#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gvp s LYS 178 N 0.00 0.63 0.54 3.69 2.47 -1.26 -4.88 119.74 120.93 3gvp s LYS 178 Ca 0.00 0.92 0.09 0.00 -1.56 0.00 0.00 55.97 55.42 3gvp s LYS 178 Cb 0.00 0.22 0.07 0.00 -1.46 0.00 0.00 37.83 36.66 3gvp s LYS 178 CO 0.00 -0.10 0.75 0.54 0.16 0.00 0.00 175.35 176.69 3gvp s ASN 179 N 0.97 5.21 0.00 1.43 4.22 -1.17 -4.93 114.94 120.67 3gvp s ASN 179 Ca -0.05 -0.73 0.00 0.00 -2.14 0.00 0.00 52.86 49.95 3gvp s ASN 179 Cb -0.05 0.06 0.00 0.00 1.28 0.00 0.00 41.25 42.54 3gvp s ASN 179 CO -0.11 -1.22 0.00 -1.20 -2.04 0.00 0.00 177.10 172.53 3gvp n SER 180 N -2.17 0.00 0.00 3.54 7.64 -1.26 -4.17 113.62 117.19 3gvp n SER 180 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.02 3gvp n SER 180 Cb 0.61 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.81 3gvp n SER 180 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3gvp n LYS 181 N -1.09 0.00 0.00 1.43 4.81 -1.26 -4.99 118.16 117.06 3gvp n LYS 181 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3gvp n LYS 181 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 3gvp n LYS 181 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gvp n GLY 182 N -0.10 3.92 3.78 3.14 0.00 -1.26 -5.14 105.19 109.52 3gvp n GLY 182 Ca 0.00 -0.62 -0.39 0.00 0.00 0.00 0.00 46.02 45.01 3gvp n GLY 182 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gvp s SER 183 N 0.00 7.25 0.00 1.61 0.15 -1.26 -4.95 113.70 116.50 3gvp s SER 183 Ca 0.00 1.49 0.03 0.00 0.70 0.00 0.00 55.95 58.17 3gvp s SER 183 Cb 0.00 -2.45 0.06 0.00 -1.71 0.00 0.00 66.02 61.92 3gvp s SER 183 CO 0.00 0.20 0.87 -0.24 1.20 0.00 0.00 173.24 175.27 3gvp n SER 184 N 1.85 1.84 -3.81 5.45 2.88 -1.26 -3.06 113.62 117.51 3gvp n SER 184 Ca -0.07 -1.62 -0.42 0.00 -1.33 0.00 0.00 58.87 55.43 3gvp n SER 184 Cb 0.50 -0.04 -0.02 0.00 -0.75 0.00 0.00 64.21 63.90 3gvp n SER 184 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3gvp n ASP 185 N -0.04 3.51 -2.95 -3.46 2.03 -1.26 -4.72 116.55 109.66 3gvp n ASP 185 Ca 0.03 -2.79 -0.00 0.00 0.52 0.00 0.00 54.79 52.54 3gvp n ASP 185 Cb 0.21 -1.50 0.01 0.00 -0.72 0.00 0.00 41.12 39.12 3gvp n ASP 185 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 3gvp n PHE 186 N 7.08 -0.78 -3.58 -0.67 -1.74 -1.26 -3.95 117.46 112.57 3gvp n PHE 186 Ca 0.51 -0.77 -0.01 0.00 -0.56 0.00 0.00 57.45 56.62 3gvp n PHE 186 Cb 0.40 0.37 -0.04 0.00 1.52 0.00 0.00 39.48 41.73 3gvp n PHE 186 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3gvp s VAL 188 N 2.69 0.04 0.19 0.00 1.01 -1.26 -1.97 120.40 121.10 3gvp s VAL 188 Ca -0.05 -1.02 -0.17 0.00 0.00 0.00 0.00 61.98 60.73 3gvp s VAL 188 Cb -0.10 -1.69 0.16 0.00 0.00 0.00 0.00 36.38 34.75 3gvp s VAL 188 CO -0.19 -0.18 1.62 0.50 0.00 0.00 0.00 175.10 176.85 3gvp h LYS 189 N 2.32 -0.09 -0.94 2.72 1.63 -1.89 -3.42 116.57 116.89 3gvp h LYS 189 Ca -0.30 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 59.59 3gvp h LYS 189 Cb 1.25 0.02 -0.21 0.00 -0.60 0.00 0.00 32.23 32.69 3gvp h LYS 189 CO 0.41 -0.06 -0.29 1.21 -3.45 0.00 0.00 179.45 177.27 3gvp s ASN 190 N -5.18 -1.42 0.00 4.20 2.47 -1.26 -4.80 114.94 108.95 3gvp s ASN 190 Ca -0.14 0.52 0.20 0.00 0.42 0.00 0.00 52.86 53.86 3gvp s ASN 190 Cb 0.17 2.05 1.10 0.00 -1.45 0.00 0.00 41.25 43.11 3gvp s ASN 190 CO 0.71 -0.26 1.63 0.00 -3.72 0.00 0.00 177.10 175.46 3gvp n ILE 191 N 5.42 0.25 0.52 -5.21 3.06 -1.26 -2.18 119.36 119.96 3gvp n ILE 191 Ca 0.02 0.06 0.13 0.00 -2.50 0.00 0.00 62.75 60.46 3gvp n ILE 191 Cb 0.53 -0.73 0.45 0.00 0.54 0.00 0.00 39.64 40.42 3gvp n ILE 191 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 3gvp n LYS 192 N -1.19 0.23 0.00 9.51 4.76 -1.26 -3.39 118.16 126.82 3gvp n LYS 192 Ca 0.12 0.31 0.11 0.00 -2.87 0.00 0.00 58.31 55.98 3gvp n LYS 192 Cb 0.13 -1.84 0.62 0.00 -1.84 0.00 0.00 35.03 32.10 3gvp n LYS 192 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3gvp n GLN 193 N -2.26 0.55 -0.32 1.97 6.02 -0.93 -4.21 117.38 118.20 3gvp n GLN 193 Ca 0.04 0.03 0.16 0.00 -0.01 0.00 0.00 57.00 57.23 3gvp n GLN 193 Cb 0.34 -1.50 0.40 0.00 1.02 0.00 0.00 30.24 30.50 3gvp n GLN 193 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3gvp h ALA 194 N 3.26 1.91 0.00 -1.58 0.00 -1.77 -1.66 119.26 119.42 3gvp h ALA 194 Ca 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.77 3gvp h ALA 194 Cb 0.08 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 17.84 3gvp h ALA 194 CO 0.00 -0.27 -0.80 1.49 0.00 0.00 0.00 179.25 179.67 3gvp h GLU 195 N 0.61 0.54 0.38 0.00 4.81 -1.90 -1.11 114.58 117.90 3gvp h GLU 195 Ca 0.56 -0.58 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 3gvp h GLU 195 Cb 1.08 0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.63 3gvp h GLU 195 CO -0.32 1.21 -0.18 0.35 -0.73 0.00 0.00 179.01 179.34 3gvp h PHE 196 N 0.11 -0.48 -0.97 0.92 -0.00 -1.77 -2.62 116.94 112.13 3gvp h PHE 196 Ca -0.10 -0.01 0.04 0.00 -0.00 0.00 0.00 57.97 57.90 3gvp h PHE 196 Cb 1.49 0.16 -0.06 0.00 -0.00 0.00 0.00 35.95 37.54 3gvp h PHE 196 CO 0.13 -0.29 0.63 0.78 -0.00 0.00 0.00 178.31 179.56 3gvp h GLY 197 N -0.52 1.40 1.61 2.40 0.00 -1.39 -2.50 103.07 104.08 3gvp h GLY 197 Ca -0.05 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.73 3gvp h GLY 197 CO 0.09 0.41 -0.10 -0.09 0.00 0.00 0.00 176.54 176.85 3gvp h ARG 198 N 1.22 0.47 -0.08 4.80 9.65 -1.07 -0.54 114.38 128.82 3gvp h ARG 198 Ca 0.39 -0.12 -0.00 0.00 -1.10 0.00 0.00 59.98 59.14 3gvp h ARG 198 Cb 0.01 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 28.53 3gvp h ARG 198 CO -0.12 0.57 0.04 -0.09 2.80 0.00 0.00 179.97 183.17 3gvp h ARG 199 N 0.44 0.12 -0.63 0.20 2.43 -1.07 -1.61 114.38 114.26 3gvp h ARG 199 Ca 0.09 -0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.37 3gvp h ARG 199 Cb 0.44 -0.02 -0.11 0.00 -0.42 0.00 0.00 29.97 29.86 3gvp h ARG 199 CO 0.02 0.22 -0.04 0.93 -1.51 0.00 0.00 179.97 179.59 3gvp h GLU 200 N -0.00 0.08 -0.75 0.20 4.39 -1.14 0.46 114.58 117.82 3gvp h GLU 200 Ca 0.03 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 3gvp h GLU 200 Cb 0.14 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 3gvp h GLU 200 CO -0.00 0.05 0.38 0.82 -1.16 0.00 0.00 179.01 179.10 3gvp h ILE 201 N 0.08 1.24 -0.63 3.13 2.04 -0.94 -1.93 117.51 120.50 3gvp h ILE 201 Ca 0.32 -0.64 -0.09 0.00 1.00 0.00 0.00 64.86 65.45 3gvp h ILE 201 Cb 0.53 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 3gvp h ILE 201 CO -0.57 0.28 0.05 -0.08 0.00 0.00 0.00 178.15 177.83 3gvp h GLU 202 N 1.05 1.06 -0.58 2.37 4.22 -0.07 0.19 114.58 122.81 3gvp h GLU 202 Ca 0.26 -0.30 0.02 0.00 0.08 0.00 0.00 59.36 59.41 