#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h60 n SER 177 N 0.00 2.96 -3.27 2.98 3.41 -1.26 -5.03 113.62 113.41 3h60 n SER 177 Ca 0.00 -1.89 -0.21 0.00 -0.26 0.00 0.00 58.87 56.50 3h60 n SER 177 Cb 0.00 -0.22 0.17 0.00 -0.26 0.00 0.00 64.21 63.90 3h60 n SER 177 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h60 n GLY 178 N 0.85 -2.45 3.76 5.00 0.00 -1.26 -5.01 105.19 106.08 3h60 n GLY 178 Ca 0.14 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.29 3h60 n GLY 178 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3h60 s PRO 179 N -4.82 3.04 -0.00 1.61 0.02 -1.26 -5.05 135.00 128.53 3h60 s PRO 179 Ca 0.51 1.66 -0.01 0.00 0.02 0.00 0.00 61.00 63.18 3h60 s PRO 179 Cb -0.04 -1.96 -0.00 0.00 0.02 0.00 0.00 34.50 32.52 3h60 s PRO 179 CO 0.39 -1.11 0.01 0.15 -0.33 0.00 0.00 177.00 176.11 3h60 s LYS 180 N -3.48 0.08 0.41 5.54 1.02 -1.26 -4.76 119.74 117.28 3h60 s LYS 180 Ca 0.73 -0.09 -0.25 0.00 0.02 0.00 0.00 55.97 56.38 3h60 s LYS 180 Cb -0.26 0.03 -0.08 0.00 -0.52 0.00 0.00 37.83 37.00 3h60 s LYS 180 CO 0.33 -0.01 1.24 -0.51 -0.92 0.00 0.00 175.35 175.48 3h60 s LEU 181 N -0.26 4.18 -0.74 3.17 1.43 -1.26 -4.88 118.68 120.31 3h60 s LEU 181 Ca -0.03 2.52 -0.17 0.00 -1.03 0.00 0.00 54.13 55.41 3h60 s LEU 181 Cb -0.02 -3.99 0.15 0.00 0.03 0.00 0.00 46.19 42.36 3h60 s LEU 181 CO -0.00 -0.82 0.81 -1.61 0.23 0.00 0.00 176.35 174.95 3h60 s GLU 182 N -2.32 3.33 -0.44 1.70 2.02 -0.63 -4.00 118.70 118.36 3h60 s GLU 182 Ca 0.58 -1.79 -0.02 0.00 0.02 0.00 0.00 54.97 53.77 3h60 s GLU 182 Cb -0.35 -4.46 0.00 0.00 0.10 0.00 0.00 34.13 29.42 3h60 s GLU 182 CO 0.44 -1.51 0.38 -0.25 0.02 0.00 0.00 175.26 174.34 3h60 n ASP 183 N 5.61 -2.82 -2.71 -0.19 8.00 -1.26 -3.37 116.55 119.81 3h60 n ASP 183 Ca 0.05 -0.20 -0.19 0.00 0.71 0.00 0.00 54.79 55.16 3h60 n ASP 183 Cb 0.45 -2.07 0.00 0.00 -0.02 0.00 0.00 41.12 39.48 3h60 n ASP 183 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h60 n GLY 184 N -1.03 -0.50 3.04 0.44 0.00 -1.26 -4.97 105.19 100.91 3h60 n GLY 184 Ca -0.04 0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 3h60 n GLY 184 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h60 s LYS 185 N -5.35 0.19 0.17 1.61 2.36 -1.22 -5.07 119.74 112.43 3h60 s LYS 185 Ca 0.13 0.25 -0.30 0.00 -2.55 0.00 0.00 55.97 53.51 3h60 s LYS 185 Cb -0.06 0.07 -0.08 0.00 -1.05 0.00 0.00 37.83 36.71 3h60 s LYS 185 CO 0.16 -0.04 1.21 0.08 1.55 0.00 0.00 175.35 178.31 3h60 s VAL 186 N 0.20 3.62 0.36 4.02 1.01 -1.26 -1.61 120.40 126.74 3h60 s VAL 186 Ca -0.01 1.32 0.04 0.00 0.00 0.00 0.00 61.98 63.33 3h60 s VAL 186 Cb -0.02 -3.84 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 3h60 s VAL 186 CO -0.00 0.19 0.06 0.42 0.00 0.00 0.00 175.10 175.77 3h60 s THR 187 N 0.15 1.20 0.28 3.92 -4.23 -1.26 -4.81 115.64 110.89 3h60 s THR 187 Ca 0.54 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 59.05 3h60 s THR 187 Cb -0.32 -2.71 0.13 0.00 1.34 0.00 0.00 72.50 70.93 3h60 s THR 187 CO 0.35 0.00 1.79 -0.29 -0.54 0.00 0.00 174.62 175.94 3h60 h ILE 188 N 1.97 1.23 -0.23 2.99 -0.00 -1.98 -2.22 117.51 119.27 3h60 h ILE 188 Ca -0.41 -0.95 -0.14 0.00 -0.00 0.00 0.00 64.86 63.37 3h60 h ILE 188 Cb 1.25 0.90 -0.01 0.00 -0.00 0.00 0.00 36.82 38.97 3h60 h ILE 188 CO 0.69 0.33 -0.43 0.77 -0.00 0.00 0.00 178.15 179.51 3h60 h SER 189 N 0.67 0.60 -0.44 2.19 4.64 -1.99 -1.39 113.55 117.82 3h60 h SER 189 Ca 0.13 -0.28 0.05 0.00 -0.47 0.00 0.00 61.79 61.23 3h60 h SER 189 Cb 0.42 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 62.29 3h60 h SER 189 CO 0.02 0.95 0.18 0.15 -0.87 0.00 0.00 176.83 177.26 3h60 h PHE 190 N 0.45 0.33 -0.86 4.77 3.57 -1.86 -0.94 116.94 122.39 3h60 h PHE 190 Ca 0.03 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 3h60 h PHE 190 Cb 0.94 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.56 3h60 h PHE 190 CO 0.04 0.14 0.49 0.52 -2.23 0.00 0.00 178.31 177.27 3h60 h MET 191 N 0.37 1.19 -0.60 1.11 2.86 -1.14 0.96 114.93 119.69 3h60 h MET 191 Ca 0.20 -0.13 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 3h60 h MET 191 Cb 0.17 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 3h60 h MET 191 CO -0.18 0.86 0.05 0.87 1.06 0.00 0.00 176.91 179.56 3h60 h LYS 192 N 1.20 1.03 -0.04 1.72 1.57 -1.02 -1.55 116.57 119.49 3h60 h LYS 192 Ca 0.31 -0.30 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 3h60 h LYS 192 Cb 0.00 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 3h60 h LYS 192 CO -0.05 0.99 -0.70 0.93 -0.57 0.00 0.00 179.45 180.05 3h60 h GLU 193 N 0.93 0.21 -0.34 3.15 5.08 -0.28 -2.72 114.58 120.60 3h60 h GLU 193 Ca 0.18 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3h60 h GLU 193 Cb 0.50 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 3h60 h GLU 193 CO 0.02 0.83 0.20 1.25 -1.00 0.00 0.00 179.01 180.31 3h60 h LEU 194 N 0.14 0.33 -0.56 1.33 5.85 0.12 -1.91 115.31 120.61 3h60 h LEU 194 Ca -0.02 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 3h60 h LEU 194 Cb 1.25 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 3h60 h LEU 194 CO 0.11 0.24 -0.02 0.24 -0.34 0.00 0.00 178.44 178.66 3h60 h MET 195 N 0.41 1.01 -0.36 1.25 2.86 -1.14 -0.99 114.93 117.97 3h60 h MET 195 Ca 0.13 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.43 3h60 h MET 195 Cb -0.01 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 3h60 h MET 195 CO -0.06 1.02 0.21 0.37 1.06 0.00 0.00 176.91 179.51 3h60 h GLN 196 N 0.90 0.50 -0.41 1.72 5.75 -1.48 0.11 115.11 122.19 3h60 h GLN 196 Ca 0.16 -0.05 0.06 0.00 -0.15 0.00 0.00 58.65 58.66 3h60 h GLN 196 Cb 0.58 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.98 3h60 h GLN 196 CO 0.03 0.40 0.12 2.35 -2.65 0.00 0.00 178.83 179.08 3h60 h TRP 197 N 0.47 0.20 -0.46 3.99 2.91 -0.92 -0.31 115.95 121.83 3h60 h TRP 197 Ca 0.13 0.02 -0.10 0.00 1.13 0.00 0.00 58.89 60.07 3h60 h TRP 197 Cb 0.04 -0.03 -0.01 0.00 -0.51 0.00 0.00 29.16 28.64 3h60 h TRP 197 CO -0.03 0.06 -0.11 1.88 -1.03 0.00 0.00 178.44 179.20 3h60 h TYR 198 N 0.26 1.00 -0.96 2.65 0.05 -1.14 -1.84 116.97 117.00 3h60 h TYR 198 Ca 0.20 -0.22 0.13 0.00 0.05 0.00 0.00 58.73 58.89 3h60 h TYR 198 Cb 0.21 -0.24 -0.09 0.00 1.01 0.00 0.00 36.73 37.62 3h60 h TYR 198 CO -0.18 0.98 0.58 -0.22 -1.05 0.00 0.00 178.16 178.28 3h60 h LYS 199 N 0.73 0.87 -0.24 4.88 3.64 -0.24 0.10 116.57 126.31 3h60 h LYS 199 Ca 0.12 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3h60 h LYS 199 Cb 0.66 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3h60 h LYS 199 CO 0.05 0.58 0.00 -0.25 -2.27 0.00 0.00 179.45 177.55 3h60 n ASP 200 N -4.68 0.44 -2.77 4.20 8.00 -0.17 -4.88 116.55 116.69 3h60 n ASP 200 Ca 0.18 -2.01 -0.19 0.00 0.71 0.00 0.00 54.79 53.48 3h60 n ASP 200 Cb 0.37 -0.13 0.05 0.00 -0.02 0.00 0.00 41.12 41.39 3h60 n ASP 200 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h60 n GLN 201 N -0.29 -5.36 -4.18 -1.24 6.02 0.36 -5.02 117.38 107.66 3h60 n GLN 201 Ca 0.01 0.70 -0.22 0.00 -0.01 0.00 0.00 57.00 57.48 3h60 n GLN 201 Cb 0.09 -5.23 -0.05 0.00 1.02 0.00 0.00 30.24 26.07 3h60 n GLN 201 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3h60 s LYS 202 N -5.80 2.66 -0.16 -1.09 1.02 -0.74 -5.02 119.74 110.61 3h60 s LYS 202 Ca 0.37 -1.21 -0.13 0.00 0.02 0.00 0.00 55.97 55.02 3h60 s LYS 202 Cb -0.16 -2.40 -0.05 0.00 -0.52 0.00 0.00 37.83 34.70 3h60 s LYS 202 CO 0.46 0.37 0.27 0.21 -0.92 0.00 0.00 175.35 175.75 3h60 s LYS 203 N -3.78 4.20 0.23 1.68 2.20 -1.26 -4.38 119.74 118.63 3h60 s LYS 203 Ca 0.33 0.05 -0.30 0.00 -0.36 0.00 0.00 55.97 55.69 3h60 s LYS 203 Cb -0.07 -3.41 -0.09 0.00 -1.51 0.00 0.00 37.83 32.75 3h60 s LYS 203 CO 0.23 0.28 1.33 -1.17 -0.36 0.00 0.00 175.35 175.66 3h60 s LEU 204 N 0.34 4.42 0.37 5.43 2.96 -1.26 -4.94 118.68 125.99 3h60 s LEU 204 Ca 0.16 2.49 -0.28 0.00 -0.22 0.00 0.00 54.13 56.28 3h60 s LEU 204 Cb -0.13 -3.62 -0.11 0.00 0.50 0.00 0.00 46.19 42.83 3h60 s LEU 204 CO 0.03 -0.55 1.38 1.57 -1.32 0.00 0.00 176.35 177.46 3h60 n HIS 205 N 2.29 2.58 -0.23 5.38 -0.00 -1.26 -4.77 115.22 119.21 3h60 n HIS 205 Ca 0.05 0.50 0.27 0.00 -0.00 0.00 0.00 57.72 58.54 3h60 n HIS 205 Cb 0.42 -2.46 0.66 0.00 -0.00 0.00 0.00 29.99 28.61 3h60 n HIS 205 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 3h60 h ARG 206 N 2.67 0.13 0.00 1.57 0.11 -1.95 -0.44 114.38 116.46 3h60 h ARG 206 Ca -0.48 -0.01 -0.14 0.00 0.10 0.00 0.00 59.98 59.45 3h60 h ARG 206 Cb 1.27 -0.03 -0.02 0.00 1.11 0.00 0.00 29.97 32.30 3h60 h ARG 206 CO 0.63 0.09 -0.68 0.87 0.10 0.00 0.00 179.97 180.98 3h60 h LYS 207 N 0.13 0.00 -0.13 0.08 1.57 -1.99 -0.02 116.57 116.21 3h60 h LYS 207 Ca 0.48 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.16 3h60 h LYS 207 Cb 1.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.97 3h60 h LYS 207 CO -0.08 0.68 -0.32 0.00 -0.57 0.00 0.00 179.45 179.16 3h60 h ALA 209 N 0.53 0.52 -0.56 0.00 0.00 -1.26 -2.09 119.26 116.40 3h60 h ALA 209 Ca -0.00 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.91 3h60 h ALA 209 Cb 0.93 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 3h60 h ALA 209 CO 0.07 0.02 0.25 -0.92 0.00 0.00 0.00 179.25 178.68 3h60 h TYR 210 N 0.54 0.46 -0.53 0.00 3.20 -1.06 -2.03 116.97 117.55 3h60 h TYR 210 Ca 0.15 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 3h60 h TYR 210 Cb 0.01 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.14 3h60 h TYR 210 CO -0.03 0.19 0.18 1.96 -1.64 0.00 0.00 178.16 178.82 3h60 h GLN 211 N 0.48 0.77 0.06 1.82 4.20 -0.90 -2.36 115.11 119.19 3h60 h GLN 211 Ca 0.26 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 3h60 h GLN 211 Cb 0.23 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.88 3h60 h GLN 211 CO -0.22 0.66 -0.03 0.82 -0.67 0.00 0.00 178.83 179.39 3h60 h ILE 212 N 0.76 1.14 -0.09 2.54 2.04 -1.07 -2.11 117.51 120.73 3h60 h ILE 212 Ca 0.18 -0.70 0.02 0.00 1.00 0.00 0.00 64.86 65.36 3h60 h ILE 212 Cb 0.20 1.60 -0.06 0.00 -0.74 0.00 0.00 36.82 37.82 3h60 h ILE 212 CO -0.01 0.17 -0.49 -0.07 0.00 0.00 0.00 178.15 177.76 3h60 h LEU 213 N -0.39 -1.54 -1.31 1.44 3.38 -1.33 0.19 115.31 115.74 3h60 h LEU 213 Ca -0.01 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3h60 h LEU 213 Cb 0.35 0.59 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 3h60 h LEU 213 CO 0.01 -0.44 0.22 -0.37 0.09 0.00 0.00 178.44 177.95 3h60 h VAL 214 N -0.54 1.17 -0.30 1.22 -1.51 -1.49 0.13 116.25 114.93 3h60 h VAL 214 Ca 0.02 -0.51 -0.14 0.00 -1.23 0.00 0.00 66.70 64.85 3h60 h VAL 214 Cb 0.62 0.56 -0.00 0.00 -2.13 0.00 0.00 31.29 30.34 3h60 h VAL 214 CO -0.37 0.20 -0.34 1.56 -1.23 0.00 0.00 177.57 177.39 3h60 h GLN 215 N 0.69 0.76 -0.15 5.19 4.20 -1.04 -2.97 115.11 121.80 3h60 h GLN 215 Ca 0.17 -0.42 -0.14 0.00 0.06 0.00 0.00 58.65 58.32 3h60 h GLN 215 Cb 0.10 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 