -3.28 114.93 116.98 1xm6 h MET 296 Ca 0.01 -0.28 0.00 0.00 -0.28 0.00 0.00 59.70 59.15 1xm6 h MET 296 Cb 1.09 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.79 1xm6 h MET 296 CO 0.11 0.94 0.00 0.66 0.23 0.00 0.00 176.91 178.85 1xm6 n TYR 297 N -4.29 1.12 -3.96 1.39 4.01 -0.60 -4.98 117.16 109.85 1xm6 n TYR 297 Ca 0.02 -0.58 -0.29 0.00 -0.16 0.00 0.00 57.90 56.89 1xm6 n TYR 297 Cb 0.30 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 1xm6 n TYR 297 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1xm6 n ASN 298 N 1.03 -2.83 0.00 7.72 3.02 -0.39 -2.38 115.26 121.44 1xm6 n ASN 298 Ca 0.23 -0.89 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 1xm6 n ASN 298 Cb 0.73 -3.47 0.00 0.00 -0.61 0.00 0.00 39.78 36.43 1xm6 n ASN 298 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xm6 n ASP 299 N -2.87 -2.16 -4.45 6.41 8.00 -0.99 -4.95 116.55 115.54 1xm6 n ASP 299 Ca -0.09 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.04 1xm6 n ASP 299 Cb 0.58 -2.54 -0.12 0.00 -0.02 0.00 0.00 41.12 39.02 1xm6 n ASP 299 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1xm6 s GLU 300 N -1.21 3.60 -1.35 -1.24 2.56 -1.00 -4.54 118.70 115.52 1xm6 s GLU 300 Ca 0.00 -0.52 -0.19 0.00 0.00 0.00 0.00 54.97 54.26 1xm6 s GLU 300 Cb 0.00 -3.38 0.03 0.00 2.00 0.00 0.00 34.13 32.78 1xm6 s GLU 300 CO 0.00 -0.23 0.37 0.43 -0.56 0.00 0.00 175.26 175.27 1xm6 n SER 301 N 4.94 -1.77 0.19 -1.70 7.64 -1.26 -4.80 113.62 116.85 1xm6 n SER 301 Ca -0.16 -1.28 -0.15 0.00 1.01 0.00 0.00 58.87 58.29 1xm6 n SER 301 Cb 0.51 -1.56 -0.08 0.00 -1.01 0.00 0.00 64.21 62.07 1xm6 n SER 301 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1xm6 h VAL 302 N -2.22 0.17 -0.43 0.44 2.07 -1.88 -1.07 116.25 113.33 1xm6 h VAL 302 Ca -0.68 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1xm6 h VAL 302 Cb 1.39 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1xm6 h VAL 302 CO 0.60 0.00 0.24 -0.07 0.02 0.00 0.00 177.57 178.36 1xm6 h LEU 303 N -0.75 0.54 -0.63 2.57 3.38 -1.94 -2.32 115.31 116.16 1xm6 h LEU 303 Ca -0.01 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1xm6 h LEU 303 Cb 0.71 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1xm6 h LEU 303 CO -0.14 0.47 0.06 -0.33 0.09 0.00 0.00 178.44 178.58 1xm6 h GLU 304 N 0.56 1.07 -0.71 1.13 3.07 -1.88 0.21 114.58 118.04 1xm6 h GLU 304 Ca 0.15 -0.31 -0.02 0.00 -0.50 0.00 0.00 59.36 58.68 1xm6 h GLU 304 Cb 0.05 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 27.81 1xm6 h GLU 304 CO -0.03 1.01 0.36 -0.91 -1.40 0.00 0.00 179.01 178.04 1xm6 h ASN 305 N 0.98 0.92 -0.74 1.42 2.35 -1.14 -2.37 115.58 116.99 1xm6 h ASN 305 Ca 0.19 -0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1xm6 h ASN 305 Cb 0.49 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.59 1xm6 h ASN 305 CO 0.02 0.78 0.29 -0.74 -1.65 0.00 0.00 177.43 176.13 1xm6 h HIS 306 N 0.99 1.13 -0.54 1.19 2.76 -0.70 -1.17 115.15 118.82 1xm6 h HIS 306 Ca 0.25 -0.09 -0.03 0.00 -2.20 0.00 0.00 60.37 58.29 1xm6 h HIS 306 Cb 0.09 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 28.69 1xm6 h HIS 306 CO 0.00 0.87 0.21 0.45 -1.30 0.00 0.00 177.93 178.16 1xm6 h HIS 307 N 1.06 0.83 -0.35 5.26 3.86 -0.40 -1.43 115.15 123.98 1xm6 h HIS 307 Ca 0.24 -0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.37 1xm6 h HIS 307 Cb 0.22 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 1xm6 h HIS 307 CO 0.02 0.68 0.15 -0.07 0.86 0.00 0.00 177.93 179.58 1xm6 h LEU 308 N 0.73 0.48 -0.66 2.43 3.38 -1.32 -1.39 115.31 118.97 1xm6 h LEU 308 Ca 0.18 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xm6 h LEU 308 Cb 0.21 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1xm6 h LEU 308 CO -0.01 0.49 0.41 0.00 0.09 0.00 0.00 178.44 179.42 1xm6 h ALA 309 N 1.00 0.84 0.19 1.53 0.00 -0.92 -0.78 119.26 121.12 1xm6 h ALA 309 Ca 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xm6 h ALA 309 Cb 0.16 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1xm6 h ALA 309 CO -0.01 0.30 -0.09 0.28 0.00 0.00 0.00 179.25 179.73 1xm6 h VAL 310 N 0.90 0.89 -0.79 0.00 2.07 -1.18 0.09 116.25 118.23 1xm6 h VAL 310 Ca 0.24 -0.40 0.09 0.00 0.82 0.00 0.00 66.70 67.45 1xm6 h VAL 310 Cb -0.05 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1xm6 h VAL 310 CO -0.05 0.09 0.44 1.23 0.02 0.00 0.00 177.57 179.30 1xm6 h GLY 311 N -0.45 1.21 1.93 2.17 0.00 -1.03 -1.22 103.07 105.68 1xm6 h GLY 311 Ca -0.03 -0.29 -0.22 0.00 0.00 0.00 0.00 47.33 46.79 1xm6 h GLY 311 CO 0.04 0.12 -1.05 0.74 0.00 0.00 0.00 176.54 176.40 1xm6 h PHE 312 N 0.75 0.08 -0.68 5.60 0.04 -1.12 -3.20 116.94 118.41 1xm6 h PHE 312 Ca 0.38 -0.06 -0.07 0.00 2.80 0.00 0.00 57.97 61.03 1xm6 h PHE 312 Cb 0.34 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.46 1xm6 h PHE 312 CO -0.07 1.04 0.16 0.87 -0.60 0.00 0.00 178.31 179.71 1xm6 h LYS 313 N 0.01 1.08 0.00 1.51 1.57 -0.48 -2.30 116.57 117.97 1xm6 h LYS 313 Ca -0.03 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 1xm6 h LYS 313 Cb 1.80 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.97 1xm6 h LYS 313 CO 0.14 0.97 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.87 1xm6 h LEU 314 N 1.01 0.00 -1.14 2.94 3.38 -1.24 -1.89 115.31 118.37 1xm6 h LEU 314 Ca 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1xm6 h LEU 314 Cb 0.37 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1xm6 h LEU 314 CO 0.00 0.05 -0.03 -0.07 0.09 0.00 0.00 178.44 178.48 1xm6 h LEU 315 N 0.00 0.00 -8.77 1.67 3.38 -1.42 -3.42 115.31 106.76 1xm6 h LEU 315 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1xm6 h LEU 315 Cb 0.11 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.79 1xm6 h LEU 315 CO 0.01 0.03 0.88 -1.10 0.09 0.00 0.00 178.44 178.35 1xm6 s GLN 316 N -3.58 3.79 0.00 1.13 -1.52 -0.71 -3.78 119.66 114.98 1xm6 s GLN 316 Ca 0.02 0.65 0.00 0.00 -1.95 0.00 0.00 55.36 54.08 1xm6 s GLN 316 Cb 0.08 -3.87 0.00 0.00 -0.22 0.00 0.00 33.01 29.00 1xm6 s GLN 316 CO 0.58 -1.26 0.00 -1.91 -0.25 0.00 0.00 175.29 172.45 1xm6 n GLU 317 N 7.58 0.00 -0.35 2.91 4.07 -1.26 -4.98 120.64 128.61 1xm6 n GLU 317 Ca 0.12 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.35 1xm6 n GLU 317 Cb 0.49 0.00 0.32 0.00 -0.06 0.00 0.00 31.44 32.19 1xm6 n GLU 317 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1xm6 h GLU 318 N 0.00 0.72 -1.03 5.31 5.08 -1.96 -1.20 114.58 121.51 1xm6 h GLU 318 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1xm6 h GLU 318 Cb 0.00 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1xm6 h GLU 318 CO 0.00 0.48 0.00 1.58 -1.00 0.00 0.00 179.01 180.07 1xm6 n HIS 319 N -4.78 0.00 -2.96 4.33 -0.00 -1.26 -4.85 115.22 105.70 1xm6 n HIS 319 Ca 0.24 -0.07 -0.05 0.00 0.46 0.00 0.00 57.72 58.30 1xm6 n HIS 319 Cb 0.59 -0.08 0.01 0.00 -0.12 0.00 0.00 29.99 30.38 1xm6 n HIS 319 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1xm6 n ASP 321 N 0.63 -7.33 0.24 0.26 2.03 -0.46 -4.61 116.55 107.30 1xm6 n ASP 321 Ca 0.00 0.84 0.16 0.00 0.52 0.00 0.00 54.79 56.31 1xm6 n ASP 321 Cb 0.10 -3.83 0.72 0.00 -0.72 0.00 0.00 41.12 37.40 1xm6 n ASP 321 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 1xm6 h ILE 322 N 2.99 0.00 -0.65 5.18 3.07 -1.87 -2.71 