3gvp h GLU 202 Cb 0.09 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3gvp h GLU 202 CO -0.04 1.00 0.37 0.82 -2.18 0.00 0.00 179.01 178.99 3gvp h ILE 203 N 0.98 1.11 -0.00 2.32 1.08 -0.81 -2.56 117.51 119.62 3gvp h ILE 203 Ca 0.19 -0.26 -0.09 0.00 -0.39 0.00 0.00 64.86 64.31 3gvp h ILE 203 Cb 0.49 0.30 -0.01 0.00 -3.07 0.00 0.00 36.82 34.52 3gvp h ILE 203 CO 0.02 0.14 -0.41 0.00 -0.69 0.00 0.00 178.15 177.21 3gvp h ALA 204 N 1.24 1.32 -0.46 1.87 0.00 -0.40 -0.59 119.26 122.25 3gvp h ALA 204 Ca 0.23 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3gvp h ALA 204 Cb -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3gvp h ALA 204 CO -0.08 0.51 0.29 0.93 0.00 0.00 0.00 179.25 180.91 3gvp h GLU 205 N 0.00 0.57 -0.42 0.00 5.08 -0.48 0.47 114.58 119.80 3gvp h GLU 205 Ca -0.00 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 3gvp h GLU 205 Cb 0.72 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 3gvp h GLU 205 CO 0.05 0.38 0.02 1.96 -1.00 0.00 0.00 179.01 180.42 3gvp h GLN 206 N 0.59 0.66 -0.01 2.33 4.20 -0.74 -2.11 115.11 120.03 3gvp h GLN 206 Ca 0.18 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3gvp h GLN 206 Cb -0.03 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.66 3gvp h GLN 206 CO -0.06 0.67 -0.02 0.39 -0.67 0.00 0.00 178.83 179.14 3gvp n GLU 207 N -4.26 1.29 -3.01 1.46 -0.58 -0.55 -4.17 120.64 110.81 3gvp n GLU 207 Ca 0.02 -0.50 -0.21 0.00 -0.42 0.00 0.00 57.16 56.05 3gvp n GLU 207 Cb 0.26 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.61 3gvp n GLU 207 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3gvp n MET 208 N -0.42 2.03 0.31 3.49 2.81 0.11 -4.49 117.12 120.95 3gvp n MET 208 Ca 0.20 -4.03 0.20 0.00 -1.81 0.00 0.00 57.70 52.27 3gvp n MET 208 Cb 0.25 -1.92 0.97 0.00 -0.71 0.00 0.00 33.22 31.82 3gvp n MET 208 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3gvp h PRO 209 N 2.97 0.00 -0.36 0.03 0.13 -1.72 -2.31 132.00 130.74 3gvp h PRO 209 Ca 0.11 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.18 3gvp h PRO 209 Cb 0.80 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 3gvp h PRO 209 CO 0.65 0.01 -0.03 0.00 -0.23 0.00 0.00 178.00 178.40 3gvp h ALA 210 N 1.99 1.29 -0.16 -0.56 0.00 -1.92 0.11 119.26 120.00 3gvp h ALA 210 Ca -0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.47 3gvp h ALA 210 Cb 0.22 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.86 3gvp h ALA 210 CO 0.00 0.48 -0.71 -0.07 0.00 0.00 0.00 179.25 178.95 3gvp h LEU 211 N 0.55 0.90 -0.50 0.00 3.38 -1.76 -2.17 115.31 115.70 3gvp h LEU 211 Ca 0.11 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.43 3gvp h LEU 211 Cb 0.39 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3gvp h LEU 211 CO 0.02 1.37 0.20 0.24 0.09 0.00 0.00 178.44 180.36 3gvp h MET 212 N 0.49 0.75 -0.32 1.13 2.86 -1.49 -1.88 114.93 116.48 3gvp h MET 212 Ca -0.04 -0.14 0.04 0.00 -2.06 0.00 0.00 59.70 57.50 3gvp h MET 212 Cb 1.34 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.86 3gvp h MET 212 CO 0.15 0.67 0.22 0.00 1.06 0.00 0.00 176.91 179.00 3gvp h ALA 213 N 1.05 1.94 -0.33 6.32 0.00 -0.73 -1.84 119.26 125.68 3gvp h ALA 213 Ca 0.17 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 3gvp h ALA 213 Cb 0.20 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3gvp h ALA 213 CO -0.01 0.01 -0.33 1.25 0.00 0.00 0.00 179.25 180.16 3gvp h LEU 214 N 0.28 0.86 0.19 0.00 5.85 -0.70 -0.66 115.31 121.14 3gvp h LEU 214 Ca 0.13 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.39 3gvp h LEU 214 Cb 0.18 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3gvp h LEU 214 CO -0.03 1.16 -0.20 0.03 -0.34 0.00 0.00 178.44 179.06 3gvp h ARG 215 N 0.59 -0.41 -0.50 1.25 3.08 -0.92 -0.82 114.38 116.64 3gvp h ARG 215 Ca 0.05 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.23 3gvp h ARG 215 Cb 0.91 0.09 -0.09 0.00 0.08 0.00 0.00 29.97 30.97 3gvp h ARG 215 CO 0.08 -0.28 -0.03 0.87 -1.07 0.00 0.00 179.97 179.55 3gvp h LYS 216 N -0.43 0.09 -0.57 0.04 1.57 -1.22 0.19 116.57 116.24 3gvp h LYS 216 Ca 0.00 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 3gvp h LYS 216 Cb 0.41 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 3gvp h LYS 216 CO -0.05 0.06 0.01 0.00 -0.57 0.00 0.00 179.45 178.89 3gvp h ARG 217 N 0.09 0.98 0.00 3.15 3.08 -1.03 -3.39 114.38 117.26 3gvp h ARG 217 Ca 0.25 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3gvp h ARG 217 Cb 0.38 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 3gvp h ARG 217 CO -0.44 0.96 -1.28 0.00 -1.07 0.00 0.00 179.97 178.14 3gvp n ALA 218 N -2.48 2.17 0.17 0.04 0.00 -0.32 -4.72 120.51 115.37 3gvp n ALA 218 Ca 0.03 -0.17 0.02 0.00 0.00 0.00 0.00 53.44 53.32 3gvp n ALA 218 Cb 0.33 -0.15 0.30 0.00 0.00 0.00 0.00 19.45 19.92 3gvp n ALA 218 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 3gvp h GLN 219 N 0.00 0.00 0.29 0.00 3.07 -0.80 -2.42 115.11 115.25 3gvp h GLN 219 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.72 3gvp h GLN 219 Cb 0.41 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.95 3gvp h GLN 219 CO 0.00 0.46 -0.29 0.78 0.09 0.00 0.00 178.83 179.86 3gvp h GLY 220 N 1.55 -0.66 1.51 0.06 0.00 -1.83 -2.73 103.07 100.96 3gvp h GLY 220 Ca -0.00 0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.66 3gvp h GLY 220 CO 0.06 -0.26 0.00 -2.21 0.00 0.00 0.00 176.54 174.13 3gvp n GLU 221 N -5.41 0.30 -3.66 4.80 0.00 -1.08 -4.95 120.64 110.63 3gvp n GLU 221 Ca -0.09 0.10 -0.25 0.00 0.00 0.00 0.00 57.16 56.92 3gvp n GLU 221 Cb 0.32 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.26 3gvp n GLU 221 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3gvp n LYS 222 N -1.26 -1.61 0.13 5.31 4.76 -0.93 -4.87 118.16 119.69 3gvp n LYS 222 Ca 0.09 0.97 0.13 0.00 -2.87 0.00 0.00 58.31 56.63 3gvp n LYS 222 Cb 0.14 -2.60 0.46 0.00 -1.84 0.00 0.00 35.03 31.20 3gvp n LYS 222 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 3gvp h PRO 223 N 0.25 0.00 -0.22 1.97 0.13 -1.63 -3.18 132.00 129.31 3gvp h PRO 223 Ca -0.56 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 3gvp h PRO 223 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 3gvp h PRO 223 CO 0.33 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.38 3gvp n LEU 224 N -2.33 3.42 -4.61 1.56 4.32 -0.19 -4.80 117.00 114.38 3gvp n LEU 224 Ca 0.03 -2.84 -0.43 0.00 -0.02 0.00 0.00 56.01 52.76 3gvp n LEU 224 Cb 0.31 -0.46 -0.03 0.00 -1.62 0.00 0.00 43.42 41.63 3gvp n LEU 224 CO 0.24 0.68 1.63 0.00 -1.22 0.00 0.00 177.39 178.72 3gvp s ALA 225 N -2.49 2.95 0.00 -1.18 0.00 -1.20 -1.70 121.76 118.13 3gvp s ALA 225 Ca 0.36 