3h60 h GLN 215 CO -0.02 1.04 -0.53 -0.24 -0.67 0.00 0.00 178.83 178.42 3h60 h VAL 216 N 0.52 1.34 -0.97 -0.54 3.04 -0.15 -1.78 116.25 117.71 3h60 h VAL 216 Ca 0.04 -1.78 0.19 0.00 -1.01 0.00 0.00 66.70 64.14 3h60 h VAL 216 Cb 0.92 1.80 -0.09 0.00 -2.01 0.00 0.00 31.29 31.91 3h60 h VAL 216 CO 0.08 0.54 0.61 0.50 -1.01 0.00 0.00 177.57 178.30 3h60 h LYS 217 N 0.33 0.63 -0.09 4.17 3.64 -0.79 0.12 116.57 124.57 3h60 h LYS 217 Ca 0.01 -0.04 -0.18 0.00 -1.27 0.00 0.00 60.65 59.18 3h60 h LYS 217 Cb 1.03 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.72 3h60 h LYS 217 CO 0.09 0.42 -0.63 1.49 -2.27 0.00 0.00 179.45 178.55 3h60 h GLU 218 N 0.65 0.59 -0.12 1.90 4.57 -1.17 -1.12 114.58 119.88 3h60 h GLU 218 Ca 0.53 -0.51 0.04 0.00 -1.18 0.00 0.00 59.36 58.24 3h60 h GLU 218 Cb 0.97 0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 29.63 3h60 h GLU 218 CO -0.29 1.13 -0.12 0.28 -1.18 0.00 0.00 179.01 178.84 3h60 h VAL 219 N 0.22 0.67 -0.41 0.32 2.07 -0.89 -3.23 116.25 115.00 3h60 h VAL 219 Ca -0.05 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.36 3h60 h VAL 219 Cb 1.28 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3h60 h VAL 219 CO 0.13 0.00 -0.16 -0.07 0.02 0.00 0.00 177.57 177.48 3h60 h LEU 220 N -0.14 0.86 -2.71 2.57 3.38 -0.74 -2.87 115.31 115.67 3h60 h LEU 220 Ca 0.09 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3h60 h LEU 220 Cb 0.26 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 3h60 h LEU 220 CO -0.21 1.06 0.08 0.77 0.09 0.00 0.00 178.44 180.23 3h60 h SER 221 N 0.66 0.00 0.90 -0.43 4.64 -1.23 -1.26 113.55 116.83 3h60 h SER 221 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3h60 h SER 221 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3h60 h SER 221 CO 0.05 0.00 -0.47 0.29 -0.87 0.00 0.00 176.83 175.84 3h60 n LYS 222 N -3.13 0.21 -2.40 4.77 4.76 -1.08 -4.95 118.16 116.35 3h60 n LYS 222 Ca -0.03 0.08 -0.34 0.00 -2.87 0.00 0.00 58.31 55.16 3h60 n LYS 222 Cb 0.15 -1.66 -0.02 0.00 -1.84 0.00 0.00 35.03 31.67 3h60 n LYS 222 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3h60 s LEU 223 N -3.96 3.77 0.67 -0.35 1.43 -0.48 -5.04 118.68 114.73 3h60 s LEU 223 Ca 0.08 1.99 -0.15 0.00 -1.03 0.00 0.00 54.13 55.02 3h60 s LEU 223 Cb 0.14 -4.56 0.01 0.00 0.03 0.00 0.00 46.19 41.81 3h60 s LEU 223 CO 0.68 -0.96 1.12 -0.55 0.23 0.00 0.00 176.35 176.87 3h60 s SER 224 N -2.02 4.96 0.45 2.29 0.15 -1.26 -4.92 113.70 113.35 3h60 s SER 224 Ca 0.68 2.04 0.14 0.00 0.70 0.00 0.00 55.95 59.52 3h60 s SER 224 Cb -0.18 -2.56 1.07 0.00 -1.71 0.00 0.00 66.02 62.64 3h60 s SER 224 CO 0.24 -1.73 2.01 0.74 1.20 0.00 0.00 173.24 175.69 3h60 h THR 225 N -0.05 0.91 -3.59 6.45 2.02 -1.85 -3.37 112.91 113.43 3h60 h THR 225 Ca -0.47 -0.12 -0.70 0.00 0.77 0.00 0.00 66.41 65.89 3h60 h THR 225 Cb 1.25 0.54 -0.28 0.00 -1.74 0.00 0.00 68.15 67.92 3h60 h THR 225 CO 0.53 0.06 -0.55 -0.22 0.37 0.00 0.00 175.52 175.71 3h60 s LEU 226 N -9.27 4.65 0.01 2.58 2.96 -1.26 -0.80 118.68 117.55 3h60 s LEU 226 Ca -0.07 -1.27 -0.30 0.00 -0.22 0.00 0.00 54.13 52.27 3h60 s LEU 226 Cb 0.19 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.92 3h60 s LEU 226 CO 0.74 -0.40 1.04 -0.69 -1.32 0.00 0.00 176.35 175.71 3h60 s VAL 227 N 1.42 4.65 -0.21 1.68 1.01 0.24 -4.93 120.40 124.26 3h60 s VAL 227 Ca 0.01 1.90 -0.01 0.00 0.00 0.00 0.00 61.98 63.88 3h60 s VAL 227 Cb -0.21 -4.22 0.02 0.00 0.00 0.00 0.00 36.38 31.97 3h60 s VAL 227 CO 0.03 0.14 -0.11 -1.61 0.00 0.00 0.00 175.10 173.54 3h60 s GLU 228 N 1.07 3.02 -0.06 2.72 2.02 -1.26 -0.31 118.70 125.90 3h60 s GLU 228 Ca 0.54 -0.84 0.04 0.00 0.02 0.00 0.00 54.97 54.73 3h60 s GLU 228 Cb -0.23 -2.82 -0.02 0.00 0.10 0.00 0.00 34.13 31.16 3h60 s GLU 228 CO 0.28 -0.27 -0.17 0.99 0.02 0.00 0.00 175.26 176.10 3h60 s THR 229 N 1.34 2.78 -0.20 3.63 2.01 0.47 -4.97 115.64 120.70 3h60 s THR 229 Ca 0.03 -0.81 -0.07 0.00 0.31 0.00 0.00 61.69 61.14 3h60 s THR 229 Cb -0.15 -2.08 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 3h60 s THR 229 CO -0.08 0.57 0.07 -0.89 -0.69 0.00 0.00 174.62 173.61 3h60 s THR 230 N -0.43 4.68 -0.30 -0.82 2.01 -1.26 -0.86 115.64 118.65 3h60 s THR 230 Ca 0.05 -0.06 -0.09 0.00 0.31 0.00 0.00 61.69 61.89 3h60 s THR 230 Cb -0.12 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 69.25 3h60 s THR 230 CO 0.02 0.42 0.14 -0.76 -0.69 0.00 0.00 174.62 173.75 3h60 s LEU 231 N 0.75 4.04 1.02 4.42 1.02 -1.26 -4.97 118.68 123.69 3h60 s LEU 231 Ca 0.04 -0.48 -0.12 0.00 0.02 0.00 0.00 54.13 53.59 3h60 s LEU 231 Cb -0.13 -2.00 0.20 0.00 0.02 0.00 0.00 46.19 44.28 3h60 s LEU 231 CO 0.02 -0.17 1.08 -0.54 0.02 0.00 0.00 176.35 176.75 3h60 s LYS 232 N 1.62 0.27 0.37 1.70 1.02 -1.26 -4.42 119.74 119.04 3h60 s LYS 232 Ca 0.05 0.84 0.07 0.00 0.02 0.00 0.00 55.97 56.94 3h60 s LYS 232 Cb -0.17 -1.69 0.77 0.00 -0.52 0.00 0.00 37.83 36.22 3h60 s LYS 232 CO 0.06 -2.92 1.97 1.49 -0.92 0.00 0.00 175.35 175.03 3h60 h GLU 233 N -2.04 0.69 -0.61 1.68 4.81 -1.97 -0.98 114.58 116.17 3h60 h GLU 233 Ca -0.54 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 3h60 h GLU 233 Cb 1.31 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.53 3h60 h GLU 233 CO 0.52 0.46 0.00 0.25 -0.73 0.00 0.00 179.01 179.51 3h60 n THR 234 N -4.48 0.81 -3.78 0.32 -2.24 -1.26 -2.45 114.28 101.20 3h60 n THR 234 Ca 0.10 -0.85 -0.36 0.00 -2.27 0.00 0.00 64.05 60.67 3h60 n THR 234 Cb 0.22 0.53 -0.06 0.00 -2.10 0.00 0.00 70.33 68.93 3h60 n THR 234 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h60 s GLU 235 N -1.19 3.57 0.31 -0.78 2.02 -0.38 -4.94 118.70 117.31 3h60 s GLU 235 Ca 0.43 -0.04 0.10 0.00 0.02 0.00 0.00 54.97 55.49 3h60 s GLU 235 Cb 0.23 -3.15 -0.05 0.00 0.10 0.00 0.00 34.13 31.26 3h60 s GLU 235 CO 0.31 0.71 -0.09 -1.59 0.02 0.00 0.00 175.26 174.62 3h60 s LYS 236 N -1.38 1.92 -0.04 1.61 -2.85 -1.26 -0.99 119.74 116.75 3h60 s LYS 236 Ca 0.22 -1.75 -0.12 0.00 -1.00 0.00 0.00 55.97 53.32 3h60 s LYS 236 Cb -0.13 -1.86 0.02 0.00 -2.06 0.00 0.00 37.83 33.80 3h60 s LYS 236 CO 0.11 0.23 0.27 -1.50 0.10 0.00 0.00 175.35 174.56 3h60 s ILE 237 N -2.51 0.05 -0.19 3.79 2.07 -0.16 -4.34 121.20 119.91 3h60 s ILE 237 Ca 0.32 -0.39 -0.05 0.00 -1.41 0.00 0.00 60.65 59.12 3h60 s ILE 237 Cb -0.02 -0.52 -0.03 0.00 0.13 0.00 0.00 42.46 42.02 3h60 s ILE 237 CO 0.17 -0.21 0.00 -0.89 -1.91 0.00 0.00 174.94 172.10 3h60 s THR 238 N -0.92 4.09 -0.22 4.00 2.01 -0.65 -0.88 115.64 123.06 3h60 s THR 238 Ca -0.10 -0.27 -0.04 0.00 0.31 0.00 0.00 61.69 61.58 3h60 s THR 238 Cb -0.05 -2.84 -0.01 0.00 0.01 0.00 0.00 72.50 69.61 3h60 s THR 238 CO 0.03 0.44 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.69 3h60 s VAL 239 N 0.77 3.56 0.06 3.82 1.01 0.39 -0.32 120.40 129.69 3h60 s VAL 239 Ca 0.00 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.58 3h60 s VAL 239 Cb -0.14 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 3h60 s VAL 239 CO 0.02 0.41 0.04 0.00 0.00 0.00 0.00 175.10 175.57 3h60 n GLY 241 N 0.75 1.42 3.64 0.00 0.00 -1.26 -1.06 105.19 108.68 3h60 n GLY 241 Ca -0.11 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 3h60 n GLY 241 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h60 n ASP 242 N 0.00 1.91 -0.01 1.61 9.92 -1.26 -4.18 116.55 124.54 3h60 n ASP 242 Ca 0.00 1.16 -0.01 0.00 -0.53 0.00 0.00 54.79 55.41 3h60 n ASP 242 Cb 0.00 -1.39 -0.02 0.00 -0.64 0.00 0.00 41.12 39.07 3h60 n ASP 242 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3h60 n THR 243 N 0.10 0.17 -3.83 -3.53 -2.24 -0.64 -1.44 114.28 102.87 3h60 n THR 243 Ca 0.07 -0.11 -0.34 0.00 -2.27 0.00 0.00 64.05 61.41 3h60 n THR 243 Cb 0.35 -0.88 0.03 0.00 -2.10 0.00 0.00 70.33 67.73 3h60 n THR 243 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3h60 n HIS 244 N -2.07 -1.73 -1.39 4.78 8.25 0.30 -1.98 115.22 121.37 3h60 n HIS 244 Ca -0.04 0.41 -0.14 0.00 -0.26 0.00 0.00 57.72 57.69 3h60 n HIS 244 Cb 0.56 -3.32 -0.06 0.00 1.12 0.00 0.00 29.99 28.30 3h60 n HIS 244 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h60 n GLY 245 N -1.84 1.29 2.81 -1.41 0.00 -0.07 -1.68 105.19 104.29 3h60 n GLY 245 Ca -0.13 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 3h60 n GLY 245 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h60 n GLN 246 N -1.20 3.41 -0.37 1.61 6.02 -0.84 -1.71 117.38 124.30 3h60 n GLN 246 Ca -0.14 -3.25 0.05 0.00 -0.01 0.00 0.00 57.00 53.65 3h60 n GLN 246 Cb 0.62 -3.03 0.21 0.00 1.02 0.00 0.00 30.24 29.06 3h60 n GLN 246 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 3h60 h PHE 247 N 5.79 1.17 0.00 1.08 3.57 -1.87 -1.26 116.94 125.43 3h60 h PHE 247 Ca 0.45 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.90 3h60 h PHE 247 Cb 0.63 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 3h60 h PHE 247 CO 1.32 0.53 -0.38 1.88 -2.23 0.00 0.00 178.31 179.43 3h60 h TYR 248 N 1.08 0.00 -0.04 0.41 -1.99 -1.91 -1.70 116.97 112.82 3h60 h TYR 248 Ca 0.47 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 61.01 3h60 h TYR 248 Cb 0.34 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 3h60 h TYR 248 CO -0.00 0.38 -0.80 -0.44 -0.00 0.00 0.00 178.16 177.30 3h60 h ASP 249 N 0.00 0.40 -0.49 3.88 3.32 -1.64 -2.27 116.42 119.63 3h60 h ASP 249 Ca -0.00 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.70 3h60 h ASP 249 Cb 0.72 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 3h60 h ASP 249 CO 0.05 1.04 0.06 0.25 -1.72 0.00 0.00 179.24 178.92 3h60 h LEU 250 N 0.20 0.80 -1.31 1.55 5.85 -0.93 -0.65 115.31 120.83 3h60 h LEU 250 Ca -0.04 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 3h60 h LEU 250 Cb 1.39 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 3h60 h LEU 250 CO 0.13 0.87 0.36 -0.07 -0.34 0.00 0.00 178.44 179.39 3h60 h LEU 251 N 0.69 0.73 -0.69 2.25 3.38 -1.29 -2.24 115.31 118.14 3h60 h LEU 251 Ca 0.15 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3h60 h LEU 251 Cb 0.43 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 3h60 h LEU 251 CO 0.01 0.57 0.17 -1.13 0.09 0.00 0.00 178.44 178.16 3h60 h ASN 252 N 0.85 1.04 -0.30 -0.43 -1.24 -0.98 -1.24 115.58 113.27 3h60 h ASN 252 Ca 0.22 -0.23 0.06 0.00 0.71 0.00 0.00 56.30 57.06 3h60 h ASN 252 Cb -0.02 -0.27 -0.06 0.00 0.73 0.00 0.00 38.32 38.70 3h60 h ASN 252 CO -0.04 1.00 -0.06 0.40 -1.29 0.00 0.00 177.43 177.43 3h60 h ILE 253 N 1.03 0.71 0.00 2.57 2.04 -0.77 0.35 117.51 123.44 3h60 h ILE 253 Ca 0.22 -0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.02 3h60 h ILE 253 Cb 0.36 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3h60 h ILE 253 CO 0.00 0.00 -0.22 -0.26 0.00 0.00 0.00 178.15 177.67 3h60 h PHE 254 N 0.01 0.00 -0.09 1.37 0.04 -0.94 -0.04 116.94 117.30 3h60 h PHE 254 Ca 0.14 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 3h60 h PHE 254 