117.51 123.52 1xm6 h ILE 322 Ca -0.06 -0.29 0.00 0.00 1.55 0.00 0.00 64.86 66.06 1xm6 h ILE 322 Cb 0.59 1.16 0.00 0.00 -0.27 0.00 0.00 36.82 38.30 1xm6 h ILE 322 CO 0.10 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.69 1xm6 n PHE 323 N -2.77 1.43 -0.24 0.16 3.72 -1.26 -4.58 117.46 113.91 1xm6 n PHE 323 Ca 0.00 -0.58 0.17 0.00 -0.05 0.00 0.00 57.45 57.00 1xm6 n PHE 323 Cb 0.21 -0.22 0.49 0.00 -0.94 0.00 0.00 39.48 39.02 1xm6 n PHE 323 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 1xm6 h MET 324 N 4.05 0.44 -0.64 -1.08 4.05 -1.84 -2.28 114.93 117.63 1xm6 h MET 324 Ca 0.00 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1xm6 h MET 324 Cb 1.39 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 32.09 1xm6 h MET 324 CO 0.21 0.29 0.00 0.09 0.23 0.00 0.00 176.91 177.73 1xm6 n ASN 325 N -4.52 3.83 -4.87 1.39 3.02 -1.26 -4.91 115.26 107.94 1xm6 n ASN 325 Ca 0.18 -2.00 -0.31 0.00 -0.03 0.00 0.00 54.58 52.42 1xm6 n ASN 325 Cb 0.63 -0.43 0.01 0.00 -0.61 0.00 0.00 39.78 39.39 1xm6 n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1xm6 s LEU 326 N -1.14 3.25 0.80 3.41 1.43 -0.86 -4.87 118.68 120.70 1xm6 s LEU 326 Ca 0.47 1.42 -0.12 0.00 -1.03 0.00 0.00 54.13 54.87 1xm6 s LEU 326 Cb 0.25 -4.46 0.07 0.00 0.03 0.00 0.00 46.19 42.08 1xm6 s LEU 326 CO 0.33 -0.86 1.10 -0.89 0.23 0.00 0.00 176.35 176.27 1xm6 s THR 327 N -3.15 2.98 0.17 5.49 2.01 -1.26 -4.82 115.64 117.05 1xm6 s THR 327 Ca 0.55 0.32 -0.14 0.00 0.31 0.00 0.00 61.69 62.72 1xm6 s THR 327 Cb -0.11 -3.07 0.05 0.00 0.01 0.00 0.00 72.50 69.38 1xm6 s THR 327 CO 0.53 -0.42 1.82 0.11 -0.69 0.00 0.00 174.62 175.97 1xm6 h LYS 328 N -1.11 0.59 -0.93 4.92 1.57 -1.97 -1.34 116.57 118.31 1xm6 h LYS 328 Ca -0.47 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1xm6 h LYS 328 Cb 1.27 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 33.40 1xm6 h LYS 328 CO 0.60 0.39 0.59 -0.22 -0.57 0.00 0.00 179.45 180.24 1xm6 h LYS 329 N 0.61 1.24 -0.08 3.15 1.63 -1.99 -2.21 116.57 118.91 1xm6 h LYS 329 Ca 0.19 -0.09 -0.00 0.00 -0.85 0.00 0.00 60.65 59.89 1xm6 h LYS 329 Cb -0.03 -0.27 -0.00 0.00 -0.60 0.00 0.00 32.23 31.33 1xm6 h LYS 329 CO -0.07 0.84 0.04 1.96 -3.45 0.00 0.00 179.45 178.78 1xm6 h GLN 330 N 1.27 0.12 -0.96 1.90 4.20 -1.72 -1.07 115.11 118.84 1xm6 h GLN 330 Ca 0.34 -0.01 0.05 0.00 0.06 0.00 0.00 58.65 59.08 1xm6 h GLN 330 Cb -0.11 -0.02 -0.06 0.00 0.30 0.00 0.00 27.48 27.59 1xm6 h GLN 330 CO -0.07 0.16 0.63 0.00 -0.67 0.00 0.00 178.83 178.88 1xm6 h ARG 331 N 0.04 1.14 -0.31 1.46 3.08 -1.02 0.24 114.38 119.01 1xm6 h ARG 331 Ca 0.03 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 59.93 1xm6 h ARG 331 Cb 0.08 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 1xm6 h ARG 331 CO -0.00 0.75 -0.11 0.37 -1.07 0.00 0.00 179.97 179.91 1xm6 h GLN 332 N 1.17 0.63 -0.33 0.04 4.15 -1.23 -1.09 115.11 118.45 1xm6 h GLN 332 Ca 0.40 -0.26 -0.06 0.00 0.77 0.00 0.00 58.65 59.50 1xm6 h GLN 332 Cb 0.08 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 1xm6 h GLN 332 CO -0.14 0.83 -0.03 1.15 -1.93 0.00 0.00 178.83 178.71 1xm6 h THR 333 N 0.39 1.27 -0.16 2.39 2.02 -0.84 -1.77 112.91 116.21 1xm6 h THR 333 Ca 0.08 -1.02 0.02 0.00 0.77 0.00 0.00 66.41 66.25 1xm6 h THR 333 Cb 0.62 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 1xm6 h THR 333 CO 0.04 0.33 0.05 0.25 0.37 0.00 0.00 175.52 176.56 1xm6 h LEU 334 N 0.40 0.05 -0.70 2.58 6.46 -0.93 -0.93 115.31 122.24 1xm6 h LEU 334 Ca 0.09 0.02 0.01 0.00 -0.12 0.00 0.00 57.88 57.88 1xm6 h LEU 334 Cb 0.49 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.40 1xm6 h LEU 334 CO 0.02 0.05 0.46 -0.09 -0.62 0.00 0.00 178.44 178.27 1xm6 h ARG 335 N 0.13 0.91 -0.33 1.25 2.43 -1.13 0.14 114.38 117.78 1xm6 h ARG 335 Ca 0.07 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1xm6 h ARG 335 Cb 0.04 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.37 1xm6 h ARG 335 CO -0.07 0.60 0.21 -0.22 -1.51 0.00 0.00 179.97 178.98 1xm6 h LYS 336 N 0.93 0.42 -0.35 0.20 3.64 -1.05 -1.62 116.57 118.75 1xm6 h LYS 336 Ca 0.26 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1xm6 h LYS 336 Cb -0.08 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1xm6 h LYS 336 CO -0.07 0.27 0.08 0.52 -2.27 0.00 0.00 179.45 177.99 1xm6 h MET 337 N 0.43 0.56 -0.36 1.90 2.86 -0.52 -2.48 114.93 117.32 1xm6 h MET 337 Ca 0.12 -0.14 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 1xm6 h MET 337 Cb -0.04 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 1xm6 h MET 337 CO -0.04 0.62 0.04 0.28 1.06 0.00 0.00 176.91 178.88 1xm6 h VAL 338 N 0.41 1.24 -0.39 -2.22 2.07 -0.60 -1.30 116.25 115.47 1xm6 h VAL 338 Ca 0.11 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.79 1xm6 h VAL 338 Cb 0.31 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 1xm6 h VAL 338 CO 0.00 0.30 0.17 0.40 0.02 0.00 0.00 177.57 178.45 1xm6 h ILE 339 N 0.44 0.93 -0.26 4.57 2.04 -1.32 -0.90 117.51 123.00 1xm6 h ILE 339 Ca 0.11 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.90 1xm6 h ILE 339 Cb 0.39 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.97 1xm6 h ILE 339 CO 0.01 0.06 -0.02 -0.78 0.00 0.00 0.00 178.15 177.42 1xm6 h ASP 340 N 0.35 -0.15 -0.44 1.72 1.82 -1.12 -1.64 116.42 116.95 1xm6 h ASP 340 Ca 0.17 0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 56.81 1xm6 h ASP 340 Cb 0.12 0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.24 1xm6 h ASP 340 CO -0.15 -0.04 -0.01 0.24 -1.61 0.00 0.00 179.24 177.66 1xm6 h MET 341 N 0.05 0.78 -0.35 0.28 2.86 -0.81 -2.04 114.93 115.70 1xm6 h MET 341 Ca 0.12 -0.26 -0.17 0.00 -2.06 0.00 0.00 59.70 57.34 1xm6 h MET 341 Cb 0.17 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 1xm6 h MET 341 CO -0.23 0.86 -0.43 0.28 1.06 0.00 0.00 176.91 178.44 1xm6 h VAL 342 N 0.62 1.27 -0.07 -2.22 2.07 -1.08 -2.68 116.25 114.16 1xm6 h VAL 342 Ca 0.12 -1.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.00 1xm6 h VAL 342 Cb 0.51 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 1xm6 h VAL 342 CO 0.03 0.53 -0.11 -0.07 0.02 0.00 0.00 177.57 177.97 1xm6 h LEU 343 N 0.71 0.10 -0.21 2.57 3.38 -1.21 -1.56 115.31 119.09 1xm6 h LEU 343 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xm6 h LEU 343 Cb 1.02 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1xm6 h LEU 343 CO 0.10 0.23 0.00 0.00 0.09 0.00 0.00 178.44 178.86 1xm6 n ALA 344 N -2.50 1.78 1.10 1.53 0.00 -0.78 -2.58 120.51 119.06 1xm6 n ALA 344 Ca -0.02 -0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.55 1xm6 n ALA 344 Cb 0.22 -1.32 0.65 0.00 0.00 0.00 0.00 19.45 18.99 1xm6 n ALA 344 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xm6 n THR 345 N -1.77 0.03 -1.94 0.00 -2.24 -0.59 -4.77 114.28 103.00 1xm6 n THR 345 Ca 0.04 0.01 -0.43 0.00 -2.27 0.00 0.00 64.05 61.40 1xm6 n THR 345 Cb 0.22 -0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 67.91 1xm6 n THR 345 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xm6 s ASP 346 N -2.88 6.16 0.59 3.42 -1.08 -1.07 -4.88 116.67 116.94 1xm6 s ASP 346 Ca 0.18 1.79 0.29 0.00 -0.52 0.00 0.00 52.55 54.30 1xm6 s ASP 346 Cb 0.19 -2.53 1.70 0.00 -1.46 0.00 0.00 42.92 40.82 1xm6 s ASP 346 CO 0.50 -1.41 