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.90 3gvp s ALA 225 Cb 0.28 -3.99 0.00 0.00 0.00 0.00 0.00 23.12 19.41 3gvp s ALA 225 CO 0.09 -2.48 0.00 0.41 0.00 0.00 0.00 175.76 173.78 3gvp n GLY 226 N 5.34 0.18 3.74 0.00 0.00 -1.26 -5.00 105.19 108.19 3gvp n GLY 226 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 3gvp n GLY 226 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gvp s ALA 227 N -2.00 3.41 -0.32 4.61 0.00 -0.69 -4.96 121.76 121.81 3gvp s ALA 227 Ca 0.00 0.90 0.02 0.00 0.00 0.00 0.00 51.96 52.88 3gvp s ALA 227 Cb 0.00 -3.39 0.10 0.00 0.00 0.00 0.00 23.12 19.83 3gvp s ALA 227 CO 0.00 -0.31 0.05 0.15 0.00 0.00 0.00 175.76 175.65 3gvp s LYS 228 N -0.33 1.31 -0.15 0.00 1.02 -1.26 -1.81 119.74 118.52 3gvp s LYS 228 Ca 0.51 -1.58 -0.06 0.00 0.02 0.00 0.00 55.97 54.86 3gvp s LYS 228 Cb -0.31 -2.82 -0.04 0.00 -0.52 0.00 0.00 37.83 34.13 3gvp s LYS 228 CO 0.36 -0.91 0.06 0.42 -0.92 0.00 0.00 175.35 174.35 3gvp s ILE 229 N 1.14 4.75 -0.12 2.17 1.01 0.01 -1.26 121.20 128.89 3gvp s ILE 229 Ca 0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 60.65 60.66 3gvp s ILE 229 Cb -0.19 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 39.16 3gvp s ILE 229 CO -0.12 0.52 -0.07 0.68 0.00 0.00 0.00 174.94 175.94 3gvp s VAL 230 N -0.11 3.60 0.11 2.92 -7.23 -0.59 -1.68 120.40 117.41 3gvp s VAL 230 Ca 0.07 -0.48 0.10 0.00 -1.81 0.00 0.00 61.98 59.86 3gvp s VAL 230 Cb -0.12 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 3gvp s VAL 230 CO 0.01 0.53 -0.26 -0.83 -0.31 0.00 0.00 175.10 174.24 3gvp s GLY 231 N 0.05 1.51 -0.34 2.32 0.00 -0.23 -1.57 107.32 109.05 3gvp s GLY 231 Ca -0.02 -1.40 0.01 0.00 0.00 0.00 0.00 44.72 43.32 3gvp s GLY 231 CO 0.03 -1.36 0.31 0.00 0.00 0.00 0.00 173.10 172.08 3gvp n THR 233 N 4.51 0.00 -2.35 0.00 -2.24 -1.01 -1.15 114.28 112.05 3gvp n THR 233 Ca 0.07 -1.54 -0.41 0.00 -2.27 0.00 0.00 64.05 59.90 3gvp n THR 233 Cb 0.44 0.80 -0.03 0.00 -2.10 0.00 0.00 70.33 69.43 3gvp n THR 233 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3gvp s HIS 234 N -3.07 3.40 -1.01 4.78 3.76 -1.26 -1.82 115.29 120.07 3gvp s HIS 234 Ca 0.25 1.47 -0.15 0.00 -0.15 0.00 0.00 55.06 56.49 3gvp s HIS 234 Cb 0.01 -3.44 0.19 0.00 1.11 0.00 0.00 32.58 30.44 3gvp s HIS 234 CO 0.18 -1.19 1.12 0.42 -0.85 0.00 0.00 174.74 174.42 3gvp s ILE 235 N -0.48 5.22 0.38 0.60 -1.09 -1.26 -4.66 121.20 119.90 3gvp s ILE 235 Ca 0.50 -2.36 0.05 0.00 -2.23 0.00 0.00 60.65 56.62 3gvp s ILE 235 Cb -0.34 -4.71 -0.07 0.00 -1.58 0.00 0.00 42.46 35.76 3gvp s ILE 235 CO 0.40 -1.38 0.03 0.42 -1.23 0.00 0.00 174.94 173.19 3gvp s THR 236 N 1.18 1.63 0.39 2.92 -4.23 -1.26 -1.20 115.64 115.07 3gvp s THR 236 Ca 0.32 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.90 3gvp s THR 236 Cb -0.06 -2.88 0.22 0.00 1.34 0.00 0.00 72.50 71.12 3gvp s THR 236 CO -0.07 0.00 1.99 0.00 -0.54 0.00 0.00 174.62 176.00 3gvp h ALA 237 N 1.89 1.60 -0.30 3.99 0.00 -1.93 -0.76 119.26 123.74 3gvp h ALA 237 Ca -0.43 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 3gvp h ALA 237 Cb 1.24 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3gvp h ALA 237 CO 0.76 0.32 -0.15 1.96 0.00 0.00 0.00 179.25 182.14 3gvp h GLN 238 N 0.47 0.64 -0.83 0.00 7.50 -1.93 -2.72 115.11 118.24 3gvp h GLN 238 Ca 0.12 -0.28 -0.02 0.00 0.50 0.00 0.00 58.65 58.97 3gvp h GLN 238 Cb 0.11 -0.02 -0.04 0.00 0.05 0.00 0.00 27.48 27.58 3gvp h GLN 238 CO -0.01 0.86 0.45 1.15 -1.50 0.00 0.00 178.83 179.78 3gvp h THR 239 N 0.39 1.24 -0.98 -0.54 2.02 -1.70 -2.30 112.91 111.06 3gvp h THR 239 Ca 0.07 -0.61 0.13 0.00 0.77 0.00 0.00 66.41 66.77 3gvp h THR 239 Cb 0.67 0.13 -0.09 0.00 -1.74 0.00 0.00 68.15 67.12 3gvp h THR 239 CO 0.04 0.27 0.60 0.00 0.37 0.00 0.00 175.52 176.81 3gvp h ALA 240 N 1.34 1.48 -0.48 6.16 0.00 -1.04 -0.34 119.26 126.37 3gvp h ALA 240 Ca 0.29 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 3gvp h ALA 240 Cb 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3gvp h ALA 240 CO -0.05 0.17 -0.03 0.28 0.00 0.00 0.00 179.25 179.62 3gvp h VAL 241 N 0.93 1.25 0.25 0.00 2.07 -1.10 -1.19 116.25 118.46 3gvp h VAL 241 Ca 0.49 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 3gvp h VAL 241 Cb 0.53 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 3gvp h VAL 241 CO -0.28 0.38 -0.12 0.25 0.02 0.00 0.00 177.57 177.82 3gvp h LEU 242 N 0.76 -0.28 -0.70 2.57 5.85 -1.02 -1.34 115.31 121.15 3gvp h LEU 242 Ca 0.14 -0.15 0.11 0.00 0.84 0.00 0.00 57.88 58.82 3gvp h LEU 242 Cb 0.51 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 3gvp h LEU 242 CO 0.03 -0.01 0.31 0.24 -0.34 0.00 0.00 178.44 178.67 3gvp h MET 243 N -0.56 0.50 0.00 1.25 2.86 -0.88 0.19 114.93 118.30 3gvp h MET 243 Ca -0.03 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3gvp h MET 243 Cb 0.41 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.96 3gvp h MET 243 CO 0.06 0.33 0.00 0.93 1.06 0.00 0.00 176.91 179.29 3gvp h GLU 244 N 0.52 0.00 -0.21 1.72 5.08 -1.22 -1.44 114.58 119.03 3gvp h GLU 244 Ca 0.36 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.57 3gvp h GLU 244 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3gvp h GLU 244 CO -0.31 0.00 -0.47 1.15 -1.00 0.00 0.00 179.01 178.38 3gvp h THR 245 N 0.00 1.31 -0.06 1.13 2.02 0.19 -1.70 112.91 115.80 3gvp h THR 245 Ca 0.00 -1.67 -0.01 0.00 0.77 0.00 0.00 66.41 65.50 3gvp h THR 245 Cb 0.67 1.65 -0.00 0.00 -1.74 0.00 0.00 68.15 68.73 3gvp h THR 245 CO 0.00 0.52 -0.02 -0.07 0.37 0.00 0.00 175.52 176.32 3gvp h LEU 246 N 0.43 0.11 -0.67 2.58 3.38 -0.23 -2.38 115.31 118.54 3gvp h LEU 246 Ca 0.03 -0.38 0.08 0.00 0.09 0.00 0.00 57.88 57.69 3gvp h LEU 246 Cb 0.98 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.59 3gvp h LEU 246 CO 0.09 0.47 -0.54 1.23 0.09 0.00 0.00 178.44 179.78 3gvp h GLY 247 N -0.24 -0.80 1.22 0.83 0.00 -1.39 -1.83 103.07 100.85 3gvp h GLY 247 Ca 0.01 0.71 0.11 0.00 0.00 0.00 0.00 47.33 48.16 3gvp h GLY 247 CO 0.01 -0.07 0.29 0.00 0.00 0.00 0.00 176.54 176.76 3gvp h ALA 248 N 0.33 2.28 -0.00 3.60 0.00 -1.14 0.31 119.26 124.64 3gvp h ALA 248 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3gvp h ALA 248 Cb 0.53 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3gvp h ALA 248 CO -0.75 -0.48 -0.18 1.28 0.00 0.00 0.00 179.25 179.12 3gvp n LEU 249 N -4.27 0.28 0.00 0.00 7.99 -0.89 -4.60 117.00 115.51 3gvp n LEU 249 Ca 0.06 0.21 0.00 0.00 -0.01 0.00 0.00 56.01 56.27 3gvp n LEU 249 Cb 0.47 -0.33 0.00 0.00 -0.11 0.00 0.00 43.42 43.45 3gvp n LEU 249 CO 0.34 0.06 0.00 0.61 -1.51 0.00 0.00 177.39 176.89 3gvp n GLY 250 N 1.43 1.03 3.68 -0.72 0.00 0.11 -1.02 105.19 109.71 3gvp n GLY 250 Ca 0.09 -0.09 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3gvp n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gvp n ALA 251 N 0.00 0.80 -2.80 4.61 0.00 -0.74 -4.45 120.51 117.94 3gvp n ALA 251 Ca 0.00 0.04 -0.35 0.00 0.00 0.00 0.00 53.44 53.13 3gvp n ALA 251 Cb 0.00 -2.23 -0.09 0.00 0.00 0.00 0.00 19.45 17.13 3gvp n ALA 251 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3gvp s GLN 252 N -2.94 3.53 0.05 0.00 -0.21 -0.75 -3.92 119.66 115.43 3gvp s GLN 252 Ca 0.76 -0.34 0.03 0.00 0.02 0.00 0.00 55.36 55.83 3gvp s GLN 252 Cb -0.41 -3.04 -0.03 0.00 1.00 0.00 0.00 33.01 30.53 3gvp s GLN 252 CO 0.46 0.50 -0.10 0.00 -2.12 0.00 0.00 175.29 174.03 3gvp s ARG 254 N -1.60 0.76 -0.07 0.00 0.52 -0.68 -4.20 118.95 113.67 3gvp s ARG 254 Ca -0.07 -1.10 -0.17 0.00 -0.52 0.00 0.00 55.73 53.86 3gvp s ARG 254 Cb -0.10 -0.37 0.04 0.00 0.52 0.00 0.00 34.95 35.04 3gvp s ARG 254 CO 0.01 0.04 0.41 -0.46 0.02 0.00 0.00 175.30 175.32 3gvp s TRP 255 N -2.50 -0.36 0.15 -0.53 -0.11 -0.27 -1.07 118.94 114.25 3gvp s TRP 255 Ca 0.03 0.72 0.03 0.00 1.22 0.00 0.00 56.10 58.11 3gvp s TRP 255 Cb -0.02 0.17 -0.05 0.00 -1.50 0.00 0.00 33.47 32.07 3gvp s TRP 255 CO -0.01 -0.36 -0.06 0.00 -4.62 0.00 0.00 176.95 171.90 3gvp s ALA 256 N -0.73 1.39 0.56 5.86 0.00 -0.36 -1.06 121.76 127.43 3gvp s ALA 256 Ca -0.08 -1.52 -0.18 0.00 0.00 0.00 0.00 51.96 50.18 3gvp s ALA 256 Cb -0.04 0.23 -0.05 0.00 0.00 0.00 0.00 23.12 23.26 3gvp s ALA 256 CO 0.04 -0.19 1.08 0.00 0.00 0.00 0.00 175.76 176.69 3gvp s ALA 257 N -3.47 2.73 -1.83 0.00 0.00 -1.24 -2.40 121.76 115.54 3gvp s ALA 257 Ca 0.19 0.60 0.20 0.00 0.00 0.00 0.00 51.96 52.95 3gvp s ALA 257 Cb 0.04 -3.29 0.54 0.00 0.00 0.00 0.00 23.12 20.41 3gvp s ALA 257 CO 0.01 -0.72 1.45 0.00 0.00 0.00 0.00 175.76 176.51 3gvp s ASN 259 N -1.07 -0.74 0.31 0.00 3.84 -1.26 -4.98 114.94 111.03 3gvp s ASN 259 Ca 0.42 1.39 0.16 0.00 0.21 0.00 0.00 52.86 55.04 3gvp s ASN 259 Cb 0.22 1.39 0.28 0.00 -0.55 0.00 0.00 41.25 42.59 3gvp s ASN 259 CO 0.29 -0.28 1.54 0.16 -2.79 0.00 0.00 177.10 176.03 3gvp h ILE 260 N 3.93 0.91 0.00 -5.21 3.07 -1.91 -3.33 117.51 114.97 3gvp h ILE 260 Ca -0.29 -2.03 -0.33 0.00 1.55 0.00 0.00 64.86 63.76 3gvp h ILE 260 Cb 1.16 2.27 -0.06 0.00 -0.27 0.00 0.00 36.82 39.92 3gvp h ILE 260 CO 0.08 0.47 -2.23 -1.22 -1.05 0.00 0.00 178.15 174.20 3gvp n TYR 261 N -3.33 0.19 0.42 0.16 0.53 -1.26 -0.75 117.16 113.11 3gvp n TYR 261 Ca 0.01 0.07 0.12 0.00 -1.02 0.00 0.00 57.90 57.08 3gvp n TYR 261 Cb 0.66 -1.00 0.49 0.00 -1.03 0.00 0.00 39.34 38.46 3gvp n TYR 261 CO 0.00 0.00 0.00 -1.13 -1.02 0.00 0.00 176.86 174.71 3gvp n SER 262 N -2.77 0.71 -4.77 7.72 3.41 -1.25 -4.40 113.62 112.26 3gvp n SER 262 Ca -0.28 0.66 -0.40 0.00 -0.26 0.00 0.00 58.87 58.59 3gvp n SER 262 Cb 1.10 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 3gvp n SER 262 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3gvp s THR 263 N -3.30 2.16 -0.48 6.66 2.01 -1.26 -4.55 115.64 116.88 3gvp s THR 263 Ca 0.05 0.16 -0.16 0.00 0.31 0.00 0.00 61.69 62.05 3gvp s THR 263 Cb 0.10 -3.10 0.08 0.00 0.01 0.00 0.00 72.50 69.59 3gvp s THR 263 CO 0.42 0.03 0.42 -0.76 -0.69 0.00 0.00 174.62 174.04 3gvp s LEU 264 N -2.34 5.64 0.28 4.42 1.02 -0.34 -4.46 118.68 122.90 3gvp s LEU 264 Ca 0.56 -1.35 0.01 0.00 0.02 0.00 0.00 54.13 53.37 3gvp s LEU 264 Cb -0.44 -2.20 0.55 0.00 0.02 0.00 0.00 46.19 44.11 3gvp s LEU 264 CO 0.58 -0.69 1.82 0.78 0.02 0.00 0.00 176.35 178.87 3gvp h ASN 265 N 8.79 0.86 -0.68 2.29 2.35 -1.93 -1.17 115.58 126.09 3gvp h ASN 265 Ca -0.29 0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.45 3gvp h ASN 265 Cb 1.11 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 39.34 3gvp h ASN 265 CO 0.90 0.45 0.16 -0.33 -1.65 0.00 0.00 177.43 176.96 3gvp h GLU 266 N 0.93 1.09 -0.44 0.81 3.07 -1.92 0.15 114.58 118.28 3gvp h GLU 266 Ca 0.49 -0.27 -0.10 0.00 -0.50 0.00 0.00 59.36 58.98 3gvp h GLU 266 Cb 0.52 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.27 3gvp h GLU 266 CO -0.28 0.98 -0.11 0.28 -1.40 0.00 0.00 179.01 178.47 3gvp h VAL 267 N 1.02 1.27 -0.27 3.13 2.07 -1.60 -2.23 116.25 119.64 3gvp h VAL 267 Ca 0.21 -1.23 0.05 0.00 0.82 0.00 0.00 66.70 66.55 3gvp h VAL 267 Cb 0.38 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 3gvp h VAL 267 CO 0.00 0.42 0.00 0.00 0.02 0.00 0.00 177.57 178.02 3gvp h ALA 268 N 0.86 0.24 -0.47 1.67 0.00 -0.60 -1.75 119.26 119.22 3gvp h ALA 268 Ca 0.11 0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.19 3gvp h ALA 268 Cb 0.65 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 3gvp h ALA 268 CO 0.04 -0.41 -0.02 0.00 0.00 0.00 0.00 179.25 178.86 3gvp h ALA 269 N 1.23 0.42 -0.13 0.00 0.00 -0.61 -0.42 119.26 119.75 3gvp h ALA 269 Ca 0.13 0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.07 3gvp h ALA 269 Cb 0.17 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3gvp h ALA 269 CO -0.21 -0.40 -0.44 0.00 0.00 0.00 0.00 179.25 178.20 3gvp h ALA 270 N 1.43 1.01 -0.46 0.00 0.00 -1.06 0.19 119.26 120.37 3gvp h ALA 270 Ca 0.23 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 3gvp h ALA 270 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3gvp h ALA 270 CO -0.41 0.62 -0.16 -0.07 0.00 0.00 0.00 179.25 179.24 3gvp h LEU 271 N 0.26 0.94 0.40 0.00 3.38 -0.92 -2.77 115.31 116.60 3gvp h LEU 271 Ca 0.02 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 3gvp h LEU 271 Cb 0.88 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3gvp h LEU 271 CO 0.07 1.11 -0.36 0.00 0.09 0.00 0.00 178.44 179.35 3gvp h ALA 272 N 0.87 -0.79 -0.94 1.53 0.00 -0.38 0.90 119.26 120.44 3gvp h ALA 272 Ca 0.11 -0.13 0.24 0.00 0.00 0.00 0.00 54.91 55.13 3gvp h ALA 272 Cb 0.72 0.50 -0.13 0.00 0.00 0.00 0.00 17.79 18.88 3gvp h ALA 272 CO 0.05 -0.98 0.47 1.49 0.00 0.00 0.00 179.25 180.29 3gvp h GLU 273 N -0.77 0.44 -0.01 0.00 4.57 -0.65 0.82 114.58 119.00 3gvp h GLU 273 Ca -0.03 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3gvp h GLU 273 Cb 0.67 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 3gvp h GLU 273 CO -0.04 0.29 -0.02 -1.13 -1.18 0.00 0.00 179.01 176.94 3gvp n SER 274 N -4.99 0.86 -0.03 1.04 3.41 -1.05 -4.74 113.62 108.13 3gvp n SER 274 Ca 0.24 -1.22 0.00 0.00 -0.26 0.00 0.00 58.87 57.63 3gvp n SER 274 Cb 0.71 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 3gvp n SER 274 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gvp n GLY 275 N 1.13 1.32 3.61 5.00 0.00 0.29 -5.08 105.19 111.45 3gvp n GLY 275 Ca 0.20 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3gvp n GLY 275 