Cb 0.22 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.36 3h60 h PHE 254 CO -0.28 0.22 -0.02 0.93 -0.60 0.00 0.00 178.31 178.57 3h60 h GLU 255 N 0.00 0.17 -0.34 1.51 5.08 -0.48 0.21 114.58 120.73 3h60 h GLU 255 Ca -0.00 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 3h60 h GLU 255 Cb 0.47 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3h60 h GLU 255 CO 0.03 0.48 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.29 3h60 h LEU 256 N -0.14 0.61 -0.90 1.33 3.38 -0.70 -3.32 115.31 115.57 3h60 h LEU 256 Ca 0.02 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3h60 h LEU 256 Cb 0.41 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3h60 h LEU 256 CO 0.01 0.78 -0.01 -3.20 0.09 0.00 0.00 178.44 176.11 3h60 n ASN 257 N -4.16 0.97 0.00 -0.43 5.15 -0.05 -5.10 115.26 111.64 3h60 n ASN 257 Ca 0.01 -0.99 0.00 0.00 -0.60 0.00 0.00 54.58 53.00 3h60 n ASN 257 Cb 0.36 0.16 0.00 0.00 -0.53 0.00 0.00 39.78 39.77 3h60 n ASN 257 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h60 n GLY 258 N 0.25 -0.70 3.75 8.20 0.00 0.73 -4.97 105.19 112.45 3h60 n GLY 258 Ca 0.01 -1.56 -0.36 0.00 0.00 0.00 0.00 46.02 44.11 3h60 n GLY 258 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h60 s LEU 259 N -2.06 3.63 0.60 0.99 1.43 -1.21 -4.59 118.68 117.47 3h60 s LEU 259 Ca 0.00 2.42 -0.20 0.00 -1.03 0.00 0.00 54.13 55.32 3h60 s LEU 259 Cb 0.00 -4.60 -0.03 0.00 0.03 0.00 0.00 46.19 41.59 3h60 s LEU 259 CO 0.00 -1.69 1.31 -2.65 0.23 0.00 0.00 176.35 173.55 3h60 n PRO 260 N -1.71 1.38 -2.75 1.29 -0.02 -1.26 -4.76 135.00 127.17 3h60 n PRO 260 Ca 0.14 0.52 -0.05 0.00 -2.02 0.00 0.00 63.50 62.09 3h60 n PRO 260 Cb 0.49 -2.54 0.02 0.00 -0.02 0.00 0.00 33.50 31.45 3h60 n PRO 260 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3h60 n SER 261 N -1.43 -1.34 0.25 2.55 3.41 -0.96 -4.90 113.62 111.20 3h60 n SER 261 Ca 0.13 -1.89 0.17 0.00 -0.26 0.00 0.00 58.87 57.02 3h60 n SER 261 Cb 0.46 2.22 0.74 0.00 -0.26 0.00 0.00 64.21 67.38 3h60 n SER 261 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3h60 h GLU 262 N 0.00 0.00 -0.01 4.33 3.07 -1.94 -2.71 114.58 117.32 3h60 h GLU 262 Ca -0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.66 3h60 h GLU 262 Cb 0.75 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 3h60 h GLU 262 CO 0.25 0.00 -0.33 0.25 -1.40 0.00 0.00 179.01 177.78 3h60 n THR 263 N -2.84 0.00 -3.38 1.13 -2.24 -1.26 -4.68 114.28 101.01 3h60 n THR 263 Ca 0.00 -0.33 -0.26 0.00 -2.27 0.00 0.00 64.05 61.18 3h60 n THR 263 Cb 0.22 1.16 -0.08 0.00 -2.10 0.00 0.00 70.33 69.53 3h60 n THR 263 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3h60 n ASN 264 N -0.26 2.70 -4.81 3.42 4.05 -1.02 -4.79 115.26 114.56 3h60 n ASN 264 Ca 0.06 -3.22 -0.33 0.00 0.45 0.00 0.00 54.58 51.54 3h60 n ASN 264 Cb 0.30 -0.66 -0.03 0.00 1.23 0.00 0.00 39.78 40.62 3h60 n ASN 264 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3h60 s PRO 265 N -2.05 3.76 0.11 1.20 0.05 -1.22 -2.27 135.00 134.57 3h60 s PRO 265 Ca 0.38 1.23 0.07 0.00 0.05 0.00 0.00 61.00 62.73 3h60 s PRO 265 Cb 0.15 -2.10 -0.04 0.00 0.05 0.00 0.00 34.50 32.56 3h60 s PRO 265 CO -0.05 -0.45 -0.18 0.71 0.05 0.00 0.00 177.00 177.08 3h60 s TYR 266 N -2.23 1.63 -0.11 0.56 1.51 -0.46 -1.64 117.35 116.62 3h60 s TYR 266 Ca 0.64 -0.46 0.01 0.00 -1.01 0.00 0.00 57.07 56.26 3h60 s TYR 266 Cb -0.14 -0.87 0.02 0.00 -0.11 0.00 0.00 41.96 40.85 3h60 s TYR 266 CO 0.25 0.19 -0.14 0.42 -1.11 0.00 0.00 175.55 175.16 3h60 s ILE 267 N -1.50 1.41 -0.22 2.71 -1.09 0.57 -0.59 121.20 122.50 3h60 s ILE 267 Ca 0.07 -0.58 -0.05 0.00 -2.23 0.00 0.00 60.65 57.85 3h60 s ILE 267 Cb -0.08 -1.31 -0.02 0.00 -1.58 0.00 0.00 42.46 39.47 3h60 s ILE 267 CO 0.04 0.43 -0.00 -0.36 -1.23 0.00 0.00 174.94 173.82 3h60 s PHE 268 N 1.08 3.01 -0.94 3.97 0.40 0.22 -0.44 117.98 125.29 3h60 s PHE 268 Ca -0.05 -0.65 -0.03 0.00 -0.60 0.00 0.00 56.93 55.60 3h60 s PHE 268 Cb -0.14 -2.13 0.22 0.00 0.51 0.00 0.00 43.02 41.47 3h60 s PHE 268 CO -0.03 -0.40 2.23 -1.71 0.70 0.00 0.00 175.22 176.01 3h60 n ASN 269 N 4.66 7.39 -0.19 1.36 5.15 -0.22 -1.11 115.26 132.30 3h60 n ASN 269 Ca -0.17 -3.48 0.03 0.00 -0.60 0.00 0.00 54.58 50.35 3h60 n ASN 269 Cb 0.51 -1.21 -0.01 0.00 -0.53 0.00 0.00 39.78 38.55 3h60 n ASN 269 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h60 n GLY 270 N 0.49 -2.22 3.75 8.20 0.00 -0.68 -4.51 105.19 110.23 3h60 n GLY 270 Ca 0.53 -1.49 -0.22 0.00 0.00 0.00 0.00 46.02 44.84 3h60 n GLY 270 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h60 n ASP 271 N -1.40 -1.11 0.14 1.61 9.92 -1.26 -4.08 116.55 120.36 3h60 n ASP 271 Ca 0.00 -0.85 0.01 0.00 -0.53 0.00 0.00 54.79 53.42 3h60 n ASP 271 Cb 0.08 -3.87 0.12 0.00 -0.64 0.00 0.00 41.12 36.81 3h60 n ASP 271 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 3h60 h PHE 272 N -1.87 0.00 -0.52 1.24 0.04 -1.93 0.11 116.94 114.01 3h60 h PHE 272 Ca -0.61 0.00 -0.67 0.00 2.80 0.00 0.00 57.97 59.48 3h60 h PHE 272 Cb 1.36 0.00 -0.13 0.00 2.20 0.00 0.00 35.95 39.38 3h60 h PHE 272 CO 0.47 0.57 -0.52 0.14 -0.60 0.00 0.00 178.31 178.37 3h60 s VAL 273 N -3.19 1.23 0.08 -0.55 -7.23 -1.26 -0.89 120.40 108.59 3h60 s VAL 273 Ca 0.02 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 3h60 s VAL 273 Cb 0.10 -2.24 0.00 0.00 0.56 0.00 0.00 36.38 34.79 3h60 s VAL 273 CO 0.74 0.00 0.00 0.47 -0.31 0.00 0.00 175.10 176.00 3h60 n ASP 274 N -1.24 -1.10 0.00 4.85 8.00 -1.26 -4.55 116.55 121.26 3h60 n ASP 274 Ca -0.18 0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.55 3h60 n ASP 274 Cb 0.67 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 3h60 n ASP 274 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3h60 n ARG 275 N -2.05 0.00 -2.14 -1.24 1.74 0.41 -4.06 116.66 109.32 3h60 n ARG 275 Ca -0.01 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.75 3h60 n ARG 275 Cb 0.08 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.52 3h60 n ARG 275 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3h60 s GLY 276 N 0.00 2.03 -0.03 -0.13 0.00 -0.68 -0.53 107.32 107.99 3h60 s GLY 276 Ca 0.00 0.25 0.20 0.00 0.00 0.00 0.00 44.72 45.17 3h60 s GLY 276 CO 0.00 0.54 1.53 1.44 0.00 0.00 0.00 173.10 176.61 3h60 n SER 277 N -1.99 4.02 -1.47 1.64 7.64 -1.25 -3.57 113.62 118.65 3h60 n SER 277 Ca 0.08 -2.10 -0.12 0.00 1.01 0.00 0.00 58.87 57.73 3h60 n SER 277 Cb 0.53 -0.48 0.13 0.00 -1.01 0.00 0.00 64.21 63.38 3h60 n SER 277 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3h60 n PHE 278 N 1.40 1.66 -0.34 1.43 3.72 -0.70 -4.82 117.46 119.82 3h60 n PHE 278 Ca 0.23 -1.94 0.01 0.00 -0.05 0.00 0.00 57.45 55.70 3h60 n PHE 278 Cb 0.66 -0.51 0.15 0.00 -0.94 0.00 0.00 39.48 38.84 3h60 n PHE 278 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3h60 h SER 279 N 1.47 0.94 -0.13 4.37 0.02 -1.62 -1.40 113.55 117.21 3h60 h SER 279 Ca 0.28 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 61.14 3h60 h SER 279 Cb 1.43 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 3h60 h SER 279 CO 0.57 0.61 -0.22 0.58 -1.14 0.00 0.00 176.83 177.23 3h60 h VAL 280 N 1.09 1.26 -0.11 2.27 2.07 -1.92 -1.49 116.25 119.42 3h60 h VAL 280 Ca 0.39 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 3h60 h VAL 280 Cb 0.13 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3h60 h VAL 280 CO -0.16 0.41 -0.07 -0.33 0.02 0.00 0.00 177.57 177.44 3h60 h GLU 281 N 0.50 0.25 -0.23 1.57 3.07 -1.80 -2.82 114.58 115.11 3h60 h GLU 281 Ca 0.08 -0.11 0.06 0.00 -0.50 0.00 0.00 59.36 58.88 3h60 h GLU 281 Cb 0.66 -0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.50 3h60 h GLU 281 CO 0.05 0.61 -0.28 0.28 -1.40 0.00 0.00 179.01 178.26 3h60 h VAL 282 N -0.12 0.33 -0.39 3.13 2.07 -1.18 -2.53 116.25 117.56 3h60 h VAL 282 Ca 0.02 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.48 3h60 h VAL 282 Cb 0.54 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3h60 h VAL 282 CO 0.02 0.00 0.01 -0.29 0.02 0.00 0.00 177.57 177.33 3h60 h ILE 283 N -0.30 1.26 -0.07 4.57 6.09 -1.18 -0.81 117.51 127.07 3h60 h ILE 283 Ca 0.13 -0.98 -0.15 0.00 -1.37 0.00 0.00 64.86 62.49 3h60 h ILE 283 Cb 0.50 1.13 -0.01 0.00 0.47 0.00 0.00 36.82 38.91 3h60 h ILE 283 CO -0.40 0.33 -0.62 -0.07 -3.07 0.00 0.00 178.15 174.33 3h60 h LEU 284 N 0.51 0.27 -0.24 2.19 3.38 -1.57 0.12 115.31 119.97 3h60 h LEU 284 Ca 0.11 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.94 3h60 h LEU 284 Cb 0.46 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3h60 h LEU 284 CO 0.02 0.82 0.13 0.74 0.09 0.00 0.00 178.44 180.24 3h60 h THR 285 N 0.17 1.01 -0.37 0.22 2.02 -1.28 0.41 112.91 115.10 3h60 h THR 285 Ca -0.01 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 3h60 h THR 285 Cb 1.13 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 3h60 h THR 285 CO 0.10 0.05 0.17 -0.07 0.37 0.00 0.00 175.52 176.14 3h60 h LEU 286 N 0.27 0.49 -0.78 2.58 3.38 -0.86 -1.55 115.31 118.85 3h60 h LEU 286 Ca 0.09 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3h60 h LEU 286 Cb 0.01 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3h60 h LEU 286 CO -0.05 0.49 0.10 -0.26 0.09 0.00 0.00 178.44 178.81 3h60 h PHE 287 N 0.46 1.09 -0.49 1.13 0.04 -0.66 -0.43 116.94 118.07 3h60 h PHE 287 Ca 0.13 -0.14 0.02 0.00 2.80 0.00 0.00 57.97 60.78 3h60 h PHE 287 Cb 0.13 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 37.95 3h60 h PHE 287 CO -0.01 0.92 0.29 0.78 -0.60 0.00 0.00 178.31 179.68 3h60 h GLY 288 N 1.04 0.69 1.86 -1.45 0.00 0.10 -1.07 103.07 104.23 3h60 h GLY 288 Ca 0.19 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 3h60 h GLY 288 CO 0.01 0.18 -0.27 0.74 0.00 0.00 0.00 176.54 177.20 3h60 h PHE 289 N 0.58 0.18 -0.50 5.60 0.04 -0.98 -0.79 116.94 121.07 3h60 h PHE 289 Ca 0.20 -0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.90 3h60 h PHE 289 Cb 0.02 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 3h60 h PHE 289 CO -0.07 0.43 0.16 -0.22 -0.60 0.00 0.00 178.31 178.01 3h60 h LYS 290 N 0.15 0.78 -0.63 1.51 1.63 -0.45 -0.46 116.57 119.09 3h60 h LYS 290 Ca 0.02 -0.16 -0.08 0.00 -0.85 0.00 0.00 60.65 59.58 3h60 h LYS 290 Cb 0.57 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.06 3h60 h LYS 290 CO 0.04 0.72 0.07 -0.07 -3.45 0.00 0.00 179.45 176.76 3h60 h LEU 291 N 0.68 1.02 -0.06 5.20 3.38 -0.98 -1.82 115.31 122.72 3h60 h LEU 291 Ca 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3h60 h LEU 291 Cb 0.26 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 3h60 h LEU 291 CO -0.01 1.03 -0.00 0.25 0.09 0.00 0.00 178.44 179.80 3h60 h LEU 292 N 0.98 0.11 -6.40 1.67 5.85 -0.94 -3.35 115.31 113.23 3h60 h LEU 292 Ca 0.19 -0.32 -0.60 0.00 0.84 0.00 0.00 57.88 57.99 3h60 h LEU 292 Cb 0.47 -0.03 -0.42 0.00 0.37 0.00 0.00 40.66 41.05 3h60 h LEU 292 CO 0.02 0.40 -0.64 -1.22 -0.34 0.00 