2.11 0.24 0.52 0.00 0.00 175.17 177.14 1xm6 h MET 347 N 11.76 0.00 0.00 4.34 2.86 -1.91 -1.54 114.93 130.44 1xm6 h MET 347 Ca -0.37 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 1xm6 h MET 347 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 1xm6 h MET 347 CO 0.99 0.00 0.00 0.66 1.06 0.00 0.00 176.91 179.62 1xm6 h SER 348 N 0.00 0.00 -0.40 1.22 4.64 -1.90 -0.08 113.55 117.03 1xm6 h SER 348 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1xm6 h SER 348 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1xm6 h SER 348 CO -0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1xm6 n LYS 349 N -2.97 2.35 0.16 4.77 4.76 -0.58 -4.67 118.16 121.99 1xm6 n LYS 349 Ca -0.02 -2.05 -0.14 0.00 -2.87 0.00 0.00 58.31 53.23 1xm6 n LYS 349 Cb 0.10 -1.49 -0.07 0.00 -1.84 0.00 0.00 35.03 31.74 1xm6 n LYS 349 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1xm6 h HIS 350 N 3.88 -0.68 -0.94 2.13 -0.00 -1.12 -1.36 115.15 117.06 1xm6 h HIS 350 Ca 0.00 0.01 0.08 0.00 -0.00 0.00 0.00 60.37 60.45 1xm6 h HIS 350 Cb 0.86 0.27 -0.06 0.00 -0.00 0.00 0.00 27.41 28.47 1xm6 h HIS 350 CO 0.26 -0.37 0.61 0.52 -0.00 0.00 0.00 177.93 178.95 1xm6 h MET 351 N -0.53 1.01 -0.21 5.26 2.86 -1.83 -1.14 114.93 120.35 1xm6 h MET 351 Ca -0.00 -0.06 -0.19 0.00 -2.06 0.00 0.00 59.70 57.39 1xm6 h MET 351 Cb 0.50 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1xm6 h MET 351 CO -0.07 0.67 -0.63 0.66 1.06 0.00 0.00 176.91 178.60 1xm6 h SER 352 N 1.04 0.85 -0.60 1.22 4.64 -1.83 -1.59 113.55 117.27 1xm6 h SER 352 Ca 0.42 -0.49 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 1xm6 h SER 352 Cb 0.26 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 1xm6 h SER 352 CO -0.17 1.27 0.33 0.25 -0.87 0.00 0.00 176.83 177.64 1xm6 h LEU 353 N 0.55 0.75 -0.20 5.97 5.85 -0.68 -1.11 115.31 126.44 1xm6 h LEU 353 Ca -0.01 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 1xm6 h LEU 353 Cb 1.23 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1xm6 h LEU 353 CO 0.13 0.62 -0.05 0.25 -0.34 0.00 0.00 178.44 179.05 1xm6 h LEU 354 N 0.81 0.38 -0.90 2.25 5.85 -1.18 0.15 115.31 122.67 1xm6 h LEU 354 Ca 0.21 -0.36 0.04 0.00 0.84 0.00 0.00 57.88 58.61 1xm6 h LEU 354 Cb 0.04 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 1xm6 h LEU 354 CO -0.03 0.66 0.58 0.00 -0.34 0.00 0.00 178.44 179.31 1xm6 h ALA 355 N 0.74 1.20 -0.28 1.25 0.00 -1.18 0.01 119.26 121.00 1xm6 h ALA 355 Ca 0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1xm6 h ALA 355 Cb 0.49 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1xm6 h ALA 355 CO 0.02 0.42 -0.38 -0.44 0.00 0.00 0.00 179.25 178.88 1xm6 h ASP 356 N 1.12 0.68 0.21 0.00 5.19 -1.01 -2.63 116.42 119.97 1xm6 h ASP 356 Ca 0.37 -0.30 -0.12 0.00 -0.62 0.00 0.00 57.03 56.36 1xm6 h ASP 356 Cb 0.03 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 1xm6 h ASP 356 CO -0.13 0.99 -0.45 0.25 -3.12 0.00 0.00 179.24 176.78 1xm6 h LEU 357 N 0.54 0.32 -0.68 1.55 5.85 -0.29 -2.52 115.31 120.07 1xm6 h LEU 357 Ca 0.05 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.52 1xm6 h LEU 357 Cb 0.89 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 1xm6 h LEU 357 CO 0.08 0.73 -0.13 0.11 -0.34 0.00 0.00 178.44 178.89 1xm6 h LYS 358 N 0.24 0.89 -0.31 1.25 1.57 -0.84 -1.58 116.57 117.79 1xm6 h LYS 358 Ca 0.02 -0.32 -0.07 0.00 -1.87 0.00 0.00 60.65 58.41 1xm6 h LYS 358 Cb 0.89 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 1xm6 h LYS 358 CO 0.07 0.97 -0.09 1.15 -0.57 0.00 0.00 179.45 180.98 1xm6 h THR 359 N 0.80 1.22 -0.43 -0.16 2.02 -1.33 -1.77 112.91 113.26 1xm6 h THR 359 Ca 0.13 -0.96 -0.14 0.00 0.77 0.00 0.00 66.41 66.20 1xm6 h THR 359 Cb 0.65 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1xm6 h THR 359 CO 0.05 0.32 -0.30 -0.03 0.37 0.00 0.00 175.52 175.93 1xm6 h MET 360 N 0.48 0.94 -0.49 6.66 1.85 -1.07 -2.83 114.93 120.46 1xm6 h MET 360 Ca 0.09 -0.44 -0.07 0.00 -0.61 0.00 0.00 59.70 58.67 1xm6 h MET 360 Cb 0.45 -0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.45 1xm6 h MET 360 CO 0.02 1.10 0.03 0.28 -0.40 0.00 0.00 176.91 177.95 1xm6 h VAL 361 N 0.79 1.24 -0.65 -5.77 2.07 -0.97 -2.35 116.25 110.61 1xm6 h VAL 361 Ca 0.09 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.61 1xm6 h VAL 361 Cb 0.88 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1xm6 h VAL 361 CO 0.08 0.34 0.20 -0.33 0.02 0.00 0.00 177.57 177.88 1xm6 h GLU 362 N 0.75 0.98 -0.65 1.57 5.08 -1.16 -2.72 114.58 118.44 1xm6 h GLU 362 Ca 0.15 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1xm6 h GLU 362 Cb 0.41 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1xm6 h GLU 362 CO 0.01 0.84 0.00 0.25 -1.00 0.00 0.00 179.01 179.11 1xm6 n THR 363 N -4.27 2.04 -1.68 1.13 -2.24 -1.08 -5.01 114.28 103.16 1xm6 n THR 363 Ca 0.05 -1.23 -0.45 0.00 -2.27 0.00 0.00 64.05 60.16 1xm6 n THR 363 Cb 0.21 0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.43 1xm6 n THR 363 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1xm6 n LYS 364 N 1.03 2.19 -4.40 -0.78 4.81 -0.90 -5.02 118.16 115.11 1xm6 n LYS 364 Ca 0.26 0.79 -0.21 0.00 -0.87 0.00 0.00 58.31 58.28 1xm6 n LYS 364 Cb 0.96 -2.53 -0.13 0.00 0.02 0.00 0.00 35.03 33.36 1xm6 n LYS 364 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1xm6 s LYS 365 N 0.39 1.00 0.16 1.64 1.02 -1.26 -5.08 119.74 117.61 1xm6 s LYS 365 Ca 0.74 -0.77 0.01 0.00 0.02 0.00 0.00 55.97 55.97 1xm6 s LYS 365 Cb -0.65 -1.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.60 1xm6 s LYS 365 CO 0.42 0.25 0.01 0.14 -0.92 0.00 0.00 175.35 175.26 1xm6 s VAL 366 N -0.83 0.54 0.88 3.17 -7.23 -1.26 -0.68 120.40 114.99 1xm6 s VAL 366 Ca 0.02 -1.96 -0.14 0.00 -1.81 0.00 0.00 61.98 58.10 1xm6 s VAL 366 Cb -0.08 -2.09 0.14 0.00 0.56 0.00 0.00 36.38 34.91 1xm6 s VAL 366 CO 0.01 -0.49 1.24 0.42 -0.31 0.00 0.00 175.10 175.98 1xm6 s THR 367 N -3.75 2.01 -0.14 5.32 -4.23 -0.19 -4.87 115.64 109.79 1xm6 s THR 367 Ca 0.24 -0.01 0.27 0.00 -1.18 0.00 0.00 61.69 61.01 1xm6 s THR 367 Cb 0.06 -3.00 0.28 0.00 1.34 0.00 0.00 72.50 71.19 1xm6 s THR 367 CO 0.03 0.00 1.82 0.77 -0.54 0.00 0.00 174.62 176.70 1xm6 h SER 368 N -1.33 0.00 1.17 3.99 4.64 -2.02 -2.58 113.55 117.43 1xm6 h SER 368 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1xm6 h SER 368 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1xm6 h SER 368 CO 0.52 0.00 -0.27 -1.20 -0.87 0.00 0.00 176.83 175.01 1xm6 n SER 369 N -2.48 0.72 0.00 4.97 7.64 -1.26 -4.94 113.62 118.27 1xm6 n SER 369 Ca -0.00 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.24 1xm6 n SER 369 Cb 0.15 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1xm6 n SER 369 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xm6 n GLY 370 N 1.34 1.15 3.68 0.23 0.00 -0.97 -5.09 105.19 105.52 1xm6 n GLY 370 Ca 0.05 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1xm6 n GLY 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xm6 s VAL 371 N -2.00 4.87 0.39 1.61 1.01 -1.26 -4.61 120.40 120.41 1xm6 s VAL 371 Ca 0.00 -0.01 -0.27 0.00 0.00 0.00 0.00 61.98 61.70 1xm6 s VAL 371 Cb 0.00 -3.17 -0.11 0.00 0.00 0.00 0.00 36.38 33.10 1xm6 s VAL 371 CO 0.00 0.50 1.36 0.18 0.00 0.00 0.00 175.10 177.14 1xm6 n