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gvp s PHE 276 N -2.05 3.25 -0.79 1.61 0.08 0.21 -4.99 117.98 115.29 3gvp s PHE 276 Ca 0.00 0.55 -0.26 0.00 0.12 0.00 0.00 56.93 57.34 3gvp s PHE 276 Cb 0.00 -2.75 -0.13 0.00 -0.57 0.00 0.00 43.02 39.57 3gvp s PHE 276 CO 0.00 -0.32 2.38 -2.14 -0.10 0.00 0.00 175.22 175.03 3gvp s PRO 277 N 2.32 1.67 -0.13 0.24 0.02 -1.25 -4.04 135.00 133.83 3gvp s PRO 277 Ca 0.21 0.46 0.01 0.00 0.02 0.00 0.00 61.00 61.70 3gvp s PRO 277 Cb -0.16 -4.80 -0.01 0.00 0.02 0.00 0.00 34.50 29.56 3gvp s PRO 277 CO 0.10 -4.36 -0.17 0.08 -0.33 0.00 0.00 177.00 172.32 3gvp s VAL 278 N 14.44 2.68 -0.42 3.83 1.01 -1.26 -1.12 120.40 139.56 3gvp s VAL 278 Ca 0.91 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 62.12 3gvp s VAL 278 Cb -0.13 -2.10 0.12 0.00 0.00 0.00 0.00 36.38 34.28 3gvp s VAL 278 CO 0.08 0.53 0.18 -0.36 0.00 0.00 0.00 175.10 175.54 3gvp s PHE 279 N 0.43 2.50 -0.28 5.22 0.08 -0.22 -0.15 117.98 125.57 3gvp s PHE 279 Ca -0.12 -2.56 -0.26 0.00 0.12 0.00 0.00 56.93 54.10 3gvp s PHE 279 Cb -0.16 -2.24 0.17 0.00 -0.57 0.00 0.00 43.02 40.21 3gvp s PHE 279 CO 0.06 -0.82 1.28 0.00 -0.10 0.00 0.00 175.22 175.64 3gvp s ALA 280 N 0.54 -2.11 0.25 5.36 0.00 -0.83 -3.64 121.76 121.31 3gvp s ALA 280 Ca 0.15 1.75 -0.19 0.00 0.00 0.00 0.00 51.96 53.67 3gvp s ALA 280 Cb -0.23 -1.54 0.02 0.00 0.00 0.00 0.00 23.12 21.37 3gvp s ALA 280 CO -0.06 -0.18 0.63 1.67 0.00 0.00 0.00 175.76 177.82 3gvp s TRP 281 N -0.22 -0.10 0.45 0.00 -2.14 -1.26 -4.41 118.94 111.26 3gvp s TRP 281 Ca 0.06 -0.30 -0.22 0.00 2.66 0.00 0.00 56.10 58.30 3gvp s TRP 281 Cb -0.04 0.54 -0.09 0.00 -3.10 0.00 0.00 33.47 30.78 3gvp s TRP 281 CO -0.10 -1.10 1.05 0.21 -2.66 0.00 0.00 176.95 174.35 3gvp s LYS 282 N -3.92 3.95 -1.31 3.25 2.20 -1.26 -3.90 119.74 118.75 3gvp s LYS 282 Ca 0.12 1.45 -0.04 0.00 -0.36 0.00 0.00 55.97 57.14 3gvp s LYS 282 Cb -0.04 -2.30 0.01 0.00 -1.51 0.00 0.00 37.83 34.00 3gvp s LYS 282 CO 0.04 -0.32 0.97 0.41 -0.36 0.00 0.00 175.35 176.10 3gvp n GLY 283 N 0.04 -0.41 3.72 5.54 0.00 0.07 -4.96 105.19 109.19 3gvp n GLY 283 Ca 0.07 0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 3gvp n GLY 283 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gvp s GLU 284 N -5.92 1.56 0.31 1.61 2.02 -0.56 -5.01 118.70 112.71 3gvp s GLU 284 Ca 0.24 1.27 0.07 0.00 0.02 0.00 0.00 54.97 56.57 3gvp s GLU 284 Cb -0.11 -1.81 -0.02 0.00 0.10 0.00 0.00 34.13 32.29 3gvp s GLU 284 CO 0.76 -2.17 0.37 -1.54 0.02 0.00 0.00 175.26 172.70 3gvp s SER 285 N -3.08 5.74 0.27 -0.19 1.04 -1.26 -4.89 113.70 111.32 3gvp s SER 285 Ca 0.64 -0.27 -0.00 0.00 0.48 0.00 0.00 55.95 56.80 3gvp s SER 285 Cb -0.20 -1.25 0.53 0.00 0.10 0.00 0.00 66.02 65.21 3gvp s SER 285 CO 0.57 -0.31 1.80 -0.33 0.98 0.00 0.00 173.24 175.95 3gvp h GLU 286 N 1.12 0.77 0.06 4.02 4.39 -2.00 -1.17 114.58 121.77 3gvp h GLU 286 Ca -0.47 -0.05 -0.28 0.00 0.34 0.00 0.00 59.36 58.91 3gvp h GLU 286 Cb 1.25 -0.17 0.02 0.00 -0.10 0.00 0.00 28.75 29.75 3gvp h GLU 286 CO 0.57 0.51 -1.13 -0.44 -1.16 0.00 0.00 179.01 177.35 3gvp h ASP 287 N 0.80 0.87 -0.65 1.42 3.45 -2.00 -3.06 116.42 117.24 3gvp h ASP 287 Ca 0.47 -0.75 0.04 0.00 0.43 0.00 0.00 57.03 57.22 3gvp h ASP 287 Cb 0.56 -0.27 -0.04 0.00 -0.56 0.00 0.00 39.33 39.03 3gvp h ASP 287 CO -0.31 1.55 0.43 0.44 -1.57 0.00 0.00 179.24 179.78 3gvp h ASP 288 N 0.33 0.66 0.00 6.45 3.45 -1.81 0.84 116.42 126.34 3gvp h ASP 288 Ca -0.15 -0.01 0.03 0.00 0.43 0.00 0.00 57.03 57.33 3gvp h ASP 288 Cb 1.79 -0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 40.37 3gvp h ASP 288 CO 0.22 0.45 -0.27 0.15 -1.57 0.00 0.00 179.24 178.21 3gvp h PHE 289 N 0.76 -0.74 -0.01 4.55 3.57 -1.13 0.14 116.94 124.08 3gvp h PHE 289 Ca 0.26 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.66 3gvp h PHE 289 Cb 0.10 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 3gvp h PHE 289 CO -0.00 -0.37 -0.58 -1.49 -2.23 0.00 0.00 178.31 173.65 3gvp h TRP 290 N -0.42 0.04 -0.25 0.41 4.06 -1.40 -2.25 115.95 116.13 3gvp h TRP 290 Ca 0.06 -0.02 0.03 0.00 2.06 0.00 0.00 58.89 61.03 3gvp h TRP 290 Cb 0.50 -0.01 -0.03 0.00 -1.00 0.00 0.00 29.16 28.62 3gvp h TRP 290 CO -0.30 0.60 0.06 2.35 -3.56 0.00 0.00 178.44 177.59 3gvp h TRP 291 N 0.03 0.10 0.01 0.49 7.01 -0.52 0.16 115.95 123.22 3gvp h TRP 291 Ca -0.01 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 3gvp h TRP 291 Cb 1.03 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 28.08 3gvp h TRP 291 CO 0.00 0.03 -0.01 0.00 -2.79 0.00 0.00 178.44 175.68 3gvp h ILE 293 N -0.12 0.52 -0.80 0.00 2.04 -1.26 -1.98 117.51 115.91 3gvp h ILE 293 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 3gvp h ILE 293 Cb 0.11 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 3gvp h ILE 293 CO 0.00 0.00 0.48 -0.78 0.00 0.00 0.00 178.15 177.86 3gvp h ASP 294 N -0.03 0.96 0.20 1.72 1.82 -0.45 -1.53 116.42 119.11 3gvp h ASP 294 Ca 0.21 -0.05 -0.04 0.00 -0.39 0.00 0.00 57.03 56.76 3gvp h ASP 294 Cb 0.35 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 40.12 3gvp h ASP 294 CO -0.47 0.74 -0.19 0.03 -1.61 0.00 0.00 179.24 177.74 3gvp h ARG 295 N 1.11 0.00 -0.24 0.28 2.47 -0.56 0.20 114.38 117.64 3gvp h ARG 295 Ca 0.29 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.99 3gvp h ARG 295 Cb -0.05 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.26 3gvp h ARG 295 CO -0.05 0.19 0.07 0.00 0.56 0.00 0.00 179.97 180.73 3gvp h VAL 297 N 0.22 1.61 -1.88 0.00 2.07 -0.99 -3.46 116.25 113.82 3gvp h VAL 297 Ca 0.08 -3.23 -0.12 0.00 0.82 0.00 0.00 66.70 64.24 3gvp h VAL 297 Cb 0.26 2.88 -0.29 0.00 -1.52 0.00 0.00 31.29 32.62 3gvp h VAL 297 CO -0.00 0.93 -0.45 0.21 0.02 0.00 0.00 177.57 178.28 3gvp s ASN 298 N -6.91 0.03 0.00 0.57 3.04 0.67 -4.70 114.94 107.64 3gvp s ASN 298 Ca -0.01 0.37 0.00 0.00 0.04 0.00 0.00 52.86 53.26 3gvp s ASN 298 Cb 0.09 1.24 0.00 0.00 -1.54 0.00 0.00 41.25 41.04 3gvp s ASN 298 CO 0.85 -0.29 0.00 0.52 -3.04 0.00 0.00 177.10 175.14 3gvp n VAL 299 N 5.37 0.00 0.00 -5.21 0.31 -1.26 -4.28 118.33 113.26 3gvp n VAL 299 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 3gvp n VAL 299 Cb 0.50 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 3gvp n VAL 299 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3gvp n GLU 300 N 0.00 0.00 -0.40 5.55 2.13 -1.26 -3.43 120.64 123.24 3gvp n GLU 300 Ca 0.00 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.90 3gvp n GLU 300 Cb 0.00 0.00 0.18 0.00 0.27 0.00 0.00 31.44 31.89 3gvp n GLU 300 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3gvp n GLY 301 N 0.00 5.00 3.09 8.31 0.00 -1.26 -4.98 