0.00 178.44 176.66 3h60 n TYR 293 N -4.86 3.12 -0.13 1.25 4.01 -0.20 -4.95 117.16 115.40 3h60 n TYR 293 Ca -0.07 -4.13 0.18 0.00 -0.16 0.00 0.00 57.90 53.72 3h60 n TYR 293 Cb 0.19 -0.54 0.57 0.00 -0.31 0.00 0.00 39.34 39.25 3h60 n TYR 293 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3h60 h PRO 294 N 4.50 0.27 -0.01 -0.72 0.13 -1.48 -1.47 132.00 133.23 3h60 h PRO 294 Ca 0.18 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3h60 h PRO 294 Cb 0.71 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.78 3h60 h PRO 294 CO 0.77 0.18 -0.16 -0.25 -0.23 0.00 0.00 178.00 178.31 3h60 n ASP 295 N -4.44 0.84 -0.00 1.44 8.00 -1.26 -4.27 116.55 116.86 3h60 n ASP 295 Ca 0.14 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.78 3h60 n ASP 295 Cb 0.59 0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 3h60 n ASP 295 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3h60 n HIS 296 N -0.67 0.00 -3.77 1.24 8.25 -0.80 -4.99 115.22 114.48 3h60 n HIS 296 Ca 0.14 -0.12 -0.26 0.00 -0.26 0.00 0.00 57.72 57.22 3h60 n HIS 296 Cb 0.31 -0.01 -0.17 0.00 1.12 0.00 0.00 29.99 31.24 3h60 n HIS 296 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 3h60 s PHE 297 N -0.24 1.03 -0.04 4.41 5.36 -0.62 -1.35 117.98 126.53 3h60 s PHE 297 Ca 0.00 -0.68 0.05 0.00 -0.96 0.00 0.00 56.93 55.35 3h60 s PHE 297 Cb 0.00 -1.01 -0.01 0.00 -0.34 0.00 0.00 43.02 41.67 3h60 s PHE 297 CO 0.00 -0.52 -0.20 -1.01 -1.46 0.00 0.00 175.22 172.03 3h60 s HIS 298 N 1.85 1.91 -0.08 10.12 3.76 0.25 -4.75 115.29 128.35 3h60 s HIS 298 Ca 0.01 -0.52 0.03 0.00 -0.15 0.00 0.00 55.06 54.43 3h60 s HIS 298 Cb -0.15 -1.27 0.01 0.00 1.11 0.00 0.00 32.58 32.28 3h60 s HIS 298 CO -0.07 -0.16 -0.18 -0.51 -0.85 0.00 0.00 174.74 172.97 3h60 s LEU 299 N -0.10 1.87 0.08 0.89 1.43 -1.26 0.70 118.68 122.29 3h60 s LEU 299 Ca -0.02 -0.44 0.08 0.00 -1.03 0.00 0.00 54.13 52.72 3h60 s LEU 299 Cb -0.11 -1.13 -0.04 0.00 0.03 0.00 0.00 46.19 44.94 3h60 s LEU 299 CO 0.02 0.10 -0.16 -0.76 0.23 0.00 0.00 176.35 175.78 3h60 s LEU 300 N 0.52 2.76 0.27 1.79 1.43 -0.27 -4.20 118.68 120.99 3h60 s LEU 300 Ca -0.16 -0.45 -0.29 0.00 -1.03 0.00 0.00 54.13 52.19 3h60 s LEU 300 Cb -0.17 -1.61 -0.10 0.00 0.03 0.00 0.00 46.19 44.35 3h60 s LEU 300 CO 0.06 0.21 1.26 -0.60 0.23 0.00 0.00 176.35 177.52 3h60 s ARG 301 N -1.86 4.43 0.39 1.70 3.52 -0.21 -1.69 118.95 125.23 3h60 s ARG 301 Ca 0.17 2.07 0.08 0.00 -0.13 0.00 0.00 55.73 57.92 3h60 s ARG 301 Cb -0.11 -3.14 -0.03 0.00 -1.56 0.00 0.00 34.95 30.11 3h60 s ARG 301 CO 0.09 -0.12 0.30 0.20 -0.81 0.00 0.00 175.30 174.96 3h60 s GLY 302 N -0.27 2.06 0.60 8.12 0.00 -1.26 -4.38 107.32 112.19 3h60 s GLY 302 Ca 0.51 -1.86 0.32 0.00 0.00 0.00 0.00 44.72 43.69 3h60 s GLY 302 CO 0.45 -1.71 2.26 3.45 0.00 0.00 0.00 173.10 177.55 3h60 h ASN 303 N 1.19 0.00 0.22 1.64 -1.07 -1.95 -1.44 115.58 114.17 3h60 h ASN 303 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.94 3h60 h ASN 303 Cb 1.26 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.51 3h60 h ASN 303 CO 0.60 0.01 -0.06 1.41 0.07 0.00 0.00 177.43 179.46 3h60 n HIS 304 N -3.70 0.00 -1.84 4.14 8.25 -1.26 -3.93 115.22 116.87 3h60 n HIS 304 Ca -0.03 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.08 3h60 n HIS 304 Cb 0.10 -0.11 -0.02 0.00 1.12 0.00 0.00 29.99 31.07 3h60 n HIS 304 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3h60 n GLU 305 N -0.78 3.80 -3.84 -0.41 4.71 -0.54 -4.59 120.64 118.99 3h60 n GLU 305 Ca 0.17 -3.13 -0.10 0.00 -0.01 0.00 0.00 57.16 54.10 3h60 n GLU 305 Cb 0.25 -2.43 -0.08 0.00 -1.01 0.00 0.00 31.44 28.17 3h60 n GLU 305 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 3h60 s THR 306 N -1.84 0.12 0.06 2.62 -4.23 -1.25 -4.73 115.64 106.40 3h60 s THR 306 Ca 0.55 -1.03 -0.29 0.00 -1.18 0.00 0.00 61.69 59.74 3h60 s THR 306 Cb 0.26 -1.14 -0.18 0.00 1.34 0.00 0.00 72.50 72.79 3h60 s THR 306 CO -0.15 -0.57 1.58 0.44 -0.54 0.00 0.00 174.62 175.38 3h60 h ASP 307 N 3.05 -0.51 -0.76 3.99 3.32 -1.92 -1.56 116.42 122.04 3h60 h ASP 307 Ca -0.33 -0.02 0.14 0.00 0.02 0.00 0.00 57.03 56.84 3h60 h ASP 307 Cb 1.20 0.13 -0.14 0.00 0.22 0.00 0.00 39.33 40.74 3h60 h ASP 307 CO 0.52 -0.31 -0.30 0.78 -1.72 0.00 0.00 179.24 178.21 3h60 h ASN 308 N -0.66 -1.07 -0.41 6.45 2.35 -1.98 -0.24 115.58 120.01 3h60 h ASN 308 Ca -0.06 0.25 -0.15 0.00 -0.55 0.00 0.00 56.30 55.79 3h60 h ASN 308 Cb 0.49 0.59 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 3h60 h ASN 308 CO 0.10 -0.29 -0.33 0.24 -1.65 0.00 0.00 177.43 175.51 3h60 h MET 309 N -0.07 0.95 -0.62 0.81 2.86 -1.84 -3.13 114.93 113.91 3h60 h MET 309 Ca 0.32 -0.47 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 3h60 h MET 309 Cb 0.58 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.21 3h60 h MET 309 CO -0.81 1.13 0.35 -0.91 1.06 0.00 0.00 176.91 177.74 3h60 h ASN 310 N 0.79 0.74 -0.40 1.22 -0.26 -0.22 0.15 115.58 117.60 3h60 h ASN 310 Ca 0.08 -0.05 -0.09 0.00 -0.56 0.00 0.00 56.30 55.68 3h60 h ASN 310 Cb 0.92 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.97 3h60 h ASN 310 CO 0.09 0.59 -0.07 1.56 -1.06 0.00 0.00 177.43 178.53 3h60 h GLN 311 N 0.85 0.84 0.13 0.81 1.08 -1.03 -2.44 115.11 115.35 3h60 h GLN 311 Ca 0.22 -0.27 -0.35 0.00 -1.45 0.00 0.00 58.65 56.80 3h60 h GLN 311 Cb -0.00 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 3h60 h GLN 311 CO -0.04 0.89 -1.87 0.82 -0.95 0.00 0.00 178.83 177.68 3h60 h ILE 312 N 0.76 0.77 -0.58 2.54 2.04 -1.44 -3.42 117.51 118.19 3h60 h ILE 312 Ca 0.13 -2.45 0.00 0.00 1.00 0.00 0.00 64.86 63.54 3h60 h ILE 312 Cb 0.56 2.60 0.00 0.00 -0.74 0.00 0.00 36.82 39.24 3h60 h ILE 312 CO 0.03 0.85 0.00 -1.22 0.00 0.00 0.00 178.15 177.82 3h60 n TYR 313 N -3.48 1.11 0.00 1.37 4.01 0.00 -4.86 117.16 115.31 3h60 n TYR 313 Ca -0.27 -0.59 0.00 0.00 -0.16 0.00 0.00 57.90 56.88 3h60 n TYR 313 Cb 1.06 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.94 3h60 n TYR 313 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h60 n GLY 314 N 0.99 2.69 0.26 2.72 0.00 -1.21 -0.45 105.19 110.19 3h60 n GLY 314 Ca 0.22 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.38 3h60 n GLY 314 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3h60 h PHE 315 N 0.00 1.08 -0.19 1.61 3.57 -1.86 0.19 116.94 121.34 3h60 h PHE 315 Ca 0.00 -0.31 0.02 0.00 3.53 0.00 0.00 57.97 61.21 3h60 h PHE 315 Cb 0.00 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.49 3h60 h PHE 315 CO 0.00 1.12 0.06 1.49 -2.23 0.00 0.00 178.31 178.75 3h60 h GLU 316 N 0.73 0.15 -0.47 1.11 4.81 -1.78 -1.67 114.58 117.46 3h60 h GLU 316 Ca 0.07 -0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.39 3h60 h GLU 316 Cb 0.91 -0.03 -0.09 0.00 0.63 0.00 0.00 28.75 30.17 3h60 h GLU 316 CO 0.08 0.10 -0.10 0.78 -0.73 0.00 0.00 179.01 179.14 3h60 h GLY 317 N 0.15 0.36 0.87 1.92 0.00 -1.68 -0.39 103.07 104.31 3h60 h GLY 317 Ca 0.08 0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.57 3h60 h GLY 317 CO -0.08 -0.17 -0.02 -2.09 0.00 0.00 0.00 176.54 174.17 3h60 h GLU 318 N 0.01 -0.00 -0.60 4.80 4.81 -0.41 -1.17 114.58 122.03 3h60 h GLU 318 Ca 0.23 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.38 3h60 h GLU 318 Cb 0.35 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 3h60 h GLU 318 CO -0.47 -0.00 0.05 0.28 -0.73 0.00 0.00 179.01 178.14 3h60 h VAL 319 N -0.00 1.26 -0.70 0.32 2.07 -1.16 -0.78 116.25 117.25 3h60 h VAL 319 Ca 0.03 -1.05 -0.04 0.00 0.82 0.00 0.00 66.70 66.46 3h60 h VAL 319 Cb 0.05 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 3h60 h VAL 319 CO -0.06 0.38 0.30 0.11 0.02 0.00 0.00 177.57 178.32 3h60 h LYS 320 N 0.93 1.02 -0.05 1.57 1.57 -0.94 0.81 116.57 121.48 3h60 h LYS 320 Ca 0.18 -0.16 -0.19 0.00 -1.87 0.00 0.00 60.65 58.60 3h60 h LYS 320 Cb 0.47 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 3h60 h LYS 320 CO 0.02 0.82 -0.78 0.00 -0.57 0.00 0.00 179.45 178.93 3h60 h ALA 321 N 1.32 0.55 0.00 3.86 0.00 -0.87 -3.30 119.26 120.82 3h60 h ALA 321 Ca 0.24 -0.64 -0.29 0.00 0.00 0.00 0.00 54.91 54.22 3h60 h ALA 321 Cb 0.17 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 3h60 h ALA 321 CO -0.02 0.79 -1.71 1.63 0.00 0.00 0.00 179.25 179.94 3h60 n LYS 322 N -3.80 0.63 0.00 0.00 5.02 -0.33 -5.00 118.16 114.69 3h60 n LYS 322 Ca -0.05 0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 3h60 n LYS 322 Cb 0.74 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 3h60 n LYS 322 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3h60 n TYR 323 N -3.06 0.00 -4.28 2.13 4.01 0.28 -5.03 117.16 111.21 3h60 n TYR 323 Ca -0.17 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.40 3h60 n TYR 323 Cb 1.05 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.99 3h60 n TYR 323 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3h60 s THR 324 N 3.12 0.15 0.21 -0.72 -4.23 -1.13 -4.68 115.64 108.36 3h60 s THR 324 Ca 0.00 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.42 3h60 s THR 324 Cb 0.00 -2.51 0.16 0.00 1.34 0.00 0.00 72.50 71.49 3h60 s THR 324 CO 0.00 0.00 1.81 0.00 -0.54 0.00 0.00 174.62 175.89 3h60 h ALA 325 N 2.31 1.01 -0.65 3.99 0.00 -1.87 -1.78 119.26 122.28 3h60 h ALA 325 Ca -0.32 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.48 3h60 h ALA 325 Cb 1.24 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 3h60 h ALA 325 CO 0.48 0.55 0.43 1.96 0.00 0.00 0.00 179.25 182.67 3h60 h GLN 326 N 1.10 0.75 -0.32 0.00 4.20 -1.98 -0.81 115.11 118.06 3h60 h GLN 326 Ca 0.27 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.81 3h60 h GLN 326 Cb 0.08 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 3h60 h GLN 326 CO -0.04 0.50 -0.28 1.98 -0.67 0.00 0.00 178.83 180.32 3h60 h MET 327 N 0.78 0.76 -0.45 1.46 4.05 -1.85 -2.33 114.93 117.35 3h60 h MET 327 Ca 0.26 -0.39 0.07 0.00 -0.28 0.00 0.00 59.70 59.36 3h60 h MET 327 Cb 0.06 0.01 -0.06 0.00 -0.80 0.00 0.00 31.60 30.80 3h60 h MET 327 CO -0.07 1.01 0.09 -0.92 0.23 0.00 0.00 176.91 177.25 3h60 h TYR 328 N 0.52 0.14 -0.30 1.39 3.20 -0.47 -1.82 116.97 119.65 3h60 h TYR 328 Ca 0.06 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 3h60 h TYR 328 Cb 0.85 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.11 3h60 h TYR 328 CO 0.07 0.00 -0.06 0.93 -1.64 0.00 0.00 178.16 177.46 3h60 h GLU 329 N 0.22 0.47 -0.20 1.82 4.39 -1.13 -1.51 114.58 118.64 3h60 h GLU 329 Ca 0.22 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 3h60 h GLU 329 Cb 0.28 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 3h60 h GLU 329 CO -0.29 0.55 0.10 1.25 -1.16 0.00 0.00 179.01 179.46 3h60 h LEU 330 N 0.45 0.26 -0.43 1.33 5.85 -0.98 -1.99 115.31 119.80 3h60 h LEU 330 Ca 0.09 -0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.78 3h60 h LEU 330 Cb 0.39 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.28 3h60 h LEU 330 CO 0.02 0.31 -0.02 -0.26 -0.34 0.00 0.00 178.44 178.14 3h60 h PHE 331 N 0.20 -0.07 -0.47 1.25 0.04 -0.65 -1.38 116.94 115.86 3h60 h PHE 331 Ca 0.07 0.03 0.09 0.00 2.80 0.00 0.00 57.97 60.97 3h60 h PHE 331 Cb 0.11 0.09 -0.10 0.00 2.20 0.00 0.00 35.95 38.26 3h60 h PHE 331 CO -0.03 -0.11 -0.25 1.03 -0.60 0.00 0.00 178.31 178.36 3h60 h SER 332 N 0.09 -0.85 -0.20 2.17 0.87 -1.14 0.84 113.55 115.33 3h60 h SER 332 Ca 0.21 0.18 -0.04 0.00 -1.23 0.00 0.00 61.79 60.91 3h60 h SER 332 Cb 0.31 0.44 -0.02 0.00 -0.44 0.00 0.00 62.40 62.70 3h60 h SER 332 CO -0.37 -0.27 0.01 -0.33 -0.53 0.00 0.00 176.83 175.34 3h60 h GLU 333 N -0.15 0.47 -0.19 2.24 5.08 -0.78 -2.58 114.58 118.67 3h60 h GLU 333 Ca 0.22 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.28 3h60 h GLU 333 Cb 0.49 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.67 3h60 h GLU 333 CO -0.56 0.48 -0.70 0.28 -1.00 0.00 0.00 179.01 177.52 3h60 h VAL 334 N 0.45 1.29 -0.84 3.13 2.07 -0.15 -3.20 116.25 119.00 3h60 h VAL 334 Ca 0.10 -1.91 0.06 0.00 0.82 0.00 0.00 66.70 65.78 3h60 h VAL 334 Cb 0.28 1.