LEU 372 N 3.16 4.27 -4.48 3.92 4.77 -0.46 -1.02 117.00 127.17 1xm6 n LEU 372 Ca -0.17 1.17 -0.36 0.00 -0.03 0.00 0.00 56.01 56.61 1xm6 n LEU 372 Cb 0.53 -1.55 -0.12 0.00 -2.33 0.00 0.00 43.42 39.95 1xm6 n LEU 372 CO 0.34 -0.30 -0.27 -0.76 -1.33 0.00 0.00 177.39 175.07 1xm6 s LEU 373 N -1.75 3.53 -0.23 2.23 1.43 0.14 -4.81 118.68 119.22 1xm6 s LEU 373 Ca 0.57 -0.16 -0.00 0.00 -1.03 0.00 0.00 54.13 53.51 1xm6 s LEU 373 Cb -0.51 -1.95 0.03 0.00 0.03 0.00 0.00 46.19 43.79 1xm6 s LEU 373 CO 0.61 -0.02 -0.11 -0.76 0.23 0.00 0.00 176.35 176.30 1xm6 s LEU 374 N 1.54 2.89 0.05 1.79 1.43 -1.26 -4.59 118.68 120.52 1xm6 s LEU 374 Ca 0.06 -0.84 -0.27 0.00 -1.03 0.00 0.00 54.13 52.05 1xm6 s LEU 374 Cb -0.15 -1.60 -0.14 0.00 0.03 0.00 0.00 46.19 44.33 1xm6 s LEU 374 CO 0.04 -0.09 1.41 0.44 0.23 0.00 0.00 176.35 178.38 1xm6 h ASP 375 N 7.97 -0.89 -1.70 2.29 5.19 -1.98 -3.48 116.42 123.83 1xm6 h ASP 375 Ca -0.35 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.10 1xm6 h ASP 375 Cb 1.11 0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.87 1xm6 h ASP 375 CO 0.58 -0.57 0.00 -3.20 -3.12 0.00 0.00 179.24 172.93 1xm6 n ASN 376 N -4.65 0.00 -0.30 6.45 5.15 -1.26 -5.06 115.26 115.60 1xm6 n ASN 376 Ca -0.11 -0.92 0.10 0.00 -0.60 0.00 0.00 54.58 53.05 1xm6 n ASN 376 Cb 0.37 0.00 0.23 0.00 -0.53 0.00 0.00 39.78 39.85 1xm6 n ASN 376 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1xm6 h TYR 377 N 0.92 0.01 -0.60 1.20 3.20 -1.99 -2.18 116.97 117.53 1xm6 h TYR 377 Ca 0.00 0.06 0.09 0.00 3.14 0.00 0.00 58.73 62.02 1xm6 h TYR 377 Cb 0.00 0.13 -0.07 0.00 1.54 0.00 0.00 36.73 38.33 1xm6 h TYR 377 CO 0.00 -0.31 0.23 1.15 -1.64 0.00 0.00 178.16 177.59 1xm6 h THR 378 N 0.09 0.78 -0.19 1.81 2.02 -1.99 0.19 112.91 115.62 1xm6 h THR 378 Ca 0.51 -0.14 -0.18 0.00 0.77 0.00 0.00 66.41 67.36 1xm6 h THR 378 Cb 0.97 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.71 1xm6 h THR 378 CO -0.76 0.08 -0.61 0.44 0.37 0.00 0.00 175.52 175.03 1xm6 h ASP 379 N 0.42 0.73 -0.11 4.18 3.32 -1.81 -2.57 116.42 120.57 1xm6 h ASP 379 Ca 0.30 -0.42 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1xm6 h ASP 379 Cb 0.36 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 1xm6 h ASP 379 CO -0.30 1.17 0.02 0.03 -1.72 0.00 0.00 179.24 178.44 1xm6 h ARG 380 N 0.48 0.19 0.00 3.56 3.08 -0.95 -2.52 114.38 118.22 1xm6 h ARG 380 Ca -0.00 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 1xm6 h ARG 380 Cb 1.18 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.21 1xm6 h ARG 380 CO 0.12 0.39 -0.23 0.97 -1.07 0.00 0.00 179.97 180.15 1xm6 h ILE 381 N -0.04 0.96 -0.47 2.04 6.09 -1.05 -1.86 117.51 123.17 1xm6 h ILE 381 Ca 0.03 -0.86 -0.11 0.00 -1.37 0.00 0.00 64.86 62.55 1xm6 h ILE 381 Cb 0.29 1.49 -0.01 0.00 0.47 0.00 0.00 36.82 39.06 1xm6 h ILE 381 CO 0.00 0.23 -0.15 -0.61 -3.07 0.00 0.00 178.15 174.55 1xm6 h GLN 382 N 0.00 0.94 -0.37 2.19 4.15 -1.22 -0.80 115.11 119.99 1xm6 h GLN 382 Ca -0.00 -0.38 -0.09 0.00 0.77 0.00 0.00 58.65 58.95 1xm6 h GLN 382 Cb 0.47 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 1xm6 h GLN 382 CO 0.03 1.04 -0.11 0.28 -1.93 0.00 0.00 178.83 178.14 1xm6 h VAL 383 N 0.78 1.28 -0.60 2.39 2.07 -1.13 -2.74 116.25 118.30 1xm6 h VAL 383 Ca 0.12 -1.20 -0.06 0.00 0.82 0.00 0.00 66.70 66.38 1xm6 h VAL 383 Cb 0.71 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 1xm6 h VAL 383 CO 0.05 0.40 0.15 -0.07 0.02 0.00 0.00 177.57 178.12 1xm6 h LEU 384 N 0.54 0.92 -0.45 2.57 3.38 -1.19 0.73 115.31 121.81 1xm6 h LEU 384 Ca 0.09 -0.23 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1xm6 h LEU 384 Cb 0.63 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1xm6 h LEU 384 CO 0.04 0.91 0.25 0.03 0.09 0.00 0.00 178.44 179.77 1xm6 h ARG 385 N 0.88 0.49 -0.11 1.13 3.08 -1.15 -1.36 114.38 117.34 1xm6 h ARG 385 Ca 0.19 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 60.10 1xm6 h ARG 385 Cb 0.36 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1xm6 h ARG 385 CO 0.00 0.32 -0.41 -0.91 -1.07 0.00 0.00 179.97 177.90 1xm6 h ASN 386 N 0.50 0.26 -0.29 7.04 2.35 -1.18 -2.09 115.58 122.18 1xm6 h ASN 386 Ca 0.18 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.78 1xm6 h ASN 386 Cb 0.04 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1xm6 h ASN 386 CO -0.10 0.65 0.03 -0.03 -1.65 0.00 0.00 177.43 176.33 1xm6 h MET 387 N 0.21 0.49 -0.42 0.81 4.05 -0.29 1.00 114.93 120.77 1xm6 h MET 387 Ca 0.02 -0.14 -0.08 0.00 -0.28 0.00 0.00 59.70 59.21 1xm6 h MET 387 Cb 0.82 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.55 1xm6 h MET 387 CO 0.06 0.61 -0.09 0.28 0.23 0.00 0.00 176.91 178.01 1xm6 h VAL 388 N 0.30 1.25 -0.48 -5.77 2.07 -1.21 -0.31 116.25 112.11 1xm6 h VAL 388 Ca 0.09 -1.11 -0.06 0.00 0.82 0.00 0.00 66.70 66.44 1xm6 h VAL 388 Cb 0.37 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1xm6 h VAL 388 CO 0.01 0.38 0.06 -0.74 0.02 0.00 0.00 177.57 177.29 1xm6 h HIS 389 N 0.67 0.86 -0.61 1.57 6.17 -1.10 0.41 115.15 123.12 1xm6 h HIS 389 Ca 0.12 -0.13 0.00 0.00 0.71 0.00 0.00 60.37 61.07 1xm6 h HIS 389 Cb 0.54 -0.23 -0.03 0.00 2.52 0.00 0.00 27.41 30.21 1xm6 h HIS 389 CO 0.03 0.80 0.38 0.00 0.71 0.00 0.00 177.93 179.85 1xm6 h ALA 391 N 1.20 0.85 -0.27 0.00 0.00 -0.57 -0.43 119.26 120.04 1xm6 h ALA 391 Ca 0.22 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1xm6 h ALA 391 Cb -0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1xm6 h ALA 391 CO -0.04 0.29 0.04 0.22 0.00 0.00 0.00 179.25 179.75 1xm6 h ASP 392 N 0.91 0.35 -0.91 0.00 -0.00 -0.43 -2.51 116.42 113.83 1xm6 h ASP 392 Ca 0.24 -0.04 -0.49 0.00 -0.00 0.00 0.00 57.03 56.74 1xm6 h ASP 392 Cb -0.09 -0.09 -0.28 0.00 -0.00 0.00 0.00 39.33 38.87 1xm6 h ASP 392 CO -0.05 0.38 0.56 0.18 -0.00 0.00 0.00 179.24 180.31 1xm6 n LEU 393 N -4.36 6.44 -0.17 2.28 4.77 -0.16 -4.63 117.00 121.17 1xm6 n LEU 393 Ca 0.01 -3.70 0.12 0.00 -0.03 0.00 0.00 56.01 52.40 1xm6 n LEU 393 Cb 0.18 -0.82 0.16 0.00 -2.33 0.00 0.00 43.42 40.61 1xm6 n LEU 393 CO 0.37 1.13 0.37 -1.54 -1.33 0.00 0.00 177.39 176.39 1xm6 n SER 394 N -1.13 1.07 -0.16 -1.43 3.41 -0.30 -4.52 113.62 110.56 1xm6 n SER 394 Ca 0.56 -0.86 -0.02 0.00 -0.26 0.00 0.00 58.87 58.30 1xm6 n SER 394 Cb 1.50 0.43 0.06 0.00 -0.26 0.00 0.00 64.21 65.94 1xm6 n SER 394 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1xm6 h ASN 395 N 0.85 -0.24 0.40 4.04 -0.26 -1.82 -1.49 115.58 117.06 1xm6 h ASN 395 Ca 0.00 0.13 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 1xm6 h ASN 395 Cb 0.55 0.23 0.00 0.00 -1.06 0.00 0.00 38.32 38.04 1xm6 h ASN 395 CO 0.00 -0.09 0.00 -2.65 -1.06 0.00 0.00 177.43 173.63 1xm6 n PRO 396 N -5.25 0.01 0.00 0.81 -0.02 -1.26 -2.48 135.00 126.81 1xm6 n PRO 396 Ca 0.06 0.29 0.13 0.00 -2.02 0.00 0.00 63.50 61.95 1xm6 n PRO 396 Cb 0.28 -1.50 0.28 0.00 -0.02 0.00 0.00 33.50 32.54 1xm6 n PRO 396 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1xm6 n THR 397 N -1.49 0.00 -2.56 3.45 -2.24 -0.56 -4.18 114.28 106.70 1xm6 n THR 397 Ca 0.03 -0.28 -0.22 0.00 -2.27 0.00 0.00 64.05 61.30 1xm6 n THR 397 Cb 0.14 0.86 0.06 0.00 -2.10 0.00 0.00 70.33 69.29 1xm6 n THR 397 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1xm6 s LYS 398 