105.19 115.36 3gvp n GLY 301 Ca 0.00 -1.24 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 3gvp n GLY 301 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3gvp s TRP 302 N -3.07 3.05 -0.27 1.61 -0.00 -1.22 -5.09 118.94 113.96 3gvp s TRP 302 Ca 0.35 -2.04 -0.08 0.00 -0.00 0.00 0.00 56.10 54.34 3gvp s TRP 302 Cb 0.33 -1.92 -0.02 0.00 -0.00 0.00 0.00 33.47 31.86 3gvp s TRP 302 CO -0.03 -0.85 0.08 1.14 -0.00 0.00 0.00 176.95 177.29 3gvp s GLN 303 N 1.18 3.52 0.32 5.86 -2.07 -1.26 -4.85 119.66 122.36 3gvp s GLN 303 Ca -0.03 -0.57 -0.29 0.00 -1.82 0.00 0.00 55.36 52.64 3gvp s GLN 303 Cb -0.17 -3.37 -0.11 0.00 -1.09 0.00 0.00 33.01 28.27 3gvp s GLN 303 CO -0.08 -0.26 1.51 -1.25 -1.32 0.00 0.00 175.29 173.88 3gvp s PRO 304 N 1.60 4.16 0.00 9.60 0.04 -1.26 -4.86 135.00 144.27 3gvp s PRO 304 Ca 0.06 2.50 0.08 0.00 0.04 0.00 0.00 61.00 63.68 3gvp s PRO 304 Cb -0.16 -3.02 0.07 0.00 0.04 0.00 0.00 34.50 31.43 3gvp s PRO 304 CO 0.04 -0.53 0.78 0.27 0.04 0.00 0.00 177.00 177.60 3gvp n ASN 305 N 1.50 1.73 -3.86 6.66 6.94 -0.39 -4.65 115.26 123.20 3gvp n ASN 305 Ca 0.05 -1.37 -0.12 0.00 -0.02 0.00 0.00 54.58 53.12 3gvp n ASN 305 Cb 0.39 -0.01 -0.11 0.00 -2.36 0.00 0.00 39.78 37.69 3gvp n ASN 305 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 3gvp s MET 306 N -0.69 0.32 -0.08 -3.83 -1.94 -0.88 0.05 119.30 112.25 3gvp s MET 306 Ca 0.10 -0.13 0.05 0.00 -1.71 0.00 0.00 55.69 54.00 3gvp s MET 306 Cb 0.07 0.14 -0.00 0.00 2.01 0.00 0.00 34.83 37.04 3gvp s MET 306 CO 0.10 -0.06 -0.23 0.42 -0.01 0.00 0.00 175.02 175.24 3gvp s ILE 307 N -0.69 1.93 -0.17 2.53 1.01 -0.64 -1.55 121.20 123.63 3gvp s ILE 307 Ca -0.08 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 59.62 3gvp s ILE 307 Cb -0.05 -1.66 0.02 0.00 0.01 0.00 0.00 42.46 40.79 3gvp s ILE 307 CO 0.01 0.53 -0.17 -0.22 0.00 0.00 0.00 174.94 175.09 3gvp s LEU 308 N 0.19 1.98 0.01 2.97 2.96 -0.61 -0.49 118.68 125.69 3gvp s LEU 308 Ca -0.13 -0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 53.17 3gvp s LEU 308 Cb -0.16 -1.35 -0.01 0.00 0.50 0.00 0.00 46.19 45.18 3gvp s LEU 308 CO 0.06 -0.03 0.00 -0.62 -1.32 0.00 0.00 176.35 174.44 3gvp s ASP 309 N 1.37 0.11 -0.38 3.68 3.68 -0.15 -1.27 116.67 123.71 3gvp s ASP 309 Ca 0.04 -0.24 0.01 0.00 2.13 0.00 0.00 52.55 54.49 3gvp s ASP 309 Cb -0.13 0.08 0.12 0.00 -1.45 0.00 0.00 42.92 41.54 3gvp s ASP 309 CO -0.12 -0.17 0.18 -0.62 0.13 0.00 0.00 175.17 174.57 3gvp s ASP 310 N -0.78 3.73 0.00 -0.34 2.15 -0.30 -1.29 116.67 119.83 3gvp s ASP 310 Ca -0.09 -2.18 0.00 0.00 0.43 0.00 0.00 52.55 50.71 3gvp s ASP 310 Cb -0.05 -0.90 0.00 0.00 -0.30 0.00 0.00 42.92 41.67 3gvp s ASP 310 CO -0.00 -0.33 0.00 0.61 -0.17 0.00 0.00 175.17 175.27 3gvp n GLY 311 N 4.12 4.35 1.01 2.66 0.00 -1.26 -4.77 105.19 111.30 3gvp n GLY 311 Ca 0.05 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.19 3gvp n GLY 311 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gvp n GLY 312 N 0.00 0.73 0.19 -0.02 0.00 -1.26 -3.94 105.19 100.89 3gvp n GLY 312 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3gvp n GLY 312 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gvp h ASP 313 N 0.00 0.90 -0.73 1.61 3.32 -1.96 0.34 116.42 119.90 3gvp h ASP 313 Ca 0.00 -0.78 -0.06 0.00 0.02 0.00 0.00 57.03 56.21 3gvp h ASP 313 Cb 0.00 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.24 3gvp h ASP 313 CO 0.00 1.58 0.21 0.25 -1.72 0.00 0.00 179.24 179.56 3gvp h LEU 314 N 0.34 1.08 -0.24 1.55 6.46 -1.93 -1.51 115.31 121.06 3gvp h LEU 314 Ca -0.16 -0.22 -0.03 0.00 -0.12 0.00 0.00 57.88 57.36 3gvp h LEU 314 Cb 1.80 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 41.44 3gvp h LEU 314 CO 0.22 1.02 0.05 0.74 -0.62 0.00 0.00 178.44 179.85 3gvp h THR 315 N 1.10 1.22 0.15 1.05 2.02 -1.95 -1.69 112.91 114.80 3gvp h THR 315 Ca 0.23 -0.72 0.01 0.00 0.77 0.00 0.00 66.41 66.70 3gvp h THR 315 Cb 0.33 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 3gvp h THR 315 CO -0.00 0.23 -0.18 -0.74 0.37 0.00 0.00 175.52 175.20 3gvp h HIS 316 N 0.21 -0.46 -0.44 3.16 -0.00 -0.93 0.42 115.15 117.11 3gvp h HIS 316 Ca 0.07 0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.54 3gvp h HIS 316 Cb 0.30 0.19 -0.09 0.00 -0.00 0.00 0.00 27.41 27.80 3gvp h HIS 316 CO 0.02 -0.27 -0.21 2.35 -0.00 0.00 0.00 177.93 179.82 3gvp h TRP 317 N -0.37 -0.52 -0.61 5.26 2.91 -1.18 0.17 115.95 121.61 3gvp h TRP 317 Ca 0.01 0.05 -0.06 0.00 1.13 0.00 0.00 58.89 60.02 3gvp h TRP 317 Cb 0.36 0.30 -0.03 0.00 -0.51 0.00 0.00 29.16 29.28 3gvp h TRP 317 CO -0.16 -0.29 0.15 0.82 -1.03 0.00 0.00 178.44 177.93 3gvp h ILE 318 N -0.12 1.24 0.61 2.65 2.04 -1.07 -0.34 117.51 122.52 3gvp h ILE 318 Ca 0.21 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.16 3gvp h ILE 318 Cb 0.44 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 3gvp h ILE 318 CO -0.52 0.34 -0.34 0.22 0.00 0.00 0.00 178.15 177.85 3gvp h TYR 319 N 0.92 -0.89 0.04 1.37 3.20 0.21 -1.55 116.97 120.27 3gvp h TYR 319 Ca 0.20 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 3gvp h TYR 319 Cb 0.33 0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.91 3gvp h TYR 319 CO 0.02 -0.53 -0.02 0.87 -1.64 0.00 0.00 178.16 176.87 3gvp h LYS 320 N -0.88 -0.05 0.00 1.82 1.79 -0.89 -3.19 116.57 115.17 3gvp h LYS 320 Ca -0.08 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.18 3gvp h LYS 320 Cb 0.70 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.33 3gvp h LYS 320 CO 0.10 0.48 -1.14 0.87 -1.08 0.00 0.00 179.45 178.68 3gvp h LYS 321 N -0.60 0.00 -1.80 3.15 1.57 -1.17 -3.39 116.57 114.34 3gvp h LYS 321 Ca -0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 3gvp h LYS 321 Cb 0.54 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.45 3gvp h LYS 321 CO 0.01 0.76 -0.99 0.66 -0.57 0.00 0.00 179.45 179.32 3gvp n TYR 322 N -3.22 1.86 -0.26 -1.35 4.02 -0.58 -4.97 117.16 112.65 3gvp n TYR 322 Ca -0.05 -3.55 0.18 0.00 -0.01 0.00 0.00 57.90 54.47 3gvp n TYR 322 Cb 0.93 -0.38 0.48 0.00 -0.02 0.00 0.00 39.34 40.35 3gvp n TYR 322 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 3gvp h PRO 323 N 2.94 0.45 -0.19 -0.72 0.13 -1.59 -0.84 132.00 132.18 3gvp h PRO 323 Ca 0.09 -0.03 -0.17 0.00 -0.87 0.00 0.00 66.00 65.03 3gvp h PRO 323 Cb 0.88 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3gvp h PRO 323 CO 0.63 0.30 -0.54 -0.91 -0.23 0.00 0.00 178.00 177.25 3gvp h ASN 324 N 0.46 0.81 -0.56 1.44 2.35 -1.89 -2.72 115.58 115.47 3gvp h ASN 324 Ca 0.49 -0.58 0.01 0.00 -0.55 0.00 0.00 56.30 55.66 3gvp h ASN 324 Cb 1.13 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.23 3gvp h ASN 