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.87 3h60 h VAL 334 CO 0.01 0.61 0.55 -0.26 0.02 0.00 0.00 177.57 178.49 3h60 h PHE 335 N 0.55 0.95 -0.37 1.57 0.04 -0.54 -1.91 116.94 117.24 3h60 h PHE 335 Ca -0.03 0.02 0.11 0.00 2.80 0.00 0.00 57.97 60.87 3h60 h PHE 335 Cb 1.31 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 39.13 3h60 h PHE 335 CO 0.08 0.50 0.28 0.93 -0.60 0.00 0.00 178.31 179.50 3h60 h GLU 336 N 0.94 0.00 0.00 1.51 5.08 -1.46 -1.77 114.58 118.88 3h60 h GLU 336 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3h60 h GLU 336 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3h60 h GLU 336 CO -0.13 0.00 -0.33 0.91 -1.00 0.00 0.00 179.01 178.46 3h60 n TRP 337 N -4.28 0.03 -1.66 4.33 7.02 -0.72 -3.54 117.44 118.62 3h60 n TRP 337 Ca 0.06 0.01 -0.48 0.00 -1.02 0.00 0.00 57.50 56.07 3h60 n TRP 337 Cb 0.46 -0.36 -0.05 0.00 -2.42 0.00 0.00 31.31 28.95 3h60 n TRP 337 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3h60 n LEU 338 N -1.53 2.94 -4.54 -0.99 4.77 -0.67 -4.54 117.00 112.44 3h60 n LEU 338 Ca 0.06 1.06 -0.31 0.00 -0.03 0.00 0.00 56.01 56.79 3h60 n LEU 338 Cb 0.34 -1.37 0.17 0.00 -2.33 0.00 0.00 43.42 40.23 3h60 n LEU 338 CO 0.32 -0.35 0.36 -2.65 -1.33 0.00 0.00 177.39 173.74 3h60 n PRO 339 N 4.12 -0.79 -0.01 3.23 -0.02 -1.26 -4.52 135.00 135.75 3h60 n PRO 339 Ca 0.19 -0.18 0.09 0.00 -2.02 0.00 0.00 63.50 61.58 3h60 n PRO 339 Cb 0.27 -2.16 -0.15 0.00 -0.02 0.00 0.00 33.50 31.44 3h60 n PRO 339 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3h60 n LEU 340 N -3.38 0.00 -3.45 2.45 4.77 0.02 -1.04 117.00 116.36 3h60 n LEU 340 Ca 0.08 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.93 3h60 n LEU 340 Cb 0.53 0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.61 3h60 n LEU 340 CO 0.51 0.02 0.41 0.00 -1.33 0.00 0.00 177.39 176.99 3h60 s ALA 341 N -3.32 -1.64 -0.01 -1.18 0.00 -1.10 -4.43 121.76 110.07 3h60 s ALA 341 Ca -0.07 0.72 0.02 0.00 0.00 0.00 0.00 51.96 52.62 3h60 s ALA 341 Cb 0.12 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.88 3h60 s ALA 341 CO 0.81 -0.66 -0.05 -1.14 0.00 0.00 0.00 175.76 174.73 3h60 s GLN 342 N -3.03 0.47 -0.12 0.00 0.74 -0.43 -0.59 119.66 116.72 3h60 s GLN 342 Ca -0.02 -0.17 0.03 0.00 0.05 0.00 0.00 55.36 55.25 3h60 s GLN 342 Cb -0.01 -0.48 0.01 0.00 1.10 0.00 0.00 33.01 33.63 3h60 s GLN 342 CO -0.06 0.08 -0.23 0.00 -0.55 0.00 0.00 175.29 174.52 3h60 s ILE 344 N 0.58 4.37 -1.24 0.00 -1.09 0.43 -0.39 121.20 123.85 3h60 s ILE 344 Ca -0.13 -0.17 0.00 0.00 -2.23 0.00 0.00 60.65 58.12 3h60 s ILE 344 Cb -0.17 -3.01 0.00 0.00 -1.58 0.00 0.00 42.46 37.71 3h60 s ILE 344 CO 0.04 0.39 0.00 0.59 -1.23 0.00 0.00 174.94 174.73 3h60 n ASN 345 N 4.39 -4.29 -1.34 3.58 4.13 -0.04 -1.08 115.26 120.60 3h60 n ASN 345 Ca -0.16 0.17 -0.16 0.00 1.68 0.00 0.00 54.58 56.10 3h60 n ASN 345 Cb 0.52 -3.65 -0.07 0.00 -1.54 0.00 0.00 39.78 35.03 3h60 n ASN 345 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h60 n GLY 346 N -0.80 1.55 0.00 7.41 0.00 -1.26 -4.80 105.19 107.29 3h60 n GLY 346 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3h60 n GLY 346 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h60 n LYS 347 N -1.83 1.93 -4.05 1.61 4.76 -0.24 -4.49 118.16 115.85 3h60 n LYS 347 Ca -0.16 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 54.94 3h60 n LYS 347 Cb 0.59 -0.88 -0.15 0.00 -1.84 0.00 0.00 35.03 32.75 3h60 n LYS 347 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3h60 s VAL 348 N -1.76 2.49 -0.18 -0.18 1.01 -0.82 -0.11 120.40 120.84 3h60 s VAL 348 Ca 0.00 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.03 3h60 s VAL 348 Cb 0.00 -2.12 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 3h60 s VAL 348 CO 0.00 0.45 0.10 -0.22 0.00 0.00 0.00 175.10 175.43 3h60 s LEU 349 N 1.33 4.05 -0.09 3.92 2.96 -0.99 -0.43 118.68 129.44 3h60 s LEU 349 Ca 0.04 0.19 0.04 0.00 -0.22 0.00 0.00 54.13 54.18 3h60 s LEU 349 Cb -0.14 -2.03 -0.00 0.00 0.50 0.00 0.00 46.19 44.52 3h60 s LEU 349 CO -0.09 0.20 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.27 3h60 s ILE 350 N 0.24 2.03 0.08 6.68 1.01 0.90 -1.12 121.20 131.01 3h60 s ILE 350 Ca 0.07 -1.01 -0.16 0.00 0.00 0.00 0.00 60.65 59.54 3h60 s ILE 350 Cb -0.12 -1.74 0.03 0.00 0.01 0.00 0.00 42.46 40.64 3h60 s ILE 350 CO -0.01 0.55 0.38 0.00 0.00 0.00 0.00 174.94 175.87 3h60 s MET 351 N 0.25 0.97 0.06 2.79 0.23 -0.95 -1.31 119.30 121.34 3h60 s MET 351 Ca -0.16 -0.55 -0.32 0.00 -1.03 0.00 0.00 55.69 53.63 3h60 s MET 351 Cb -0.17 0.43 -0.18 0.00 -1.53 0.00 0.00 34.83 33.37 3h60 s MET 351 CO 0.08 -0.35 1.56 1.25 -2.03 0.00 0.00 175.02 175.53 3h60 h HIS 352 N 2.75 -0.80 0.00 3.16 2.76 -1.76 -3.29 115.15 117.97 3h60 h HIS 352 Ca -0.33 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.83 3h60 h HIS 352 Cb 1.22 0.26 0.00 0.00 1.55 0.00 0.00 27.41 30.45 3h60 h HIS 352 CO 0.38 -0.48 0.00 0.41 -1.30 0.00 0.00 177.93 176.94 3h60 n GLY 353 N -1.32 -0.38 0.00 5.26 0.00 0.90 -0.42 105.19 109.22 3h60 n GLY 353 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3h60 n GLY 353 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h60 n GLY 354 N 1.81 -0.81 0.00 -0.02 0.00 -1.08 -4.58 105.19 100.50 3h60 n GLY 354 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3h60 n GLY 354 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h60 n LEU 355 N 0.00 0.00 -4.74 0.99 4.77 -1.26 -4.16 117.00 112.60 3h60 n LEU 355 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 3h60 n LEU 355 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 3h60 n LEU 355 CO 0.00 -0.05 -0.20 -0.36 -1.33 0.00 0.00 177.39 175.45 3h60 s PHE 356 N 1.18 2.77 -2.43 -1.77 0.08 -1.26 -4.51 117.98 112.03 3h60 s PHE 356 Ca 0.00 -0.32 0.25 0.00 0.12 0.00 0.00 56.93 56.98 3h60 s PHE 356 Cb 0.00 -1.57 0.89 0.00 -0.57 0.00 0.00 43.02 41.77 3h60 s PHE 356 CO 0.00 0.38 1.64 -1.13 -0.10 0.00 0.00 175.22 176.01 3h60 n SER 357 N -1.14 1.67 -4.08 1.36 3.41 -1.26 -4.80 113.62 108.77 3h60 n SER 357 Ca -0.04 -1.61 -0.17 0.00 -0.26 0.00 0.00 58.87 56.79 3h60 n SER 357 Cb 0.60 -0.05 -0.13 0.00 -0.26 0.00 0.00 64.21 64.38 3h60 n SER 357 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3h60 s GLU 358 N -1.90 0.68 0.61 4.33 8.01 -1.26 -5.11 118.70 124.06 3h60 s GLU 358 Ca 0.35 -0.67 -0.16 0.00 0.01 0.00 0.00 54.97 54.51 3h60 s GLU 358 Cb 0.20 -0.60 -0.03 0.00 -4.31 0.00 0.00 34.13 29.39 3h60 s GLU 358 CO 0.30 0.14 1.08 -0.51 0.01 0.00 0.00 175.26 176.28 3h60 s ASP 359 N -1.16 5.58 0.00 -0.19 1.01 -1.26 -4.39 116.67 116.27 3h60 s ASP 359 Ca -0.03 1.90 0.00 0.00 0.71 0.00 0.00 52.55 55.13 3h60 s ASP 359 Cb -0.08 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.31 3h60 s ASP 359 CO 0.01 -1.30 0.00 0.61 0.21 0.00 0.00 175.17 174.69 3h60 n GLY 360 N -0.74 0.74 3.76 0.21 0.00 -1.26 -5.05 105.19 102.84 3h60 n GLY 360 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3h60 n GLY 360 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h60 s VAL 361 N -2.10 3.20 0.38 1.61 1.01 -1.26 -5.03 120.40 118.21 3h60 s VAL 361 Ca 0.00 1.14 0.08 0.00 0.00 0.00 0.00 61.98 63.20 3h60 s VAL 361 Cb 0.00 -3.73 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 3h60 s VAL 361 CO 0.00 0.25 0.10 0.42 0.00 0.00 0.00 175.10 175.86 3h60 s THR 362 N -0.81 2.50 0.43 3.92 -4.23 -1.26 -4.96 115.64 111.22 3h60 s THR 362 Ca 0.49 -1.82 0.09 0.00 -1.18 0.00 0.00 61.69 59.26 3h60 s THR 362 Cb -0.35 -2.92 0.27 0.00 1.34 0.00 0.00 72.50 70.84 3h60 s THR 362 CO 0.44 -0.10 2.06 -0.07 -0.54 0.00 0.00 174.62 176.41 3h60 h LEU 363 N 1.61 0.40 -0.58 4.79 3.38 -1.95 -1.36 115.31 121.60 3h60 h LEU 363 Ca -0.43 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.38 3h60 h LEU 363 Cb 1.25 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3h60 h LEU 363 CO 0.69 0.28 -0.67 -0.78 0.09 0.00 0.00 178.44 178.05 3h60 h ASP 364 N 0.47 0.22 -0.95 -0.43 3.58 -1.99 -1.30 116.42 116.02 3h60 h ASP 364 Ca 0.14 -0.14 0.02 0.00 0.42 0.00 0.00 57.03 57.48 3h60 h ASP 364 Cb 0.00 -0.06 -0.05 0.00 1.72 0.00 0.00 39.33 40.94 3h60 h ASP 364 CO -0.03 0.83 0.63 0.44 -2.88 0.00 0.00 179.24 178.22 3h60 h ASP 365 N 0.13 1.06 -0.36 2.28 3.32 -1.67 -1.84 116.42 119.35 3h60 h ASP 365 Ca -0.01 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 3h60 h ASP 365 Cb 1.21 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.49 3h60 h ASP 365 CO 0.10 0.75 0.09 0.40 -1.72 0.00 0.00 179.24 178.86 3h60 h ILE 366 N 1.24 1.22 -0.72 0.35 2.04 -0.85 -2.69 117.51 118.10 3h60 h ILE 366 Ca 0.36 -0.76 0.08 0.00 1.00 0.00 0.00 64.86 65.54 3h60 h ILE 366 Cb -0.07 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 3h60 h ILE 366 CO -0.10 0.26 0.48 -0.09 0.00 0.00 0.00 178.15 178.69 3h60 h ARG 367 N 0.43 0.69 -0.00 2.37 2.43 -0.89 -1.73 114.38 117.68 3h60 h ARG 367 Ca 0.11 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3h60 h ARG 367 Cb 0.30 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3h60 h ARG 367 CO 0.00 0.45 -0.34 1.63 -1.51 0.00 0.00 179.97 180.21 3h60 n LYS 368 N -4.49 0.09 -1.73 0.20 5.02 -0.72 -4.19 118.16 112.33 3h60 n LYS 368 Ca 0.11 -0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.94 3h60 n LYS 368 Cb 0.27 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.76 3h60 n LYS 368 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3h60 n ILE 369 N -1.42 1.36 -3.34 -0.18 5.41 -0.65 -4.92 119.36 115.62 3h60 n ILE 369 Ca 0.07 -0.34 -0.45 0.00 1.00 0.00 0.00 62.75 63.02 3h60 n ILE 369 Cb 0.33 -1.83 -0.05 0.00 -0.71 0.00 0.00 39.64 37.38 3h60 n ILE 369 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 3h60 s GLU 370 N -1.03 2.94 0.00 0.38 2.12 -1.26 -4.73 118.70 117.12 3h60 