N -2.22 2.25 0.60 -0.78 -0.14 -1.03 -4.71 119.74 113.70 1xm6 s LYS 398 Ca 0.28 -0.80 -0.18 0.00 -1.36 0.00 0.00 55.97 53.92 1xm6 s LYS 398 Cb 0.20 -2.40 -0.08 0.00 -1.68 0.00 0.00 37.83 33.87 1xm6 s LYS 398 CO 0.42 -1.00 0.53 -1.13 -0.76 0.00 0.00 175.35 173.41 1xm6 n SER 399 N -2.56 -1.05 -0.33 2.83 3.41 -1.26 -4.63 113.62 110.03 1xm6 n SER 399 Ca 0.10 0.71 -0.01 0.00 -0.26 0.00 0.00 58.87 59.41 1xm6 n SER 399 Cb 0.60 -1.18 0.12 0.00 -0.26 0.00 0.00 64.21 63.49 1xm6 n SER 399 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1xm6 h LEU 400 N 0.14 0.96 -0.78 1.04 5.85 -1.95 -0.95 115.31 119.62 1xm6 h LEU 400 Ca -0.46 -0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.37 1xm6 h LEU 400 Cb 1.39 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 42.13 1xm6 h LEU 400 CO 0.46 0.66 0.40 -0.08 -0.34 0.00 0.00 178.44 179.54 1xm6 h GLU 401 N 1.12 0.63 0.00 1.25 4.81 -2.00 -0.43 114.58 119.96 1xm6 h GLU 401 Ca 0.36 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.56 1xm6 h GLU 401 Cb 0.02 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.26 1xm6 h GLU 401 CO -0.13 0.42 -0.00 -0.07 -0.73 0.00 0.00 179.01 178.50 1xm6 h LEU 402 N 0.65 -0.00 -0.86 1.64 3.38 -1.75 -3.20 115.31 115.16 1xm6 h LEU 402 Ca 0.40 -0.63 0.10 0.00 0.09 0.00 0.00 57.88 57.84 1xm6 h LEU 402 Cb 0.46 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.13 1xm6 h LEU 402 CO -0.30 0.63 0.50 0.22 0.09 0.00 0.00 178.44 179.58 1xm6 h TYR 403 N -0.63 0.90 -0.42 1.13 3.20 -0.98 -0.86 116.97 119.31 1xm6 h TYR 403 Ca -0.00 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 1xm6 h TYR 403 Cb 0.63 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.60 1xm6 h TYR 403 CO 0.15 0.36 0.06 0.00 -1.64 0.00 0.00 178.16 177.08 1xm6 h ARG 404 N 0.82 0.64 -0.42 1.82 3.08 -1.16 -0.96 114.38 118.20 1xm6 h ARG 404 Ca 0.42 -0.13 -0.15 0.00 0.07 0.00 0.00 59.98 60.19 1xm6 h ARG 404 Cb 0.40 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1xm6 h ARG 404 CO -0.26 0.62 -0.31 1.96 -1.07 0.00 0.00 179.97 180.91 1xm6 h GLN 405 N 0.62 0.94 -0.58 0.04 4.20 -1.19 -1.84 115.11 117.30 1xm6 h GLN 405 Ca 0.14 -0.45 -0.05 0.00 0.06 0.00 0.00 58.65 58.35 1xm6 h GLN 405 Cb 0.30 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 1xm6 h GLN 405 CO 0.00 1.11 0.16 -1.49 -0.67 0.00 0.00 178.83 177.94 1xm6 h TRP 406 N 0.79 0.92 -0.36 2.96 -0.00 -0.82 -2.31 115.95 117.12 1xm6 h TRP 406 Ca 0.08 -0.08 -0.06 0.00 -0.00 0.00 0.00 58.89 58.83 1xm6 h TRP 406 Cb 0.89 -0.27 -0.01 0.00 -0.00 0.00 0.00 29.16 29.77 1xm6 h TRP 406 CO 0.06 0.75 -0.02 1.15 -0.00 0.00 0.00 178.44 180.37 1xm6 h THR 407 N 0.86 1.27 -0.90 1.49 2.02 -1.06 -1.23 112.91 115.36 1xm6 h THR 407 Ca 0.19 -1.03 0.12 0.00 0.77 0.00 0.00 66.41 66.46 1xm6 h THR 407 Cb 0.28 1.22 -0.08 0.00 -1.74 0.00 0.00 68.15 67.83 1xm6 h THR 407 CO -0.00 0.34 0.52 0.44 0.37 0.00 0.00 175.52 177.19 1xm6 h ASP 408 N 0.46 0.72 -0.03 4.18 3.32 -1.12 -1.39 116.42 122.56 1xm6 h ASP 408 Ca 0.10 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 1xm6 h ASP 408 Cb 0.50 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1xm6 h ASP 408 CO 0.02 0.36 -0.05 0.03 -1.72 0.00 0.00 179.24 177.88 1xm6 h ARG 409 N 0.80 0.09 -0.60 3.56 3.08 -1.10 -1.57 114.38 118.63 1xm6 h ARG 409 Ca 0.46 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.42 1xm6 h ARG 409 Cb 0.52 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 1xm6 h ARG 409 CO -0.30 0.63 0.23 0.97 -1.07 0.00 0.00 179.97 180.43 1xm6 h ILE 410 N -0.44 1.22 -0.14 2.04 6.09 -1.10 -1.40 117.51 123.78 1xm6 h ILE 410 Ca 0.00 -0.70 -0.15 0.00 -1.37 0.00 0.00 64.86 62.64 1xm6 h ILE 410 Cb 0.62 0.51 -0.01 0.00 0.47 0.00 0.00 36.82 38.42 1xm6 h ILE 410 CO 0.01 0.28 -0.56 0.24 -3.07 0.00 0.00 178.15 175.05 1xm6 h MET 411 N 0.87 0.43 -0.52 2.19 2.86 -1.27 0.97 114.93 120.46 1xm6 h MET 411 Ca 0.20 -0.27 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1xm6 h MET 411 Cb 0.19 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 1xm6 h MET 411 CO -0.02 0.87 0.19 1.49 1.06 0.00 0.00 176.91 180.50 1xm6 h GLU 412 N 0.33 0.79 -0.05 1.72 4.81 -0.82 -0.66 114.58 120.70 1xm6 h GLU 412 Ca 0.00 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1xm6 h GLU 412 Cb 1.08 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.33 1xm6 h GLU 412 CO 0.10 0.72 0.00 1.49 -0.73 0.00 0.00 179.01 180.59 1xm6 h GLU 413 N 0.71 0.08 -0.20 1.92 4.81 -1.00 -2.20 114.58 118.70 1xm6 h GLU 413 Ca 0.17 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.41 1xm6 h GLU 413 Cb 0.24 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1xm6 h GLU 413 CO -0.01 0.34 0.02 0.74 -0.73 0.00 0.00 179.01 179.37 1xm6 h PHE 414 N -0.19 0.02 -0.50 0.92 -1.00 -0.76 -1.97 116.94 113.45 1xm6 h PHE 414 Ca 0.01 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.79 1xm6 h PHE 414 Cb 0.30 0.02 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 1xm6 h PHE 414 CO 0.02 -0.01 0.24 0.74 -1.61 0.00 0.00 178.31 177.70 1xm6 h PHE 415 N 0.09 0.69 -0.45 -0.55 0.04 -1.10 -0.59 116.94 115.08 1xm6 h PHE 415 Ca 0.09 -0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.77 1xm6 h PHE 415 Cb 0.10 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 1xm6 h PHE 415 CO -0.16 0.52 -0.02 1.96 -0.60 0.00 0.00 178.31 180.00 1xm6 h GLN 416 N 0.71 0.74 -0.51 1.51 4.20 -1.11 -0.71 115.11 119.93 1xm6 h GLN 416 Ca 0.18 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 1xm6 h GLN 416 Cb 0.08 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1xm6 h GLN 416 CO -0.02 0.77 0.10 0.37 -0.67 0.00 0.00 178.83 179.38 1xm6 h GLN 417 N 0.69 0.84 -0.74 1.46 4.15 -0.53 -1.64 115.11 119.34 1xm6 h GLN 417 Ca 0.13 -0.22 -0.02 0.00 0.77 0.00 0.00 58.65 59.32 1xm6 h GLN 417 Cb 0.46 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 28.01 1xm6 h GLN 417 CO 0.02 0.82 0.37 0.78 -1.93 0.00 0.00 178.83 178.89 1xm6 h GLY 418 N 0.73 1.13 1.23 2.39 0.00 -0.70 0.62 103.07 108.46 1xm6 h GLY 418 Ca 0.16 -0.53 -0.09 0.00 0.00 0.00 0.00 47.33 46.87 1xm6 h GLY 418 CO 0.01 0.51 -0.00 -0.55 0.00 0.00 0.00 176.54 176.50 1xm6 h ASP 419 N 1.05 0.90 -0.65 0.19 3.32 -0.94 -0.94 116.42 119.36 1xm6 h ASP 419 Ca 0.26 -0.24 -0.09 0.00 0.02 0.00 0.00 57.03 56.98 1xm6 h ASP 419 Cb 0.08 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1xm6 h ASP 419 CO -0.04 0.96 0.05 0.11 -1.72 0.00 0.00 179.24 178.61 1xm6 h LYS 420 N 0.86 1.11 -0.18 3.56 1.57 -0.47 -1.27 116.57 121.74 1xm6 h LYS 420 Ca 0.16 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1xm6 h LYS 420 Cb 0.51 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1xm6 h LYS 420 CO 0.03 1.04 0.09 0.93 -0.57 0.00 0.00 179.45 180.97 1xm6 h GLU 421 N 1.02 0.25 -0.35 3.15 5.08 -0.57 -2.57 114.58 120.60 1xm6 h GLU 421 Ca 0.19 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1xm6 h GLU 421 Cb 0.51 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1xm6 h GLU 421 CO 0.02 0.28 0.19 -0.09 -1.00 0.00 0.00 179.01 178.41 1xm6 h ARG 422 N 0.16 0.38 -0.87 2.33 2.43 -0.96 -1.73 114.38 116.12 1xm6 h ARG 422 Ca 0.06 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.29 1xm6 h ARG 422 Cb 0.11 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.50 1xm6 