324 CO -0.21 1.25 0.37 -0.03 -1.65 0.00 0.00 177.43 177.16 3gvp h MET 325 N 0.41 0.74 -0.78 0.81 4.05 -1.67 -2.88 114.93 115.61 3gvp h MET 325 Ca -0.01 -0.04 0.18 0.00 -0.28 0.00 0.00 59.70 59.54 3gvp h MET 325 Cb 1.16 -0.17 -0.12 0.00 -0.80 0.00 0.00 31.60 31.68 3gvp h MET 325 CO 0.12 0.49 0.21 0.35 0.23 0.00 0.00 176.91 178.30 3gvp h PHE 326 N 0.76 0.32 0.00 1.39 3.57 -1.04 0.04 116.94 121.98 3gvp h PHE 326 Ca 0.21 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.75 3gvp h PHE 326 Cb -0.08 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.63 3gvp h PHE 326 CO -0.04 -0.10 0.00 0.87 -2.23 0.00 0.00 178.31 176.82 3gvp h LYS 327 N 0.28 0.00 0.00 1.11 1.57 -1.27 -1.76 116.57 116.51 3gvp h LYS 327 Ca 0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.23 3gvp h LYS 327 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 3gvp h LYS 327 CO -0.54 0.00 -0.05 0.87 -0.57 0.00 0.00 179.45 179.16 3gvp h LYS 328 N 0.00 0.00 -6.33 3.15 1.79 -0.92 -3.47 116.57 110.79 3gvp h LYS 328 Ca 0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.93 3gvp h LYS 328 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 3gvp h LYS 328 CO 0.00 0.00 1.02 0.42 -1.08 0.00 0.00 179.45 179.81 3gvp s ILE 329 N -3.12 3.45 0.25 1.86 -1.09 -0.66 -4.85 121.20 117.04 3gvp s ILE 329 Ca 0.10 0.71 0.21 0.00 -2.23 0.00 0.00 60.65 59.44 3gvp s ILE 329 Cb 0.11 -3.46 0.19 0.00 -1.58 0.00 0.00 42.46 37.72 3gvp s ILE 329 CO 0.62 -0.04 1.85 0.11 -1.23 0.00 0.00 174.94 176.25 3gvp h LYS 330 N 8.89 0.00 -1.45 2.79 1.79 -0.72 -3.42 116.57 124.45 3gvp h LYS 330 Ca -0.40 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.17 3gvp h LYS 330 Cb 1.18 0.00 -0.27 0.00 -1.58 0.00 0.00 32.23 31.56 3gvp h LYS 330 CO 0.94 0.28 0.59 0.20 -1.08 0.00 0.00 179.45 180.38 3gvp s GLY 331 N -4.30 -0.03 -0.09 3.86 0.00 -1.23 -4.37 107.32 101.15 3gvp s GLY 331 Ca -0.01 2.80 0.04 0.00 0.00 0.00 0.00 44.72 47.55 3gvp s GLY 331 CO 0.66 1.72 -0.23 -0.42 0.00 0.00 0.00 173.10 174.83 3gvp s ILE 332 N -0.05 2.15 -0.19 0.90 1.01 0.16 -1.62 121.20 123.56 3gvp s ILE 332 Ca 0.04 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.70 3gvp s ILE 332 Cb -0.04 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.64 3gvp s ILE 332 CO -0.07 0.56 -0.16 -0.69 0.00 0.00 0.00 174.94 174.57 3gvp s VAL 333 N 0.24 1.95 -0.05 2.92 1.01 0.36 -0.34 120.40 126.49 3gvp s VAL 333 Ca -0.15 -1.01 0.05 0.00 0.00 0.00 0.00 61.98 60.87 3gvp s VAL 333 Cb -0.17 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 3gvp s VAL 333 CO 0.08 0.39 -0.20 -0.70 0.00 0.00 0.00 175.10 174.66 3gvp s GLU 334 N 1.30 2.06 -0.21 2.72 2.56 -1.23 -0.98 118.70 124.93 3gvp s GLU 334 Ca 0.02 -0.73 0.16 0.00 0.00 0.00 0.00 54.97 54.42 3gvp s GLU 334 Cb -0.14 -1.79 -0.24 0.00 2.00 0.00 0.00 34.13 33.96 3gvp s GLU 334 CO -0.11 0.31 0.03 -1.91 -0.56 0.00 0.00 175.26 173.03 3gvp n GLU 335 N 3.03 0.69 -2.94 4.30 4.07 -0.41 -3.88 120.64 125.48 3gvp n GLU 335 Ca -0.18 0.01 -0.35 0.00 -0.06 0.00 0.00 57.16 56.58 3gvp n GLU 335 Cb 0.53 -1.52 -0.06 0.00 -0.06 0.00 0.00 31.44 30.32 3gvp n GLU 335 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 3gvp s SER 336 N -5.62 7.09 0.17 4.31 1.04 -1.26 -4.80 113.70 114.64 3gvp s SER 336 Ca -0.13 1.59 -0.14 0.00 0.48 0.00 0.00 55.95 57.75 3gvp s SER 336 Cb 0.06 -2.49 0.13 0.00 0.10 0.00 0.00 66.02 63.82 3gvp s SER 336 CO 0.80 -0.11 1.74 0.58 0.98 0.00 0.00 173.24 177.23 3gvp h VAL 337 N 2.43 0.82 -0.31 5.02 2.07 -1.98 -0.40 116.25 123.89 3gvp h VAL 337 Ca -0.48 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 3gvp h VAL 337 Cb 1.19 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3gvp h VAL 337 CO 0.64 0.05 0.03 0.74 0.02 0.00 0.00 177.57 179.05 3gvp h THR 338 N 0.27 1.25 -0.48 2.57 2.02 -1.93 -0.47 112.91 116.13 3gvp h THR 338 Ca 0.21 -0.87 0.05 0.00 0.77 0.00 0.00 66.41 66.56 3gvp h THR 338 Cb 0.23 1.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 3gvp h THR 338 CO -0.24 0.28 0.23 1.23 0.37 0.00 0.00 175.52 177.39 3gvp h GLY 339 N 0.33 0.66 0.94 2.16 0.00 -1.66 -1.94 103.07 103.56 3gvp h GLY 339 Ca 0.09 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.28 3gvp h GLY 339 CO 0.01 0.09 0.15 -2.08 0.00 0.00 0.00 176.54 174.71 3gvp h VAL 340 N 0.44 1.03 -0.63 4.60 2.07 -0.84 -1.59 116.25 121.33 3gvp h VAL 340 Ca 0.21 -0.11 0.12 0.00 0.82 0.00 0.00 66.70 67.75 3gvp h VAL 340 Cb 0.14 0.69 -0.09 0.00 -1.52 0.00 0.00 31.29 30.51 3gvp h VAL 340 CO -0.17 0.06 0.13 -0.74 0.02 0.00 0.00 177.57 176.87 3gvp h HIS 341 N 0.31 0.20 -0.69 1.57 6.17 -0.85 -0.62 115.15 121.25 3gvp h HIS 341 Ca 0.10 0.04 -0.02 0.00 0.71 0.00 0.00 60.37 61.20 3gvp h HIS 341 Cb -0.00 0.01 -0.03 0.00 2.52 0.00 0.00 27.41 29.90 3gvp h HIS 341 CO -0.08 -0.05 0.34 0.00 0.71 0.00 0.00 177.93 178.85 3gvp h ARG 342 N 0.25 0.97 -0.73 5.26 3.08 -1.01 -1.05 114.38 121.16 3gvp h ARG 342 Ca 0.33 -0.12 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 3gvp h ARG 342 Cb 0.51 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 3gvp h ARG 342 CO -0.43 0.74 0.21 -0.07 -1.07 0.00 0.00 179.97 179.35 3gvp h LEU 343 N 0.97 1.08 -1.08 3.04 3.38 -0.26 -1.90 115.31 120.54 3gvp h LEU 343 Ca 0.24 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 3gvp h LEU 343 Cb 0.09 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3gvp h LEU 343 CO -0.03 1.02 -0.46 1.88 0.09 0.00 0.00 178.44 180.94 3gvp h TYR 344 N 1.09 0.00 -0.06 1.13 0.05 -0.62 -1.92 116.97 116.65 3gvp h TYR 344 Ca 0.23 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.87 3gvp h TYR 344 Cb 0.34 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 3gvp h TYR 344 CO 0.03 0.46 -0.60 1.96 -1.05 0.00 0.00 178.16 178.96 3gvp h GLN 345 N 0.00 0.20 0.11 4.88 1.08 -0.96 -1.00 115.11 119.42 3gvp h GLN 345 Ca -0.00 -0.13 -0.01 0.00 -1.45 0.00 0.00 58.65 57.06 3gvp h GLN 345 Cb 0.81 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.27 3gvp h GLN 345 CO 0.06 0.74 -0.06 -0.07 -0.95 0.00 0.00 178.83 178.55 3gvp h LEU 346 N 0.15 -0.13 -0.49 1.46 3.38 -1.16 -2.83 115.31 115.69 3gvp h LEU 346 Ca -0.01 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 57.76 3gvp h LEU 346 Cb 1.09 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.81 3gvp h LEU 346 CO 0.09 0.23 0.10 -1.28 0.09 0.00 0.00 178.44 177.67 3gvp h SER 347 N -0.50 0.01 -0.58 -0.43 0.87 -1.32 -0.71 113.55 110.89 3gvp h SER 347 Ca -0.02 0.09 0.11 0.00 -1.23 0.00 0.00 61.79 60.74 3gvp h SER 347 Cb 0.41 0.12 -0.08 0.00 -0.44 0.00 0.00 62.40 62.40 3gvp h SER 347 CO 0.03 0.03 0.13 0.50 -0.53 0.00 0.00 176.83 176.99 3gvp h LYS 348 N 0.24 0.26 0.00 2.24 