s GLU 370 Ca 0.61 -1.72 0.23 0.00 0.36 0.00 0.00 54.97 54.45 3h60 s GLU 370 Cb -0.53 -4.26 0.12 0.00 0.26 0.00 0.00 34.13 29.72 3h60 s GLU 370 CO 0.54 -1.31 1.15 2.89 -0.54 0.00 0.00 175.26 177.98 3h60 n ARG 371 N 5.20 0.30 -2.14 4.30 1.85 -1.26 -4.72 116.66 120.18 3h60 n ARG 371 Ca -0.13 -0.22 -0.42 0.00 -1.00 0.00 0.00 57.85 56.08 3h60 n ARG 371 Cb 0.40 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 30.31 3h60 n ARG 371 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 3h60 n ASN 372 N -1.16 4.27 -3.67 2.89 6.94 -1.23 -4.73 115.26 118.57 3h60 n ASN 372 Ca 0.06 -2.86 -0.04 0.00 -0.02 0.00 0.00 54.58 51.73 3h60 n ASN 372 Cb 0.36 -1.68 -0.01 0.00 -2.36 0.00 0.00 39.78 36.08 3h60 n ASN 372 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3h60 s ARG 373 N 4.02 0.93 0.18 -3.83 1.70 -1.26 -5.01 118.95 115.67 3h60 s ARG 373 Ca 0.52 -0.48 -0.30 0.00 -0.47 0.00 0.00 55.73 55.01 3h60 s ARG 373 Cb 0.08 0.34 -0.07 0.00 -0.57 0.00 0.00 34.95 34.72 3h60 s ARG 373 CO 0.02 -0.42 1.01 -0.65 -1.08 0.00 0.00 175.30 174.18 3h60 s GLN 374 N -3.05 4.70 0.73 3.89 -1.52 -1.26 -4.76 119.66 118.39 3h60 s GLN 374 Ca 0.11 1.57 -0.15 0.00 -1.95 0.00 0.00 55.36 54.94 3h60 s GLN 374 Cb -0.00 -3.31 0.04 0.00 -0.22 0.00 0.00 33.01 29.52 3h60 s GLN 374 CO -0.01 0.25 1.19 -1.25 -0.25 0.00 0.00 175.29 175.22 3h60 s PRO 375 N -0.53 2.15 0.92 2.91 0.04 -1.26 -5.00 135.00 134.23 3h60 s PRO 375 Ca 0.46 1.71 -0.13 0.00 0.04 0.00 0.00 61.00 63.09 3h60 s PRO 375 Cb -0.27 -1.84 0.15 0.00 0.04 0.00 0.00 34.50 32.58 3h60 s PRO 375 CO 0.33 -1.81 1.15 -1.25 0.04 0.00 0.00 177.00 175.45 3h60 s PRO 376 N -3.96 1.02 0.64 0.56 0.04 -1.26 -4.94 135.00 127.09 3h60 s PRO 376 Ca 0.73 0.23 0.41 0.00 0.04 0.00 0.00 61.00 62.41 3h60 s PRO 376 Cb -0.28 -1.83 2.16 0.00 0.04 0.00 0.00 34.50 34.59 3h60 s PRO 376 CO 0.45 -2.27 2.29 -0.44 0.04 0.00 0.00 177.00 177.08 3h60 h ASP 377 N -1.55 0.00 -5.01 6.66 3.32 -2.01 -3.40 116.42 114.42 3h60 h ASP 377 Ca -0.50 0.00 0.07 0.00 0.02 0.00 0.00 57.03 56.62 3h60 h ASP 377 Cb 1.33 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.82 3h60 h ASP 377 CO 0.59 0.01 0.24 -0.94 -1.72 0.00 0.00 179.24 177.42 3h60 s SER 378 N -5.39 -0.27 0.00 6.45 1.04 -1.26 -4.61 113.70 109.66 3h60 s SER 378 Ca -0.04 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 55.83 3h60 s SER 378 Cb 0.13 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.96 3h60 s SER 378 CO 0.45 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 173.98 3h60 n GLY 379 N -0.46 1.08 0.20 7.32 0.00 -1.26 -4.53 105.19 107.55 3h60 n GLY 379 Ca -0.05 -2.06 -0.02 0.00 0.00 0.00 0.00 46.02 43.90 3h60 n GLY 379 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h60 h PRO 380 N 0.00 0.26 -0.59 1.61 0.13 -1.99 -1.28 132.00 130.14 3h60 h PRO 380 Ca 0.00 -0.02 0.05 0.00 -0.87 0.00 0.00 66.00 65.16 3h60 h PRO 380 Cb 0.00 -0.06 -0.05 0.00 0.13 0.00 0.00 31.00 31.03 3h60 h PRO 380 CO 0.00 0.17 0.32 1.98 -0.23 0.00 0.00 178.00 180.24 3h60 h MET 381 N 0.27 0.60 0.17 0.86 1.85 -1.96 -0.93 114.93 115.78 3h60 h MET 381 Ca 0.26 -0.04 -0.01 0.00 -0.61 0.00 0.00 59.70 59.31 3h60 h MET 381 Cb 0.34 -0.14 0.00 0.00 0.43 0.00 0.00 31.60 32.24 3h60 h MET 381 CO -0.32 0.40 -0.08 0.00 -0.40 0.00 0.00 176.91 176.50 3h60 h ASP 383 N -0.28 0.13 -0.91 0.00 3.32 -1.03 -1.51 116.42 116.14 3h60 h ASP 383 Ca -0.02 0.06 0.18 0.00 0.02 0.00 0.00 57.03 57.26 3h60 h ASP 383 Cb 0.22 0.05 -0.10 0.00 0.22 0.00 0.00 39.33 39.71 3h60 h ASP 383 CO 0.04 0.11 0.49 -0.07 -1.72 0.00 0.00 179.24 178.09 3h60 h LEU 384 N 0.31 0.58 0.00 1.55 3.38 -1.15 -1.89 115.31 118.09 3h60 h LEU 384 Ca 0.21 0.10 -0.20 0.00 0.09 0.00 0.00 57.88 58.08 3h60 h LEU 384 Cb 0.22 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3h60 h LEU 384 CO -0.23 0.20 -0.99 -0.07 0.09 0.00 0.00 178.44 177.44 3h60 h LEU 385 N 0.63 0.00 0.00 1.67 3.38 -1.33 0.26 115.31 119.92 3h60 h LEU 385 Ca 0.52 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.49 3h60 h LEU 385 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3h60 h LEU 385 CO -0.40 0.95 -0.82 0.79 0.09 0.00 0.00 178.44 179.06 3h60 n TRP 386 N -3.32 0.00 -2.10 1.13 7.02 -0.62 -3.79 117.44 115.76 3h60 n TRP 386 Ca -0.01 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.17 3h60 n TRP 386 Cb 0.93 -0.02 -0.00 0.00 -2.42 0.00 0.00 31.31 29.80 3h60 n TRP 386 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 3h60 s SER 387 N -1.87 6.33 0.06 -0.99 1.04 -0.74 -4.80 113.70 112.73 3h60 s SER 387 Ca -0.00 1.39 0.05 0.00 0.48 0.00 0.00 55.95 57.86 3h60 s SER 387 Cb 0.01 -2.45 -0.03 0.00 0.10 0.00 0.00 66.02 63.65 3h60 s SER 387 CO 0.04 -0.76 -0.13 -1.81 0.98 0.00 0.00 173.24 171.56 3h60 s ASP 388 N -3.89 1.51 0.50 7.02 1.01 -0.98 -3.63 116.67 118.21 3h60 s ASP 388 Ca 0.55 -0.57 -0.20 0.00 0.71 0.00 0.00 52.55 53.04 3h60 s ASP 388 Cb -0.11 -0.04 -0.07 0.00 1.01 0.00 0.00 42.92 43.70 3h60 s ASP 388 CO 0.47 -0.08 1.08 -2.16 0.21 0.00 0.00 175.17 174.70 3h60 s PRO 389 N -1.57 3.66 0.24 8.23 0.04 -1.26 -1.33 135.00 143.01 3h60 s PRO 389 Ca -0.03 1.50 0.08 0.00 0.04 0.00 0.00 61.00 62.60 3h60 s PRO 389 Cb -0.09 -2.12 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 3h60 s PRO 389 CO 0.02 -0.57 -0.13 1.14 0.04 0.00 0.00 177.00 177.50 3h60 s GLN 390 N -3.15 1.47 0.24 4.56 -2.07 0.13 -4.70 119.66 116.13 3h60 s GLN 390 Ca 0.68 -1.69 0.09 0.00 -1.82 0.00 0.00 55.36 52.63 3h60 s GLN 390 Cb -0.21 -1.25 0.22 0.00 -1.09 0.00 0.00 33.01 30.69 3h60 s GLN 390 CO 0.24 0.16 1.53 -1.00 -1.32 0.00 0.00 175.29 174.91 3h60 h PRO 391 N 2.41 0.02 -6.25 9.60 0.13 -1.98 -3.35 132.00 132.59 3h60 h PRO 391 Ca -0.39 -0.02 -0.56 0.00 -0.87 0.00 0.00 66.00 64.16 3h60 h PRO 391 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 3h60 h PRO 391 CO 0.63 0.72 -0.27 1.14 -0.23 0.00 0.00 178.00 179.99 3h60 s GLN 392 N -3.43 3.62 0.56 0.86 0.00 -1.26 -4.51 119.66 115.50 3h60 s GLN 392 Ca -0.01 -0.08 -0.20 0.00 -0.00 0.00 0.00 55.36 55.06 3h60 s GLN 392 Cb 0.12 -2.80 -0.06 0.00 0.00 0.00 0.00 33.01 30.28 3h60 s GLN 392 CO 0.78 0.41 1.11 0.09 0.00 0.00 0.00 175.29 177.67 3h60 n ASN 393 N -0.20 1.49 0.00 12.60 3.02 -1.26 -3.93 115.26 126.98 3h60 n ASN 393 Ca -0.02 0.89 0.00 0.00 -0.03 0.00 0.00 54.58 55.42 3h60 n ASN 393 Cb 0.52 -1.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.25 3h60 n ASN 393 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h60 n GLY 394 N 1.09 0.12 3.04 7.41 0.00 -1.26 -4.83 105.19 110.77 3h60 n GLY 394 Ca 0.12 -2.25 -0.16 0.00 0.00 0.00 0.00 46.02 43.73 3h60 n GLY 394 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h60 s ARG 395 N 0.00 0.60 0.13 1.61 0.52 -1.26 0.01 118.95 120.56 3h60 s ARG 395 Ca 0.00 -0.53 0.09 0.00 -0.52 0.00 0.00 55.73 54.77 3h60 s ARG 395 Cb 0.00 -0.51 -0.04 0.00 0.52 0.00 0.00 34.95 34.92 3h60 s ARG 395 CO 0.00 0.12 -0.22 -1.12 0.02 0.00 0.00 175.30 174.11 3h60 s SER 396 N -0.88 2.80 0.20 0.23 0.01 -0.50 -4.97 113.70 110.58 3h60 s SER 396 Ca -0.02 -0.75 -0.32 0.00 1.31 0.00 0.00 55.95 56.17 3h60 s SER 396 Cb -0.06 -0.17 -0.12 0.00 0.21 0.00 0.00 66.02 65.88 3h60 s SER 396 CO 0.00 0.07 1.71 -0.63 0.41 0.00 0.00 173.24 174.80 3h60 s ILE 397 N -1.36 2.15 0.27 1.44 1.01 -1.26 0.07 121.20 123.52 3h60 s ILE 397 Ca 0.11 0.08 -0.29 0.00 0.00 0.00 0.00 60.65 60.55 3h60 s ILE 397 Cb -0.09 -3.05 -0.10 0.00 0.01 0.00 0.00 42.46 39.23 3h60 s ILE 397 CO 0.06 0.01 1.29 -0.55 0.00 0.00 0.00 174.94 175.74 3h60 s SER 398 N 1.28 6.88 0.02 3.58 0.15 -1.08 -4.61 113.70 119.92 3h60 s SER 398 Ca 0.75 2.52 0.10 0.00 0.70 0.00 0.00 55.95 60.02 3h60 s SER 398 Cb -0.49 -2.63 0.42 0.00 -1.71 0.00 0.00 66.02 61.61 3h60 s SER 398 CO 0.32 -0.49 1.31 2.29 1.20 0.00 0.00 173.24 177.87 3h60 n LYS 399 N 1.63 0.01 0.04 5.44 2.85 -1.26 -1.58 118.16 125.29 3h60 n LYS 399 Ca 0.03 0.36 0.13 0.00 -1.05 0.00 0.00 58.31 57.77 3h60 n LYS 399 Cb 0.42 -1.52 0.51 0.00 -0.65 0.00 0.00 35.03 33.79 3h60 n LYS 399 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3h60 n ARG 400 N -1.54 0.10 -0.65 -1.58 1.74 -1.26 -4.91 116.66 108.56 3h60 n ARG 400 Ca 0.02 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 3h60 n ARG 400 Cb 0.11 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 3h60 n ARG 400 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h60 n GLY 401 N 1.15 0.73 3.35 -0.13 0.00 -0.61 -5.04 105.19 104.64 3h60 n GLY 401 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 3h60 n GLY 401 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h60 s VAL 402 N -2.47 0.02 0.00 1.61 0.11 -1.26 -5.01 120.40 113.40 3h60 s VAL 402 Ca 0.00 -0.17 0.00 0.00 -2.93 0.00 0.00 61.98 58.88 3h60 s VAL 402 Cb 0.00 -0.71 0.00 0.00 -1.53 0.00 0.00 36.38 34.14 3h60 s VAL 402 CO 0.00 -0.09 0.00 -0.24 -3.33 0.00 0.00 175.10 171.44 3h60 n SER 403 N 1.88 -0.21 -4.11 3.54 2.88 -1.26 -4.58 113.62 111.76 3h60 n SER 403 Ca -0.17 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.26 3h60 n SER 403 Cb 0.56 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.94 3h60 n SER 403 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h60 s GLN 405 N -4.09 3.55 -0.07 0.00 -0.21 0.11 -2.31 119.66 116.65 3h60 s GLN 405 Ca 0.30 -0.07 0.04 0.00 0.02 0.00 0.00 55.36 55.66 3h60 s GLN 405 Cb 0.04 -3.13 -0.00 0.00 1.00 0.00 0.00 33.01 30.92 3h60 s GLN 405 CO 0.09 0.70 -0.21 -0.59 -2.12 0.00 0.00 175.29 173.17 3h60 s PHE 406 N -1.19 2.17 0.89 0.91 -0.71 -0.44 -1.41 117.98 118.20 3h60 s PHE 406 Ca 0.23 -0.78 -0.11 0.00 -1.04 0.00 0.00 56.93 55.22 3h60 s PHE 406 Cb -0.13 -1.46 0.18 0.00 -1.21 0.00 0.00 43.02 40.40 3h60 s PHE 406 CO 0.12 -0.30 1.23 0.20 -1.34 0.00 0.00 175.22 175.13 3h60 s GLY 407 N 0.24 1.78 0.53 1.99 0.00 0.10 -0.69 107.32 111.27 3h60 s GLY 407 Ca -0.12 -1.39 0.30 0.00 0.00 0.00 0.00 44.72 43.51 3h60 s GLY 407 CO 0.06 -0.67 2.05 -0.56 0.00 0.00 0.00 173.10 173.98 3h60 h PRO 408 N -1.32 0.00 -0.41 2.90 0.13 -1.75 -1.78 132.00 129.77 3h60 h PRO 408 Ca -0.42 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.63 3h60 h PRO 408 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 3h60 h PRO 408 CO 0.38 0.10 -0.09 0.38 -0.23 0.00 0.00 178.00 178.53 3h60 h ASP 409 N 0.00 0.71 -0.44 1.44 2.03 -1.91 -1.35 116.42 116.90 3h60 h ASP 409 Ca -0.00 -0.20 -0.04 0.00 -0.73 0.00 0.00 57.03 56.06 3h60 h ASP 409 Cb 0.39 -0.19 -0.02 0.00 -0.83 0.00 0.00 39.33 38.68 3h60 h ASP 409 CO 0.01 0.84 0.13 0.58 -1.03 0.00 0.00 179.24 179.77 3h60 h VAL 410 N 0.66 1.22 -0.38 4.15 2.07 -1.62 -1.95 116.25 120.41 3h60 h VAL 410 Ca 0.12 -0.75 -0.06 0.00 0.82 0.00 0.00 66.70 66.82 3h60 h VAL 410 Cb 0.55 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3h60 h VAL 410 CO 0.03 0.27 -0.01 0.74 0.02 0.00 0.00 177.57 178.62 3h60 h THR 411 N 0.57 1.26 -0.49 2.57 2.02 -1.32 -1.78 