h ARG 422 CO -0.01 0.25 0.53 0.93 -1.51 0.00 0.00 179.97 180.16 1xm6 h GLU 423 N 0.39 0.90 -0.13 0.20 5.08 -1.11 -1.69 114.58 118.22 1xm6 h GLU 423 Ca 0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1xm6 h GLU 423 Cb 0.03 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1xm6 h GLU 423 CO -0.08 0.60 0.00 0.54 -1.00 0.00 0.00 179.01 179.06 1xm6 n ARG 424 N -4.65 1.40 -1.60 2.33 1.74 -0.98 -4.92 116.66 109.98 1xm6 n ARG 424 Ca 0.14 -0.62 -0.16 0.00 -0.77 0.00 0.00 57.85 56.44 1xm6 n ARG 424 Cb 0.23 -1.27 -0.06 0.00 -1.02 0.00 0.00 32.46 30.35 1xm6 n ARG 424 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xm6 n GLY 425 N 0.90 1.27 3.94 -0.13 0.00 -0.64 -5.00 105.19 105.53 1xm6 n GLY 425 Ca 0.12 -0.27 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 1xm6 n GLY 425 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1xm6 s MET 426 N -3.57 2.79 0.31 1.61 0.23 -0.69 -5.03 119.30 114.95 1xm6 s MET 426 Ca 0.00 -0.33 -0.29 0.00 -1.03 0.00 0.00 55.69 54.04 1xm6 s MET 426 Cb 0.00 -2.38 -0.10 0.00 -1.53 0.00 0.00 34.83 30.82 1xm6 s MET 426 CO 0.00 -0.65 1.25 -1.21 -2.03 0.00 0.00 175.02 172.37 1xm6 s GLU 427 N -4.86 4.44 -0.18 3.16 2.02 -1.26 -4.44 118.70 117.58 1xm6 s GLU 427 Ca 0.54 2.10 -0.28 0.00 0.02 0.00 0.00 54.97 57.35 1xm6 s GLU 427 Cb -0.10 -3.11 -0.00 0.00 0.10 0.00 0.00 34.13 31.01 1xm6 s GLU 427 CO 0.42 -0.08 0.95 0.42 0.02 0.00 0.00 175.26 176.99 1xm6 s ILE 428 N -1.11 4.78 0.05 -1.63 -1.09 -1.26 -4.89 121.20 116.05 1xm6 s ILE 428 Ca 0.48 1.86 -0.30 0.00 -2.23 0.00 0.00 60.65 60.46 1xm6 s ILE 428 Cb -0.37 -4.24 -0.08 0.00 -1.58 0.00 0.00 42.46 36.19 1xm6 s ILE 428 CO 0.49 -0.06 1.71 -0.44 -1.23 0.00 0.00 174.94 175.41 1xm6 s SER 429 N 1.18 6.58 0.25 3.58 0.01 -1.26 -4.91 113.70 119.13 1xm6 s SER 429 Ca 0.42 2.48 -0.04 0.00 1.31 0.00 0.00 55.95 60.12 1xm6 s SER 429 Cb -0.16 -2.55 0.49 0.00 0.21 0.00 0.00 66.02 64.00 1xm6 s SER 429 CO 0.11 -0.92 1.68 -0.65 0.41 0.00 0.00 173.24 173.86 1xm6 h PRO 430 N 8.87 0.24 -2.00 12.44 0.11 -1.94 -2.78 132.00 146.94 1xm6 h PRO 430 Ca -0.43 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.47 1xm6 h PRO 430 Cb 1.20 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.19 1xm6 h PRO 430 CO 0.94 0.16 -0.35 -1.33 -0.21 0.00 0.00 178.00 177.21 1xm6 n MET 431 N -5.18 1.98 -2.70 1.05 2.81 -1.26 -4.38 117.12 109.44 1xm6 n MET 431 Ca 0.15 -1.01 -0.01 0.00 -1.81 0.00 0.00 57.70 55.01 1xm6 n MET 431 Cb 0.48 -1.97 -0.01 0.00 -0.71 0.00 0.00 33.22 31.01 1xm6 n MET 431 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1xm6 n ASP 433 N 2.41 -4.63 0.30 7.83 -0.08 -1.05 -4.75 116.55 116.58 1xm6 n ASP 433 Ca 0.42 1.15 0.17 0.00 -1.51 0.00 0.00 54.79 55.02 1xm6 n ASP 433 Cb 0.89 -2.81 0.95 0.00 2.34 0.00 0.00 41.12 42.49 1xm6 n ASP 433 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1xm6 h LYS 434 N 4.58 0.00 0.00 -0.67 2.10 -1.88 -1.00 116.57 119.70 1xm6 h LYS 434 Ca -0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 1xm6 h LYS 434 Cb 0.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.66 1xm6 h LYS 434 CO 0.00 0.03 -0.10 0.72 -2.00 0.00 0.00 179.45 178.10 1xm6 n HIS 435 N -3.59 0.11 0.00 0.07 8.25 -1.26 -4.53 115.22 114.28 1xm6 n HIS 435 Ca -0.03 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1xm6 n HIS 435 Cb 0.12 -0.51 0.00 0.00 1.12 0.00 0.00 29.99 30.72 1xm6 n HIS 435 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1xm6 n THR 436 N -1.60 0.00 -2.08 1.59 -1.04 -0.88 -5.09 114.28 105.18 1xm6 n THR 436 Ca 0.07 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.66 1xm6 n THR 436 Cb 0.35 -0.26 -0.03 0.00 -1.82 0.00 0.00 70.33 68.57 1xm6 n THR 436 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xm6 s ALA 437 N -1.48 3.64 -0.22 2.41 0.00 -0.43 -4.99 121.76 120.70 1xm6 s ALA 437 Ca 0.00 1.22 -0.24 0.00 0.00 0.00 0.00 51.96 52.94 1xm6 s ALA 437 Cb 0.00 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.55 1xm6 s ALA 437 CO 0.00 -0.67 0.78 0.45 0.00 0.00 0.00 175.76 176.32 1xm6 s SER 438 N 0.93 6.81 0.22 0.00 0.15 -1.26 -4.92 113.70 115.63 1xm6 s SER 438 Ca 0.65 1.01 -0.08 0.00 0.70 0.00 0.00 55.95 58.22 1xm6 s SER 438 Cb -0.40 -2.42 0.18 0.00 -1.71 0.00 0.00 66.02 61.68 1xm6 s SER 438 CO 0.33 -0.44 1.83 0.58 1.20 0.00 0.00 173.24 176.74 1xm6 h VAL 439 N 5.33 1.25 -0.06 4.45 2.07 -1.99 -2.52 116.25 124.77 1xm6 h VAL 439 Ca -0.26 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 1xm6 h VAL 439 Cb 1.11 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1xm6 h VAL 439 CO 0.84 0.29 -0.07 -0.33 0.02 0.00 0.00 177.57 178.32 1xm6 h GLU 440 N 1.18 0.16 -0.61 1.57 3.07 -1.92 -2.32 114.58 115.71 1xm6 h GLU 440 Ca 0.29 -0.09 -0.02 0.00 -0.50 0.00 0.00 59.36 59.05 1xm6 h GLU 440 Cb 0.07 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.96 1xm6 h GLU 440 CO -0.04 0.61 0.31 0.87 -1.40 0.00 0.00 179.01 179.35 1xm6 h LYS 441 N -0.28 0.85 -0.58 2.33 1.57 -1.86 -1.72 116.57 116.89 1xm6 h LYS 441 Ca 0.01 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 1xm6 h LYS 441 Cb 0.58 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 1xm6 h LYS 441 CO 0.02 0.65 0.04 0.77 -0.57 0.00 0.00 179.45 180.35 1xm6 h SER 442 N 0.86 0.93 -0.22 0.86 0.02 -1.32 -1.07 113.55 113.61 1xm6 h SER 442 Ca 0.21 -0.23 -0.16 0.00 -0.84 0.00 0.00 61.79 60.77 1xm6 h SER 442 Cb 0.07 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1xm6 h SER 442 CO -0.03 0.97 -0.43 1.56 -1.14 0.00 0.00 176.83 177.75 1xm6 h GLN 443 N 0.90 0.77 -0.39 3.45 1.08 -1.02 -0.93 115.11 118.97 1xm6 h GLN 443 Ca 0.17 -0.42 0.01 0.00 -1.45 0.00 0.00 58.65 56.95 1xm6 h GLN 443 Cb 0.47 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 1xm6 h GLN 443 CO 0.02 1.05 0.25 0.28 -0.95 0.00 0.00 178.83 179.49 1xm6 h VAL 444 N 0.62 1.09 -0.45 -0.54 2.07 -0.85 -0.64 116.25 117.55 1xm6 h VAL 444 Ca 0.04 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 67.33 1xm6 h VAL 444 Cb 1.00 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1xm6 h VAL 444 CO 0.10 0.09 0.08 1.23 0.02 0.00 0.00 177.57 179.09 1xm6 h GLY 445 N 0.52 0.80 0.60 2.17 0.00 -1.19 0.16 103.07 106.12 1xm6 h GLY 445 Ca 0.14 -0.52 0.04 0.00 0.00 0.00 0.00 47.33 46.99 1xm6 h GLY 445 CO -0.04 0.49 -0.01 -2.75 0.00 0.00 0.00 176.54 174.23 1xm6 h PHE 446 N 0.60 -0.03 0.05 5.60 3.57 -0.84 -0.83 116.94 125.05 1xm6 h PHE 446 Ca 0.14 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 1xm6 h PHE 446 Cb 0.37 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.16 1xm6 h PHE 446 CO 0.03 -0.05 -0.02 0.82 -2.23 0.00 0.00 178.31 176.85 1xm6 h ILE 447 N 0.07 1.13 -0.62 1.41 2.04 -0.92 -0.79 117.51 119.82 1xm6 h ILE 447 Ca 0.12 -0.59 0.01 0.00 1.00 0.00 0.00 64.86 65.40 1xm6 h ILE 447 Cb 0.16 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1xm6 h ILE 447 CO -0.21 0.15 0.40 0.44 0.00 0.00 0.00 178.15 178.93 1xm6 h ASP 448 N -0.32 0.69 0.00 1.72 3.32 -0.73 0.16 116.42 121.25 1xm6 h ASP 448 Ca -0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1xm6 h ASP 448 Cb 0.29 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1xm6 h ASP 448 CO 0.01 0.49 -1.18 -1.22 -1.72 0.00 0.00 179.24 175.63 1xm6 n TYR 449 N -4.67 0.00 0.04 4.55 4.02 -0.34 -4.50 