112.91 115.74 3h60 h THR 411 Ca 0.14 -1.01 -0.01 0.00 0.77 0.00 0.00 66.41 66.30 3h60 h THR 411 Cb 0.28 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 3h60 h THR 411 CO -0.00 0.34 0.27 0.50 0.37 0.00 0.00 175.52 176.99 3h60 h LYS 412 N 0.49 0.69 -0.73 6.66 3.64 -1.18 -1.02 116.57 125.12 3h60 h LYS 412 Ca 0.11 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3h60 h LYS 412 Cb 0.48 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 3h60 h LYS 412 CO 0.02 0.55 0.40 0.00 -2.27 0.00 0.00 179.45 178.15 3h60 h ALA 413 N 1.11 0.94 -0.08 5.00 0.00 -1.25 -1.10 119.26 123.87 3h60 h ALA 413 Ca 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3h60 h ALA 413 Cb 0.06 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3h60 h ALA 413 CO -0.03 0.44 0.03 0.35 0.00 0.00 0.00 179.25 180.05 3h60 h PHE 414 N 1.01 0.12 -0.50 0.00 3.57 -1.06 -2.09 116.94 117.99 3h60 h PHE 414 Ca 0.26 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.76 3h60 h PHE 414 Cb 0.03 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 3h60 h PHE 414 CO -0.00 0.25 0.31 -0.07 -2.23 0.00 0.00 178.31 176.57 3h60 h LEU 415 N -0.04 0.51 0.34 0.59 3.38 -1.12 -1.80 115.31 117.16 3h60 h LEU 415 Ca 0.03 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3h60 h LEU 415 Cb 0.19 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3h60 h LEU 415 CO -0.00 0.36 -0.16 -0.33 0.09 0.00 0.00 178.44 178.40 3h60 h GLU 416 N 0.62 -0.44 -0.65 1.13 5.08 -1.13 0.96 114.58 120.15 3h60 h GLU 416 Ca 0.19 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.69 3h60 h GLU 416 Cb -0.01 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 3h60 h GLU 416 CO -0.07 -0.28 0.44 1.49 -1.00 0.00 0.00 179.01 179.58 3h60 h GLU 417 N -0.46 0.45 -0.22 2.33 4.81 -1.36 -2.77 114.58 117.35 3h60 h GLU 417 Ca -0.05 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3h60 h GLU 417 Cb 0.35 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3h60 h GLU 417 CO 0.08 0.30 0.00 0.09 -0.73 0.00 0.00 179.01 178.74 3h60 n ASN 418 N -4.48 3.19 -3.76 1.04 3.02 -0.68 -4.96 115.26 108.62 3h60 n ASN 418 Ca 0.11 -1.98 -0.25 0.00 -0.03 0.00 0.00 54.58 52.43 3h60 n ASN 418 Cb 0.39 -0.14 0.04 0.00 -0.61 0.00 0.00 39.78 39.46 3h60 n ASN 418 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3h60 n ASN 419 N 1.38 -3.46 -4.72 6.41 3.02 -0.30 -5.01 115.26 112.59 3h60 n ASN 419 Ca 0.17 -0.75 -0.27 0.00 -0.03 0.00 0.00 54.58 53.70 3h60 n ASN 419 Cb 0.59 -4.18 -0.07 0.00 -0.61 0.00 0.00 39.78 35.51 3h60 n ASN 419 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3h60 s LEU 420 N -7.00 3.52 -0.14 3.41 1.43 0.18 -4.68 118.68 115.40 3h60 s LEU 420 Ca 0.36 -0.26 -0.24 0.00 -1.03 0.00 0.00 54.13 52.96 3h60 s LEU 420 Cb -0.18 -2.16 -0.25 0.00 0.03 0.00 0.00 46.19 43.63 3h60 s LEU 420 CO 0.80 0.10 0.62 0.44 0.23 0.00 0.00 176.35 178.54 3h60 h ASP 421 N 2.72 0.12 -5.22 2.29 3.32 -0.81 -3.42 116.42 115.41 3h60 h ASP 421 Ca -0.47 -0.85 0.11 0.00 0.02 0.00 0.00 57.03 55.84 3h60 h ASP 421 Cb 1.20 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.67 3h60 h ASP 421 CO 0.60 1.27 0.42 -0.72 -1.72 0.00 0.00 179.24 179.09 3h60 s TYR 422 N -2.32 -0.02 0.10 4.55 1.13 -1.16 -4.85 117.35 114.78 3h60 s TYR 422 Ca -0.21 -0.43 0.09 0.00 -1.41 0.00 0.00 57.07 55.11 3h60 s TYR 422 Cb 0.01 0.72 -0.04 0.00 -1.10 0.00 0.00 41.96 41.55 3h60 s TYR 422 CO 0.70 -1.11 -0.20 0.96 -2.51 0.00 0.00 175.55 173.39 3h60 s ILE 423 N -2.82 2.70 -0.11 -3.49 -4.36 -0.39 -2.34 121.20 110.41 3h60 s ILE 423 Ca 0.16 -1.49 0.03 0.00 -0.26 0.00 0.00 60.65 59.08 3h60 s ILE 423 Cb -0.03 -2.21 -0.01 0.00 1.25 0.00 0.00 42.46 41.46 3h60 s ILE 423 CO 0.06 0.15 -0.20 -0.63 0.24 0.00 0.00 174.94 174.56 3h60 s ILE 424 N -1.08 2.40 0.30 8.37 1.01 -0.28 -1.28 121.20 130.65 3h60 s ILE 424 Ca 0.16 -0.90 0.04 0.00 0.00 0.00 0.00 60.65 59.96 3h60 s ILE 424 Cb -0.10 -1.95 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 3h60 s ILE 424 CO 0.08 0.55 0.20 0.00 0.00 0.00 0.00 174.94 175.77 3h60 s ARG 425 N 0.33 1.58 0.00 2.79 1.04 0.58 -2.25 118.95 123.02 3h60 s ARG 425 Ca -0.16 -1.90 0.00 0.00 -1.04 0.00 0.00 55.73 52.63 3h60 s ARG 425 Cb -0.17 0.12 0.00 0.00 -2.04 0.00 0.00 34.95 32.86 3h60 s ARG 425 CO 0.08 -0.52 0.00 0.43 -0.04 0.00 0.00 175.30 175.25 3h60 n SER 426 N -1.04 0.00 0.00 -2.89 7.64 0.44 -1.50 113.62 116.27 3h60 n SER 426 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 3h60 n SER 426 Cb 0.64 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.84 3h60 n SER 426 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 3h60 n HIS 427 N 0.00 0.00 -5.01 1.43 -0.00 -1.23 -4.79 115.22 105.63 3h60 n HIS 427 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.43 3h60 n HIS 427 Cb 0.00 -0.07 -0.16 0.00 -0.00 0.00 0.00 29.99 29.75 3h60 n HIS 427 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3h60 s GLU 428 N 0.00 2.26 0.33 1.57 2.02 -1.26 -5.09 118.70 118.52 3h60 s GLU 428 Ca 0.00 -0.72 -0.29 0.00 0.02 0.00 0.00 54.97 53.98 3h60 s GLU 428 Cb 0.00 -1.86 -0.11 0.00 0.10 0.00 0.00 34.13 32.26 3h60 s GLU 428 CO 0.00 0.24 1.49 0.54 0.02 0.00 0.00 175.26 177.55 3h60 s VAL 429 N 0.13 2.21 -0.05 2.63 0.11 -1.26 -4.75 120.40 119.42 3h60 s VAL 429 Ca -0.08 0.20 0.03 0.00 -2.93 0.00 0.00 61.98 59.19 3h60 s VAL 429 Cb -0.14 -3.13 0.01 0.00 -1.53 0.00 0.00 36.38 31.59 3h60 s VAL 429 CO 0.04 0.04 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.19 3h60 s LYS 430 N -1.32 1.46 0.34 1.54 -0.14 -1.26 -5.04 119.74 115.31 3h60 s LYS 430 Ca 0.57 -0.41 0.09 0.00 -1.36 0.00 0.00 55.97 54.86 3h60 s LYS 430 Cb -0.46 -1.26 0.83 0.00 -1.68 0.00 0.00 37.83 35.27 3h60 s LYS 430 CO 0.54 0.10 1.80 0.00 -0.76 0.00 0.00 175.35 177.03 3h60 h ALA 431 N 6.65 1.83 -0.26 5.17 0.00 -1.88 -0.61 119.26 130.16 3h60 h ALA 431 Ca -0.32 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3h60 h ALA 431 Cb 1.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3h60 h ALA 431 CO 0.48 -0.17 0.00 0.39 0.00 0.00 0.00 179.25 179.95 3h60 n GLU 432 N -4.68 2.23 -0.01 0.00 -0.58 -1.26 -0.85 120.64 115.50 3h60 n GLU 432 Ca 0.22 -1.85 0.00 0.00 -0.42 0.00 0.00 57.16 55.11 3h60 n GLU 432 Cb 0.60 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 30.00 3h60 n GLU 432 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h60 n GLY 433 N 1.37 1.71 3.74 0.62 0.00 -0.24 -4.59 105.19 107.81 3h60 n GLY 433 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.12 3h60 n GLY 433 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h60 s TYR 434 N -2.58 -0.20 -0.14 1.61 1.13 -1.26 -1.49 117.35 114.42 3h60 s TYR 434 Ca 0.00 -0.21 -0.24 0.00 -1.41 0.00 0.00 57.07 55.21 3h60 s TYR 434 Cb 0.00 0.62 0.06 0.00 -1.10 0.00 0.00 41.96 41.54 3h60 s TYR 434 CO 0.00 -1.13 0.61 -2.00 -2.51 0.00 0.00 175.55 170.52 3h60 s GLU 435 N -3.90 0.85 -0.27 -3.49 2.12 -0.58 -4.84 118.70 108.59 3h60 s GLU 435 Ca 0.10 0.52 0.03 0.00 0.36 0.00 0.00 54.97 55.98 3h60 s GLU 435 Cb -0.04 0.40 0.07 0.00 0.26 0.00 0.00 34.13 34.82 3h60 s GLU 435 CO 0.03 -0.19 -0.07 0.08 -0.54 0.00 0.00 175.26 174.58 3h60 s VAL 436 N -0.43 2.00 0.53 3.70 1.01 -1.26 0.14 120.40 126.09 3h60 s VAL 436 Ca -0.06 -1.65 0.06 0.00 0.00 0.00 0.00 61.98 60.34 3h60 s VAL 436 Cb -0.03 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 34.17 3h60 s VAL 436 CO 0.05 -0.16 0.43 0.00 0.00 0.00 0.00 175.10 175.42 3h60 s ALA 437 N 1.15 4.38 -1.38 5.51 0.00 0.11 -4.58 121.76 126.95 3h60 s ALA 437 Ca -0.05 -1.46 -0.09 0.00 0.00 0.00 0.00 51.96 50.37 3h60 s ALA 437 Cb -0.19 -0.82 0.01 0.00 0.00 0.00 0.00 23.12 22.12 3h60 s ALA 437 CO -0.06 -0.45 1.16 0.72 0.00 0.00 0.00 175.76 177.13 3h60 n HIS 438 N -1.76 -2.84 -2.38 0.00 8.25 -1.26 -1.72 115.22 113.51 3h60 n HIS 438 Ca 0.01 0.99 -0.19 0.00 -0.26 0.00 0.00 57.72 58.28 3h60 n HIS 438 Cb 0.64 -4.99 -0.01 0.00 1.12 0.00 0.00 29.99 26.75 3h60 n HIS 438 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h60 n GLY 439 N -1.99 -0.41 0.00 -1.41 0.00 -1.26 -2.46 105.19 97.66 3h60 n GLY 439 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3h60 n GLY 439 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h60 n GLY 440 N -0.94 0.81 0.13 -0.02 0.00 -0.70 -5.00 105.19 99.48 3h60 n GLY 440 Ca -0.22 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.89 3h60 n GLY 440 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3h60 h ARG 441 N 2.82 0.00 -3.67 1.61 2.47 -1.14 -3.43 114.38 113.04 3h60 h ARG 441 Ca 0.00 0.00 -0.60 0.00 -1.26 0.00 0.00 59.98 58.12 3h60 h ARG 441 Cb 0.00 0.00 -0.40 0.00 -1.65 0.00 0.00 29.97 27.92 3h60 h ARG 441 CO 0.00 0.07 -0.74 0.00 0.56 0.00 0.00 179.97 179.85 3h60 s VAL 443 N 1.22 5.23 -0.15 0.00 1.01 -0.40 0.05 120.40 127.35 3h60 s VAL 443 Ca 0.12 0.76 -0.06 0.00 0.00 0.00 0.00 61.98 62.80 3h60 s VAL 443 Cb -0.19 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 3h60 s VAL 443 CO -0.17 0.38 0.04 -0.89 0.00 0.00 0.00 175.10 174.46 3h60 s THR 444 N 0.39 4.60 -0.07 3.92 2.01 0.12 -0.31 115.64 126.30 3h60 s THR 444 Ca 0.22 -0.11 0.03 0.00 0.31 0.00 0.00 61.69 62.13 3h60 s THR 444 Cb -0.14 -3.03 0.01 0.00 0.01 0.00 0.00 72.50 69.35 3h60 s THR 444 CO 0.08 0.51 -0.17 0.54 -0.69 0.00 0.00 174.62 174.89 3h60 s VAL 445 N -0.04 1.46 -0.08 3.82 0.11 -0.56 -1.53 120.40 123.58 3h60 s VAL 445 Ca 0.05 -0.68 -0.01 0.00 -2.93 0.00 0.00 61.98 58.41 3h60 s VAL 445 Cb -0.12 -1.29 0.03 0.00 -1.53 0.00 0.00 36.38 33.46 3h60 s VAL 445 CO 0.01 0.43 -0.03 0.12 -3.33 0.00 0.00 175.10 172.30 3h60 s PHE 446 N 0.46 0.91 -0.26 1.54 5.36 -0.55 -4.11 117.98 121.33 3h60 s PHE 446 Ca -0.14 -0.33 0.12 0.00 -0.96 0.00 0.00 56.93 55.61 3h60 s PHE 446 Cb -0.16 -0.91 0.54 0.00 -0.34 0.00 0.00 43.02 42.16 3h60 s PHE 446 CO 0.05 -0.36 1.50 0.43 -1.46 0.00 0.00 175.22 175.38 3h60 n SER 447 N 4.93 3.29 -4.02 6.13 7.64 -0.52 -1.93 113.62 129.14 3h60 n SER 447 Ca -0.11 -3.42 -0.33 0.00 1.01 0.00 0.00 58.87 56.02 3h60 n SER 447 Cb 0.50 -0.62 -0.12 0.00 -1.01 0.00 0.00 64.21 62.96 3h60 n SER 447 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h60 s ALA 448 N -3.06 3.48 0.67 -0.43 0.00 -0.83 -4.65 121.76 116.93 3h60 s ALA 448 Ca 0.45 -3.32 -0.14 0.00 0.00 0.00 0.00 51.96 48.95 3h60 s ALA 448 Cb 0.39 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 21.10 3h60 s ALA 448 CO 0.05 -2.07 1.10 -1.25 0.00 0.00 0.00 175.76 173.59 3h60 s PRO 449 N -0.28 2.81 -1.25 0.00 0.04 -1.26 -3.18 135.00 131.88 3h60 s PRO 449 Ca 0.18 1.31 -0.13 0.00 0.04 0.00 0.00 61.00 62.40 3h60 s PRO 449 Cb -0.22 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.38 3h60 s PRO 449 CO -0.02 -1.23 0.24 -1.71 0.04 0.00 0.00 177.00 174.32 3h60 n ASN 450 N -2.54 -0.93 -4.53 6.66 5.15 0.48 -4.71 115.26 114.84 3h60 n ASN 450 Ca 0.10 -1.14 -0.53 0.00 -0.60 0.00 0.00 54.58 52.40 3h60 n ASN 450 Cb 0.52 -1.40 -0.06 0.00 -0.53 0.00 0.00 39.78 38.32 3h60 n ASN 450 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3h60 n TYR 451 N -4.35 0.93 -2.74 1.20 9.36 -1.19 0.00 117.16 120.37 3h60 n TYR 451 Ca -0.21 0.84 -0.17 0.00 3.32 0.00 0.00 57.90 61.67 3h60 n TYR 451 Cb 0.57 -2.19 0.00 0.00 -0.63 0.00 0.00 39.34 37.09 3h60 n TYR 451 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3h60 n ASP 453 N -2.05 -5.32 0.00 0.00 8.00 0.10 -4.69 116.55 112.60 3h60 n ASP 453 Ca -0.12 0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.51 3h60 n ASP 453 Cb 0.61 -3.58 0.00 0.00 -0.02 0.00 0.00 41.12 38.12 3h60 n ASP 453 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h60 n GLN 454 N -0.01 0.00 0.09 -1.24 6.02 -0.88 -4.88 117.38 116.48 3h60 n GLN 454 Ca -0.05 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.06 3h60 n GLN 454 Cb 0.50 -0.69 0.45 0.00 1.02 0.00 0.00 30.24 31.53 3h60 n GLN 454 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3h60 n MET 455 N -2.36 0.19 -0.80 -1.09 0.00 -0.87 -4.88 117.12 107.31 3h60 n MET 455 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 57.70 57.96 3h60 n MET 455 Cb 0.33 -1.77 0.00 0.00 0.00 0.00 0.00 33.22 31.78 3h60 n MET 455 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3h60 n GLY 456 N 0.82 0.25 3.76 3.03 0.00 -1.26 -4.89 105.19 106.91 3h60 n GLY 456 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 3h60 n GLY 456 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h60 s ASN 457 N -2.19 5.67 0.79 1.61 4.22 -1.26 -4.69 114.94 119.09 3h60 s ASN 457 Ca 0.00 2.34 -0.11 0.00 -2.14 0.00 0.00 52.86 52.95 3h60 s ASN 457 Cb 0.00 -2.60 0.06 0.00 1.28 0.00 0.00 41.25 40.00 3h60 s ASN 457 CO 0.00 -1.26 1.08 -0.54 -2.04 0.00 0.00 177.10 174.34 3h60 s LYS 458 N -3.07 2.16 0.41 3.55 1.02 -0.03 -0.39 119.74 123.40 3h60 s LYS 458 Ca 0.71 0.91 0.07 0.00 0.02 0.00 0.00 55.97 57.68 3h60 s LYS 458 Cb -0.29 -1.90 -0.07 0.00 -0.52 0.00 0.00 37.83 35.05 3h60 s LYS 458 CO 0.33 -1.64 0.09 0.00 -0.92 0.00 0.00 175.35 173.21 3h60 s ALA 459 N -3.01 3.37 0.13 5.17 0.00 0.09 -2.52 121.76 125.01 3h60 s ALA 459 Ca 0.61 -2.20 -0.09 0.00 0.00 0.00 0.00 51.96 50.28 3h60 s ALA 459 Cb -0.16 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.88 3h60 s ALA 459 CO 0.56 -0.14 0.26 -1.54 0.00 0.00 0.00 175.76 174.89 3h60 s SER 460 N -3.80 0.05 0.29 0.00 1.04 -0.81 -0.52 113.70 109.95 3h60 s SER 460 Ca 0.37 -0.75 0.04 0.00 0.48 0.00 0.00 55.95 56.09 3h60 s SER 460 Cb 0.07 0.40 -0.06 0.00 0.10 0.00 0.00 66.02 66.54 3h60 s SER 460 CO 0.20 -0.83 0.04 -0.72 0.98 0.00 0.00 173.24 172.91 3h60 s TYR 461 N -3.92 1.79 -0.03 5.02 -0.85 -0.28 -4.16 117.35 114.92 3h60 s TYR 461 Ca 0.12 -0.96 0.07 0.00 -0.52 0.00 0.00 57.07 55.77 3h60 s TYR 461 Cb 0.04 -1.11 -0.02 0.00 0.38 0.00 0.00 41.96 41.25 3h60 s TYR 461 CO -0.05 -0.04 -0.24 0.42 -1.52 0.00 0.00 175.55 174.13 3h60 s ILE 462 N -3.38 2.25 -0.15 -3.49 1.01 -0.41 -0.13 121.20 116.89 3h60 s ILE 462 Ca 0.34 -1.03 -0.08 0.00 0.00 0.00 0.00 60.65 59.88 3h60 s ILE 462 Cb 0.07 -1.80 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 3h60 s ILE 462 CO 0.13 0.58 0.12 -1.00 0.00 0.00 0.00 174.94 174.77 3h60 s HIS 463 N -0.56 3.48 0.12 3.97 3.76 0.24 -0.46 115.29 125.83 3h60 s HIS 463 Ca 0.08 0.40 0.09 0.00 -0.15 0.00 0.00 55.06 55.49 3h60 s HIS 463 Cb -0.11 -2.02 -0.04 0.00 1.11 0.00 0.00 32.58 31.53 3h60 s HIS 463 CO -0.00 0.52 -0.23 -0.51 -0.85 0.00 0.00 174.74 173.67 3h60 s LEU 464 N -0.43 2.32 0.10 0.89 1.43 -0.06 -1.99 118.68 120.93 3h60 s LEU 464 Ca 0.11 -0.72 0.04 0.00 -1.03 0.00 0.00 54.13 52.54 3h60 s LEU 464 Cb -0.12 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.06 3h60 s LEU 464 CO 0.02 0.10 -0.11 0.00 0.23 0.00 0.00 176.35 176.58 3h60 s GLN 465 N -2.02 0.87 0.32 1.70 -2.07 -1.08 -0.98 119.66 116.40 3h60 s GLN 465 Ca 0.10 -1.14 0.08 0.00 -1.82 0.00 0.00 55.36 52.58 3h60 s GLN 465 Cb -0.10 -0.63 0.82 0.00 -1.09 0.00 0.00 33.01 32.02 3h60 s GLN 465 CO 0.05 0.11 1.77 0.78 -1.32 0.00 0.00 175.29 176.68 3h60 h GLY 466 N 3.65 1.72 0.81 2.60 0.00 -1.01 -0.49 103.07 110.34 3h60 h GLY 466 Ca -0.38 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.62 3h60 h GLY 466 CO 0.51 -0.11 -0.18 -1.14 0.00 0.00 0.00 176.54 175.62 3h60 n SER 467 N -4.77 0.59 -3.28 0.19 3.41 -1.03 -4.68 113.62 104.06 3h60 n SER 467 Ca 0.24 -0.55 0.03 0.00 -0.26 0.00 0.00 58.87 58.33 3h60 n SER 467 Cb 0.64 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.56 3h60 n SER 467 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h60 s ASP 468 N -2.57 -0.99 -0.02 4.04 2.15 -0.19 -5.03 116.67 114.05 3h60 s ASP 468 Ca 0.25 0.86 0.15 0.00 0.43 0.00 0.00 52.55 54.23 3h60 s ASP 468 Cb 0.19 1.93 0.46 0.00 -0.30 0.00 0.00 42.92 45.20 3h60 s ASP 468 CO 0.51 -0.19 1.37 0.18 -0.17 0.00 0.00 175.17 176.88 3h60 n LEU 469 N 5.37 2.85 -4.75 -1.34 4.77 -1.22 -2.64 117.00 120.04 3h60 n LEU 469 Ca -0.06 -1.43 -0.41 0.00 -0.03 0.00 0.00 56.01 54.09 3h60 n LEU 469 Cb 0.52 -0.37 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 3h60 n LEU 469 CO -0.03 0.66 0.79 -0.13 -1.33 0.00 0.00 177.39 177.35 3h60 s ARG 470 N -1.41 4.64 -0.02 3.23 0.52 -1.26 -4.86 118.95 119.78 3h60 s ARG 470 Ca 0.34 1.76 -0.30 0.00 -0.52 0.00 0.00 55.73 57.01 3h60 s ARG 470 Cb 0.19 -3.22 -0.04 0.00 0.52 0.00 0.00 34.95 32.39 3h60 s ARG 470 CO 0.22 0.18 1.28 -1.25 0.02 0.00 0.00 175.30 175.75 3h60 s PRO 471 N -1.05 4.33 -0.22 3.54 0.04 -1.26 -4.75 135.00 135.63 3h60 s PRO 471 Ca 0.46 1.81 -0.09 0.00 0.04 0.00 0.00 61.00 63.22 3h60 s PRO 471 Cb -0.31 -3.53 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 3h60 s PRO 471 CO 0.38 -0.48 0.11 -0.65 0.04 0.00 0.00 177.00 176.40 3h60 s GLN 472 N 2.14 3.97 -0.13 4.56 -0.21 -0.84 -4.97 119.66 124.17 3h60 s GLN 472 Ca 0.59 -0.33 -0.13 0.00 0.02 0.00 0.00 55.36 55.52 3h60 s GLN 472 Cb -0.28 -3.37 -0.05 0.00 1.00 0.00 0.00 33.01 30.31 3h60 s GLN 472 CO 0.25 0.12 0.28 -0.06 -2.12 0.00 0.00 175.29 173.75 3h60 s PHE 473 N 0.84 3.52 -0.25 0.91 0.08 -1.26 -0.59 117.98 121.23 3h60 s PHE 473 Ca 0.05 0.63 0.00 0.00 0.12 0.00 0.00 56.93 57.74 3h60 s PHE 473 Cb -0.13 -2.26 0.04 0.00 -0.57 0.00 0.00 43.02 40.10 3h60 s PHE 473 CO 0.02 0.39 -0.08 -1.01 -0.10 0.00 0.00 175.22 174.44 3h60 s HIS 474 N -0.03 3.12 0.26 0.36 3.76 0.82 -4.98 115.29 118.60 3h60 s HIS 474 Ca 0.17 -1.86 -0.11 0.00 -0.15 0.00 0.00 55.06 53.12 3h60 s HIS 474 Cb -0.13 -2.01 -0.07 0.00 1.11 0.00 0.00 32.58 31.47 3h60 s HIS 474 CO 0.05 -0.80 0.60 -0.65 -0.85 0.00 0.00 174.74 173.09 3h60 s GLN 475 N 1.24 3.84 0.19 1.40 -0.21 -1.26 -1.12 119.66 123.73 3h60 s GLN 475 Ca -0.03 0.36 -0.15 0.00 0.02 0.00 0.00 55.36 55.55 3h60 s GLN 475 Cb -0.18 -2.59 0.02 0.00 1.00 0.00 0.00 33.01 31.26 3h60 s GLN 475 CO -0.05 0.26 0.47 -0.59 -2.12 0.00 0.00 175.29 173.26 3h60 s PHE 476 N -1.90 0.02 0.34 0.91 -0.71 0.32 -4.94 117.98 112.02 3h60 s PHE 476 Ca 0.49 -0.37 0.06 0.00 -1.04 0.00 0.00 56.93 56.07 3h60 s PHE 476 Cb -0.11 0.29 -0.07 0.00 -1.21 0.00 0.00 43.02 41.93 3h60 s PHE 476 CO 0.21 -0.89 -0.01 0.95 -1.34 0.00 0.00 175.22 174.15 3h60 s THR 477 N -3.90 1.68 0.30 -4.49 -4.23 -1.26 -0.73 115.64 103.01 3h60 s THR 477 Ca 0.12 -2.06 -0.29 0.00 -1.18 0.00 0.00 61.69 58.28 3h60 s THR 477 Cb -0.00 -2.74 -0.10 0.00 1.34 0.00 0.00 72.50 71.00 3h60 s THR 477 CO -0.01 -0.11 1.28 0.00 -0.54 0.00 0.00 174.62 175.23 3h60 s ALA 478 N -2.96 3.49 0.27 3.99 0.00 -1.26 -4.96 121.76 120.33 3h60 s ALA 478 Ca 0.34 1.18 0.06 0.00 0.00 0.00 0.00 51.96 53.54 3h60 s ALA 478 Cb 0.07 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 3h60 s ALA 478 CO 0.15 -0.55 0.32 0.14 0.00 0.00 0.00 175.76 175.83 3h60 s VAL 479 N -0.95 4.59 0.48 0.00 -7.23 -1.26 -5.06 120.40 110.96 3h60 s VAL 479 Ca 0.49 -1.16 -0.24 0.00 -1.81 0.00 0.00 61.98 59.26 3h60 s VAL 479 Cb -0.38 -3.56 -0.08 0.00 0.56 0.00 0.00 36.38 32.92 3h60 s VAL 479 CO 0.49 -0.29 1.30 -2.65 -0.31 0.00 0.00 175.10 173.64 3h60 n PRO 480 N -1.38 1.83 -4.16 4.82 -0.02 -1.26 -4.85 135.00 129.99 3h60 n PRO 480 Ca -0.06 0.66 -0.10 0.00 -2.02 0.00 0.00 63.50 61.98 3h60 n PRO 480 Cb 0.58 -2.46 -0.10 0.00 -0.02 0.00 0.00 33.50 31.50 3h60 n PRO 480 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3h60 s HIS 481 N -1.25 0.89 0.67 6.00 -3.43 -1.26 -4.92 115.29 111.98 3h60 s HIS 481 Ca 0.65 -1.19 -0.17 0.00 -0.80 0.00 0.00 55.06 53.56 3h60 s HIS 481 Cb -0.46 -0.51 0.00 0.00 -1.43 0.00 0.00 32.58 30.18 3h60 s HIS 481 CO 0.54 -0.46 1.23 -2.14 -2.00 0.00 0.00 174.74 171.92 3h60 s PRO 482 N -4.01 2.50 -0.89 -0.38 0.02 -1.26 -4.80 135.00 126.17 3h60 s PRO 482 Ca 0.22 1.85 -0.22 0.00 0.02 0.00 0.00 61.00 62.88 3h60 s PRO 482 Cb 0.07 -1.87 -0.14 0.00 0.02 0.00 0.00 34.50 32.59 3h60 s PRO 482 CO 0.01 -1.58 1.93 -1.71 -0.33 0.00 0.00 177.00 175.32 3h60 n ASN 483 N -2.17 2.72 -4.28 2.53 5.15 -1.26 -4.82 115.26 113.12 3h60 n ASN 483 Ca 0.14 -2.69 -0.32 0.00 -0.60 0.00 0.00 54.58 51.11 3h60 n ASN 483 Cb 0.49 -1.28 -0.16 0.00 -0.53 0.00 0.00 39.78 38.30 3h60 n ASN 483 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3h60 s VAL 484 N 6.46 2.37 0.39 3.44 1.01 -1.26 -5.13 120.40 127.68 3h60 s VAL 484 Ca 0.60 -0.92 -0.23 0.00 0.00 0.00 0.00 61.98 61.43 3h60 s VAL 484 Cb 0.11 -1.93 -0.10 0.00 0.00 0.00 0.00 36.38 34.46 3h60 s VAL 484 CO 0.12 0.55 0.96 -0.54 0.00 0.00 0.00 175.10 176.20 3h60 s LYS 485 N 0.22 4.31 0.61 2.72 1.02 -1.26 -4.86 119.74 122.51 3h60 s LYS 485 Ca -0.13 1.24 -0.18 0.00 0.02 0.00 0.00 55.97 56.92 3h60 s LYS 485 Cb -0.16 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.70 3h60 s LYS 485 CO 0.07 0.04 1.10 -2.30 -0.92 0.00 0.00 175.35 173.33 3h60 n PRO 486 N -0.21 1.01 -1.05 -1.68 -0.02 -1.26 -2.11 135.00 129.68 3h60 n PRO 486 Ca 0.05 0.39 -0.02 0.00 -2.02 0.00 0.00 63.50 61.91 3h60 n PRO 486 Cb 0.52 -2.31 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 3h60 n PRO 486 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 3h60 n MET 487 N -1.31 -1.28 -0.06 -0.52 1.56 0.30 -4.86 117.12 110.95 3h60 n MET 487 Ca 0.14 0.42 0.21 0.00 -0.27 0.00 0.00 57.70 58.20 3h60 n MET 487 Cb 0.47 -4.43 0.66 0.00 2.15 0.00 0.00 33.22 32.08 3h60 n MET 487 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3h60 h ALA 488 N 0.00 2.50 -0.57 -5.12 0.00 -1.71 -1.42 119.26 112.93 3h60 h ALA 488 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3h60 h ALA 488 Cb 0.70 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3h60 h ALA 488 CO 0.06 -0.68 0.00 0.66 0.00 0.00 0.00 179.25 179.29 3h60 n TYR 489 N -4.38 0.76 1.59 0.00 4.01 -1.26 -5.08 117.16 112.80 3h60 n TYR 489 Ca 0.12 -0.40 0.14 0.00 -0.16 0.00 0.00 57.90 57.61 3h60 n TYR 489 Cb 0.66 -0.00 0.60 0.00 -0.31 0.00 0.00 39.34 40.29 3h60 n TYR 489 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40