117.16 116.26 1xm6 n TYR 449 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1xm6 n TYR 449 Cb 0.03 -0.15 0.00 0.00 -0.02 0.00 0.00 39.34 39.21 1xm6 n TYR 449 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1xm6 n ILE 450 N -1.67 0.66 -0.03 -0.72 2.08 -0.72 -4.67 119.36 114.30 1xm6 n ILE 450 Ca 0.01 0.22 -0.13 0.00 0.56 0.00 0.00 62.75 63.41 1xm6 n ILE 450 Cb 0.34 -1.21 -0.09 0.00 -0.75 0.00 0.00 39.64 37.93 1xm6 n ILE 450 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1xm6 h VAL 451 N 0.00 1.37 -0.24 1.39 2.07 -1.14 -2.90 116.25 116.80 1xm6 h VAL 451 Ca 0.00 -1.19 -0.03 0.00 0.82 0.00 0.00 66.70 66.30 1xm6 h VAL 451 Cb 0.00 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1xm6 h VAL 451 CO 0.00 0.33 0.05 -0.74 0.02 0.00 0.00 177.57 177.23 1xm6 h HIS 452 N -0.31 0.42 -1.01 1.57 -0.00 -0.91 -1.27 115.15 113.64 1xm6 h HIS 452 Ca 0.01 -0.05 0.10 0.00 -0.00 0.00 0.00 60.37 60.43 1xm6 h HIS 452 Cb 0.55 -0.12 -0.08 0.00 -0.00 0.00 0.00 27.41 27.76 1xm6 h HIS 452 CO 0.09 0.50 0.64 -1.35 -0.00 0.00 0.00 177.93 177.81 1xm6 h PRO 453 N 0.22 1.04 -0.03 5.26 0.11 -1.75 0.20 132.00 137.03 1xm6 h PRO 453 Ca 0.08 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 1xm6 h PRO 453 Cb 0.29 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 31.17 1xm6 h PRO 453 CO 0.00 0.69 -0.02 1.25 -0.21 0.00 0.00 178.00 179.71 1xm6 h LEU 454 N 1.07 0.08 -1.03 2.35 5.85 -1.30 -2.91 115.31 119.42 1xm6 h LEU 454 Ca 0.47 -0.44 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 1xm6 h LEU 454 Cb 0.37 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1xm6 h LEU 454 CO -0.23 0.51 -0.33 -0.50 -0.34 0.00 0.00 178.44 177.54 1xm6 h TRP 455 N -0.35 0.00 -0.58 1.25 4.06 -1.01 -0.73 115.95 118.59 1xm6 h TRP 455 Ca 0.01 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.87 1xm6 h TRP 455 Cb 0.48 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.62 1xm6 h TRP 455 CO 0.08 0.33 0.00 1.49 -3.56 0.00 0.00 178.44 176.78 1xm6 h GLU 456 N 0.00 1.01 -0.09 0.49 4.81 -0.63 0.52 114.58 120.70 1xm6 h GLU 456 Ca -0.00 -0.31 -0.23 0.00 -0.13 0.00 0.00 59.36 58.69 1xm6 h GLU 456 Cb 0.83 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.12 1xm6 h GLU 456 CO 0.04 0.99 -0.85 1.15 -0.73 0.00 0.00 179.01 179.61 1xm6 h THR 457 N 0.93 1.30 -0.33 0.32 2.02 -1.24 -1.97 112.91 113.95 1xm6 h THR 457 Ca 0.17 -2.11 -0.01 0.00 0.77 0.00 0.00 66.41 65.22 1xm6 h THR 457 Cb 0.54 2.14 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 1xm6 h THR 457 CO 0.03 0.66 0.16 -0.25 0.37 0.00 0.00 175.52 176.48 1xm6 h TRP 458 N 0.44 0.48 -0.65 3.16 2.91 -1.01 -1.99 115.95 119.28 1xm6 h TRP 458 Ca -0.07 -0.02 0.05 0.00 1.13 0.00 0.00 58.89 59.98 1xm6 h TRP 458 Cb 1.48 -0.15 -0.04 0.00 -0.51 0.00 0.00 29.16 29.95 1xm6 h TRP 458 CO 0.08 0.42 0.43 0.00 -1.03 0.00 0.00 178.44 178.34 1xm6 h ALA 459 N 1.01 1.73 -0.26 2.65 0.00 -0.81 -1.31 119.26 122.28 1xm6 h ALA 459 Ca 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1xm6 h ALA 459 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xm6 h ALA 459 CO -0.01 0.18 0.05 -0.44 0.00 0.00 0.00 179.25 179.02 1xm6 h ASP 460 N 0.68 0.40 -0.97 0.00 3.32 -0.97 -0.42 116.42 118.47 1xm6 h ASP 460 Ca 0.27 -0.25 0.03 0.00 0.02 0.00 0.00 57.03 57.10 1xm6 h ASP 460 Cb 0.21 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.60 1xm6 h ASP 460 CO -0.08 0.55 0.64 0.25 -1.72 0.00 0.00 179.24 178.88 1xm6 h LEU 461 N 0.24 1.07 -3.26 1.55 5.85 -0.53 -3.16 115.31 117.07 1xm6 h LEU 461 Ca 0.08 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 1xm6 h LEU 461 Cb 0.32 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1xm6 h LEU 461 CO 0.00 0.74 -0.02 1.33 -0.34 0.00 0.00 178.44 180.16 1xm6 n VAL 462 N -4.45 2.32 -1.68 1.05 0.24 -0.70 -4.95 118.33 110.16 1xm6 n VAL 462 Ca 0.13 -2.18 -0.41 0.00 -2.04 0.00 0.00 64.34 59.83 1xm6 n VAL 462 Cb 0.07 -0.27 0.01 0.00 -1.47 0.00 0.00 33.84 32.18 1xm6 n VAL 462 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xm6 n GLN 463 N -0.81 1.78 -0.90 7.34 10.64 -0.17 -1.64 117.38 133.62 1xm6 n GLN 463 Ca 0.24 0.63 0.05 0.00 -1.83 0.00 0.00 57.00 56.09 1xm6 n GLN 463 Cb 0.91 -2.29 0.38 0.00 -0.86 0.00 0.00 30.24 28.38 1xm6 n GLN 463 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 1xm6 n PRO 464 N 0.07 4.65 0.01 2.61 -0.04 -1.26 -4.96 135.00 136.08 1xm6 n PRO 464 Ca 0.07 -3.06 0.18 0.00 -0.04 0.00 0.00 63.50 60.66 1xm6 n PRO 464 Cb 0.39 -2.25 0.67 0.00 -0.04 0.00 0.00 33.50 32.28 1xm6 n PRO 464 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xm6 h ASP 465 N 3.71 0.04 -0.66 3.54 3.32 -1.62 -2.59 116.42 122.15 1xm6 h ASP 465 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1xm6 h ASP 465 Cb 2.00 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.55 1xm6 h ASP 465 CO 0.52 0.02 0.00 0.00 -1.72 0.00 0.00 179.24 178.06 1xm6 n ALA 466 N -2.62 2.73 -0.26 3.45 0.00 -1.26 -4.58 120.51 117.97 1xm6 n ALA 466 Ca 0.09 -1.47 -0.06 0.00 0.00 0.00 0.00 53.44 52.00 1xm6 n ALA 466 Cb 0.54 -0.94 0.05 0.00 0.00 0.00 0.00 19.45 19.11 1xm6 n ALA 466 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1xm6 h GLN 467 N 4.02 1.02 -0.95 0.00 5.75 -1.82 -2.09 115.11 121.04 1xm6 h GLN 467 Ca 0.00 -0.14 0.05 0.00 -0.15 0.00 0.00 58.65 58.41 1xm6 h GLN 467 Cb 1.22 -0.19 -0.06 0.00 1.07 0.00 0.00 27.48 29.52 1xm6 h GLN 467 CO 0.12 0.79 0.61 -0.44 -2.65 0.00 0.00 178.83 177.27 1xm6 h ASP 468 N 0.99 0.99 -0.53 -0.69 3.45 -1.84 -0.24 116.42 118.56 1xm6 h ASP 468 Ca 0.25 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.66 1xm6 h ASP 468 Cb 0.10 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.64 1xm6 h ASP 468 CO -0.03 0.65 0.15 0.40 -1.57 0.00 0.00 179.24 178.84 1xm6 h ILE 469 N 1.14 1.24 -0.64 0.35 2.04 -1.79 -1.17 117.51 118.68 1xm6 h ILE 469 Ca 0.40 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 65.39 1xm6 h ILE 469 Cb 0.10 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1xm6 h ILE 469 CO -0.15 0.30 0.24 -0.07 0.00 0.00 0.00 178.15 178.47 1xm6 h LEU 470 N 0.74 0.87 -0.48 1.44 4.07 -0.68 -0.67 115.31 120.60 1xm6 h LEU 470 Ca 0.17 -0.13 -0.14 0.00 0.08 0.00 0.00 57.88 57.85 1xm6 h LEU 470 Cb 0.31 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 1xm6 h LEU 470 CO -0.00 0.80 -0.31 0.44 -1.08 0.00 0.00 178.44 178.28 1xm6 h ASP 471 N 0.93 0.96 -0.58 -0.43 3.32 -0.79 -2.14 116.42 117.68 1xm6 h ASP 471 Ca 0.21 -0.40 -0.08 0.00 0.02 0.00 0.00 57.03 56.78 1xm6 h ASP 471 Cb 0.21 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1xm6 h ASP 471 CO -0.02 1.19 0.05 0.74 -1.72 0.00 0.00 179.24 179.48 1xm6 h THR 472 N 0.77 1.26 -0.61 0.35 2.02 -0.94 -2.06 112.91 113.70 1xm6 h THR 472 Ca 0.08 -1.06 0.04 0.00 0.77 0.00 0.00 66.41 66.25 1xm6 h THR 472 Cb 0.89 0.80 -0.05 0.00 -1.74 0.00 0.00 68.15 68.05 1xm6 h THR 472 CO 0.08 0.38 0.35 0.25 0.37 0.00 0.00 175.52 176.95 1xm6 h LEU 473 N 0.89 0.54 -0.44 2.58 5.85 -0.96 -0.22 115.31 123.54 1xm6 h LEU 473 Ca 0.17 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 1xm6 h LEU 473 Cb 0.48 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1xm6 h LEU 473 CO 0.02 0.36 0.09 -0.08 -0.34 0.00 0.00 178.44 178.49 1xm6 h GLU 474 N 0.67 0.71 -0.45 1.25 4.81 -1.19 -1.52 114.58 118.87 1xm6 h GLU 474 Ca 0.26 -0.18 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1xm6 h GLU 474 Cb 0.11 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1xm6 h GLU 474 CO -0.14 0.73 0.18 -0.44 -0.73 0.00 0.00 179.01 178.60 1xm6 h ASP 475 N 0.58 0.61 -0.78 1.04 3.32 -1.05 -2.07 116.42 118.07 1xm6 h ASP 475 Ca 0.14 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 1xm6 h ASP 475 Cb 0.34 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1xm6 h ASP 475 CO 0.00 0.61 0.31 0.78 -1.72 0.00 0.00 179.24 179.23 1xm6 h ASN 476 N 0.58 1.08 -0.47 6.45 2.35 -0.92 -1.46 115.58 123.19 1xm6 h ASN 476 Ca 0.15 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1xm6 h ASN 476 Cb 0.19 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1xm6 h ASN 476 CO -0.01 0.96 0.25 -0.09 -1.65 0.00 0.00 177.43 176.89 1xm6 h ARG 477 N 1.14 0.66 -0.07 0.81 1.12 -1.17 -2.04 114.38 114.84 1xm6 h ARG 477 Ca 0.26 -0.08 -0.07 0.00 -1.11 0.00 0.00 59.98 58.98 1xm6 h ARG 477 Cb 0.22 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.04 1xm6 h ARG 477 CO -0.02 0.53 -0.29 -0.91 -3.11 0.00 0.00 179.97 176.17 1xm6 h ASN 478 N 0.62 0.12 0.10 -3.80 2.35 -1.06 -1.27 115.58 112.63 1xm6 h ASN 478 Ca 0.16 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1xm6 h ASN 478 Cb 0.07 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1xm6 h ASN 478 CO -0.03 0.41 -0.05 -0.25 -1.65 0.00 0.00 177.43 175.87 1xm6 h TRP 479 N 0.11 -0.13 -0.94 1.19 7.01 -0.85 -0.93 115.95 121.42 1xm6 h TRP 479 Ca 0.02 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.04 1xm6 h TRP 479 Cb 0.57 0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 27.62 1xm6 h TRP 479 CO 0.00 0.22 0.62 1.88 -2.79 0.00 0.00 178.44 178.38 1xm6 h TYR 480 N -0.49 1.17 -0.55 2.65 0.05 -1.26 -1.54 116.97 117.00 1xm6 h TYR 480 Ca -0.01 0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.73 1xm6 h TYR 480 Cb 0.41 -0.39 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 1xm6 h TYR 480 CO 0.04 0.70 0.07 0.37 -1.05 0.00 0.00 178.16 178.30 1xm6 h GLN 481 N 1.23 0.88 0.00 4.88 5.75 -1.18 -2.43 115.11 124.24 1xm6 h GLN 481 Ca 0.36 -0.21 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1xm6 h GLN 481 Cb -0.07 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.37 1xm6 h GLN 481 CO -0.10 0.83 -0.16 0.66 -2.65 0.00 0.00 178.83 177.41 1xm6 h SER 482 N 0.83 0.00 0.55 -0.69 4.64 -0.18 -2.36 113.55 116.34 1xm6 h SER 482 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1xm6 h SER 482 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1xm6 h SER 482 CO 0.01 0.16 -0.07 0.23 -0.87 0.00 0.00 176.83 176.29 1xm6 n MET 483 N -3.48 0.44 -3.10 4.77 2.81 -0.85 -4.72 117.12 112.99 1xm6 n MET 483 Ca -0.01 -0.09 -0.41 0.00 -1.81 0.00 0.00 57.70 55.39 1xm6 n MET 483 Cb 0.32 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.27 1xm6 n MET 483 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1xm6 s ILE 484 N -2.62 4.97 -2.00 2.02 1.01 -0.89 -5.01 121.20 118.68 1xm6 s ILE 484 Ca 0.26 1.14 0.01 0.00 0.00 0.00 0.00 60.65 62.06 1xm6 s ILE 484 Cb 0.20 -3.95 0.02 0.00 0.01 0.00 0.00 42.46 38.74 1xm6 s ILE 484 CO 0.49 0.01 0.22 -2.65 0.00 0.00 0.00 174.94 173.01 1xm6 n PRO 485 N 5.74 0.09 0.06 2.79 -0.02 -1.26 -5.02 135.00 137.38 1xm6 n PRO 485 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1xm6 n PRO 485 Cb 0.49 -1.12 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 1xm6 n PRO 485 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xm6 h GLN 500 N 0.00 0.16 -0.35 0.00 5.75 -2.00 -0.37 115.11 118.31 1xm6 h GLN 500 Ca 0.00 -0.02 -0.16 0.00 -0.15 0.00 0.00 58.65 58.33 1xm6 h GLN 500 Cb 0.18 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.70 1xm6 h GLN 500 CO 0.00 0.18 -0.39 0.78 -2.65 0.00 0.00 178.83 176.75 1xm6 h GLY 501 N 0.35 0.96 2.00 2.39 0.00 -2.02 -2.82 103.07 103.93 1xm6 h GLY 501 Ca 0.04 -1.01 0.00 0.00 0.00 0.00 0.00 47.33 46.36 1xm6 h GLY 501 CO 0.00 0.91 0.00 1.41 0.00 0.00 0.00 176.54 178.86 1xm6 h LEU 502 N 0.68 0.00 -0.20 3.11 -0.00 -1.88 -2.25 115.31 114.77 1xm6 h LEU 502 Ca 0.05 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.87 1xm6 h LEU 502 Cb 0.99 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.64 1xm6 h LEU 502 CO 0.10 0.00 -0.10 -0.03 -0.00 0.00 0.00 178.44 178.41 1xm6 h MET 503 N 0.00 0.41 -0.18 1.13 4.05 -0.89 -2.23 114.93 117.23 1xm6 h MET 503 Ca 0.00 -0.18 -0.15 0.00 -0.28 0.00 0.00 59.70 59.09 1xm6 h MET 503 Cb 0.74 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 1xm6 h MET 503 CO 0.00 0.71 -0.52 0.93 0.23 0.00 0.00 176.91 178.26 1xm6 h GLU 504 N 0.10 0.49 -0.32 0.39 5.08 -1.42 -2.88 114.58 116.02 1xm6 h GLU 504 Ca 0.04 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1xm6 h GLU 504 Cb 0.58 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1xm6 h GLU 504 CO 0.03 0.89 0.18 -0.22 -1.00 0.00 0.00 179.01 178.89 1xm6 h LYS 505 N 0.39 0.45 0.00 2.33 3.11 -1.31 -1.64 116.57 119.89 1xm6 h LYS 505 Ca 0.01 -0.05 -0.08 0.00 -2.81 0.00 0.00 60.65 57.72 1xm6 h LYS 505 Cb 1.04 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 32.17 1xm6 h LYS 505 CO 0.09 0.37 -0.39 0.35 -2.81 0.00 0.00 179.45 177.06 1xm6 h PHE 506 N 0.40 0.00 -0.06 1.91 3.57 -1.42 -1.51 116.94 119.83 1xm6 h PHE 506 Ca 0.11 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.49 1xm6 h PHE 506 Cb 0.05 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1xm6 h PHE 506 CO -0.03 0.39 -0.53 0.37 -2.23 0.00 0.00 178.31 176.28 1xm6 h GLN 507 N 0.00 0.18 -0.11 1.11 4.15 -1.25 -2.77 115.11 116.42 1xm6 h GLN 507 Ca -0.00 -0.11 -0.21 0.00 0.77 0.00 0.00 58.65 59.10 1xm6 h GLN 507 Cb 0.84 0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.55 1xm6 h GLN 507 CO 0.05 0.67 -0.75 0.35 -1.93 0.00 0.00 178.83 177.22 1xm6 h PHE 508 N 0.14 0.96 -0.61 3.99 3.57 -0.88 -2.37 116.94 121.75 1xm6 h PHE 508 Ca 0.00 -0.45 0.01 0.00 3.53 0.00 0.00 57.97 61.07 1xm6 h PHE 508 Cb 0.99 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 1xm6 h PHE 508 CO 0.01 1.27 0.40 0.93 -2.23 0.00 0.00 178.31 178.70 1xm6 h GLU 509 N 0.38 0.78 0.07 1.11 4.39 -1.19 1.27 114.58 121.39 1xm6 h GLU 509 Ca -0.06 -0.05 -0.18 0.00 0.34 0.00 0.00 59.36 59.41 1xm6 h GLU 509 Cb 1.40 -0.18 0.02 0.00 -0.10 0.00 0.00 28.75 29.89 1xm6 h GLU 509 CO 0.15 0.51 -0.74 -0.07 -1.16 0.00 0.00 179.01 177.71 1xm6 h LEU 510 N 0.80 0.53 0.04 1.33 3.38 -1.53 -3.40 115.31 116.46 1xm6 h LEU 510 Ca 0.23 -0.84 -0.34 0.00 0.09 0.00 0.00 57.88 57.01 1xm6 h LEU 510 Cb -0.06 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 1xm6 h LEU 510 CO -0.05 1.32 -2.01 0.35 0.09 0.00 0.00 178.44 178.14 1xm6 n THR 511 N -4.15 1.61 -2.58 0.22 -2.24 -0.89 -4.99 114.28 101.26 1xm6 n THR 511 Ca -0.12 -0.74 -0.16 0.00 -2.27 0.00 0.00 64.05 60.76 1xm6 n THR 511 Cb 0.76 -1.20 0.01 0.00 -2.10 0.00 0.00 70.33 67.80 1xm6 n THR 511 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1xm6 n LEU 512 N -3.15 -2.08 -0.66 3.22 4.77 0.43 -4.34 117.00 115.19 1xm6 n LEU 512 Ca -0.28 -0.12 0.13 0.00 -0.03 0.00 0.00 56.01 55.71 1xm6 n LEU 512 Cb 1.06 -2.35 0.36 0.00 -2.33 0.00 0.00 43.42 40.17 1xm6 n LEU 512 CO 0.42 0.02 0.78 -0.67 -1.33 0.00 0.00 177.39 176.60