3.64 -1.23 -0.80 116.57 120.93 3gvp h LYS 348 Ca 0.25 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 3gvp h LYS 348 Cb 0.33 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 3gvp h LYS 348 CO -0.32 0.17 0.00 0.00 -2.27 0.00 0.00 179.45 177.03 3gvp n ALA 349 N -2.57 1.80 -0.51 5.00 0.00 -0.57 -4.89 120.51 118.77 3gvp n ALA 349 Ca 0.08 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3gvp n ALA 349 Cb 0.30 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.37 3gvp n ALA 349 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gvp n GLY 350 N 0.29 0.75 0.71 0.00 0.00 -0.31 -4.97 105.19 101.66 3gvp n GLY 350 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 3gvp n GLY 350 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gvp n LYS 351 N -2.44 1.72 -2.77 1.61 4.76 -0.38 -4.73 118.16 115.94 3gvp n LYS 351 Ca 0.00 -1.42 -0.43 0.00 -2.87 0.00 0.00 58.31 53.59 3gvp n LYS 351 Cb 0.00 -1.47 -0.03 0.00 -1.84 0.00 0.00 35.03 31.69 3gvp n LYS 351 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3gvp s LEU 352 N -2.26 4.32 -0.03 -0.35 2.96 -1.21 -4.82 118.68 117.29 3gvp s LEU 352 Ca 0.23 -1.58 0.21 0.00 -0.22 0.00 0.00 54.13 52.77 3gvp s LEU 352 Cb 0.19 -2.47 0.65 0.00 0.50 0.00 0.00 46.19 45.06 3gvp s LEU 352 CO 0.45 -1.32 1.55 0.00 -1.32 0.00 0.00 176.35 175.70 3gvp s VAL 354 N -1.24 1.14 0.30 0.00 -7.23 -1.26 -4.42 120.40 107.69 3gvp s VAL 354 Ca 0.48 -1.64 -0.28 0.00 -1.81 0.00 0.00 61.98 58.74 3gvp s VAL 354 Cb 0.27 -1.41 -0.09 0.00 0.56 0.00 0.00 36.38 35.71 3gvp s VAL 354 CO 0.31 -0.45 1.00 -2.16 -0.31 0.00 0.00 175.10 173.48 3gvp s PRO 355 N -2.62 4.61 0.06 4.82 0.05 -1.26 -3.90 135.00 136.76 3gvp s PRO 355 Ca 0.06 1.53 0.09 0.00 0.05 0.00 0.00 61.00 62.73 3gvp s PRO 355 Cb -0.05 -2.99 -0.03 0.00 0.05 0.00 0.00 34.50 31.48 3gvp s PRO 355 CO 0.02 0.26 -0.24 0.00 0.05 0.00 0.00 177.00 177.09 3gvp s ALA 356 N -1.38 2.38 -0.17 8.56 0.00 -0.29 -0.67 121.76 130.18 3gvp s ALA 356 Ca 0.47 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 51.16 3gvp s ALA 356 Cb -0.25 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.35 3gvp s ALA 356 CO 0.31 0.55 -0.19 1.41 0.00 0.00 0.00 175.76 177.84 3gvp s MET 357 N -1.43 3.05 -0.17 0.00 1.75 0.53 -0.10 119.30 122.94 3gvp s MET 357 Ca 0.13 -0.81 -0.24 0.00 -1.25 0.00 0.00 55.69 53.52 3gvp s MET 357 Cb -0.10 -2.59 -0.02 0.00 2.84 0.00 0.00 34.83 34.96 3gvp s MET 357 CO 0.04 -0.16 0.78 1.21 -0.65 0.00 0.00 175.02 176.24 3gvp s ASN 358 N 1.19 6.91 0.00 1.11 2.47 0.59 -3.55 114.94 123.66 3gvp s ASN 358 Ca 0.02 1.11 0.16 0.00 0.42 0.00 0.00 52.86 54.57 3gvp s ASN 358 Cb -0.14 -2.43 0.34 0.00 -1.45 0.00 0.00 41.25 37.57 3gvp s ASN 358 CO -0.09 -0.36 1.26 0.52 -3.72 0.00 0.00 177.10 174.71 3gvp n VAL 359 N 4.66 0.65 0.29 -5.21 0.31 -1.25 -3.53 118.33 114.25 3gvp n VAL 359 Ca 0.03 -0.82 0.09 0.00 -0.01 0.00 0.00 64.34 63.63 3gvp n VAL 359 Cb 0.49 0.80 -0.13 0.00 -0.91 0.00 0.00 33.84 34.09 3gvp n VAL 359 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3gvp n ASN 360 N 0.99 0.73 -0.95 4.52 3.02 -1.26 -4.36 115.26 117.95 3gvp n ASN 360 Ca 0.15 -0.31 0.12 0.00 -0.03 0.00 0.00 54.58 54.50 3gvp n ASN 360 Cb 0.48 1.58 0.16 0.00 -0.61 0.00 0.00 39.78 41.39 3gvp n ASN 360 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3gvp n ASP 361 N -1.92 2.93 -4.76 6.41 9.92 -1.26 -4.41 116.55 123.46 3gvp n ASP 361 Ca -0.01 -1.95 -0.39 0.00 -0.53 0.00 0.00 54.79 51.91 3gvp n ASP 361 Cb 0.42 -0.05 0.02 0.00 -0.64 0.00 0.00 41.12 40.88 3gvp n ASP 361 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 3gvp s SER 362 N -1.90 5.65 0.24 -2.24 1.04 -1.26 -4.87 113.70 110.36 3gvp s SER 362 Ca 0.31 2.77 -0.05 0.00 0.48 0.00 0.00 55.95 59.46 3gvp s SER 362 Cb 0.21 -2.64 0.35 0.00 0.10 0.00 0.00 66.02 64.03 3gvp s SER 362 CO 0.31 -1.31 1.84 0.58 0.98 0.00 0.00 173.24 175.63 3gvp h VAL 363 N 1.87 1.00 0.18 5.02 2.07 -1.97 -1.76 116.25 122.67 3gvp h VAL 363 Ca -0.51 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 3gvp h VAL 363 Cb 1.28 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3gvp h VAL 363 CO 0.59 0.17 -0.09 0.74 0.02 0.00 0.00 177.57 179.00 3gvp h THR 364 N 0.91 0.93 -0.83 2.57 2.02 -1.91 -2.61 112.91 113.98 3gvp h THR 364 Ca 0.38 -0.88 0.09 0.00 0.77 0.00 0.00 66.41 66.77 3gvp h THR 364 Cb 0.22 1.43 -0.07 0.00 -1.74 0.00 0.00 68.15 67.99 3gvp h THR 364 CO -0.19 0.19 0.48 0.11 0.37 0.00 0.00 175.52 176.47 3gvp h LYS 365 N -0.70 0.77 -0.35 6.66 1.79 -1.88 -2.28 116.57 120.58 3gvp h LYS 365 Ca -0.02 -0.05 -0.10 0.00 -2.18 0.00 0.00 60.65 58.30 3gvp h LYS 365 Cb 0.50 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 3gvp h LYS 365 CO 0.04 0.51 -0.20 1.96 -1.08 0.00 0.00 179.45 180.68 3gvp h GLN 366 N 0.80 0.66 -0.32 3.15 4.20 -1.33 -1.14 115.11 121.12 3gvp h GLN 366 Ca 0.40 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 3gvp h GLN 366 Cb 0.36 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 3gvp h GLN 366 CO -0.25 0.81 0.19 0.87 -0.67 0.00 0.00 178.83 179.78 3gvp h LYS 367 N 0.58 0.44 0.08 1.46 1.57 -1.01 0.14 116.57 119.83 3gvp h LYS 367 Ca 0.09 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3gvp h LYS 367 Cb 0.66 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.88 3gvp h LYS 367 CO 0.05 0.35 -0.04 0.74 -0.57 0.00 0.00 179.45 179.97 3gvp h PHE 368 N 0.41 -0.11 -0.67 -1.35 -1.00 -1.42 -1.32 116.94 111.49 3gvp h PHE 368 Ca 0.12 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.88 3gvp h PHE 368 Cb 0.02 0.03 -0.03 0.00 3.61 0.00 0.00 35.95 39.59 3gvp h PHE 368 CO -0.04 0.32 0.35 -0.44 -1.61 0.00 0.00 178.31 176.89 3gvp h ASP 369 N -0.56 0.83 0.09 2.17 3.32 -1.14 0.75 116.42 121.88 3gvp h ASP 369 Ca -0.01 -0.07 -0.35 0.00 0.02 0.00 0.00 57.03 56.62 3gvp h ASP 369 Cb 0.47 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 3gvp h ASP 369 CO 0.02 0.69 -1.93 0.59 -1.72 0.00 0.00 179.24 176.88 3gvp n ASN 370 N -4.36 2.07 -0.03 6.45 3.02 0.46 -4.46 115.26 118.42 3gvp n ASN 370 Ca 0.06 0.22 -0.05 0.00 -0.03 0.00 0.00 54.58 54.78 3gvp n ASN 370 Cb 0.11 -0.84 -0.02 0.00 -0.61 0.00 0.00 39.78 38.42 3gvp n ASN 370 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3gvp n LEU 371 N -3.64 1.58 -0.15 3.41 7.94 -0.56 -3.78 117.00 121.80 3gvp n LEU 371 Ca -0.34 0.25 -0.10 0.00 -1.11 0.00 0.00 56.01 54.71 3gvp n LEU 371 Cb 0.98 -0.57 -0.01 0.00 0.53 0.00 0.00 43.42 44.36 3gvp n LEU 371 CO 0.37 -0.48 0.80 1.88 -1.11 0.00 0.00 177.39 178.84 3gvp h TYR 372 N -0.56 0.80 -0.30 1.96 0.05 -1.35 -0.60 116.97 116.96 3gvp h TYR 372 Ca 0.00 -0.14 -0.04 0.00 0.05 0.00 0.00 58.73 58.60 3gvp h TYR 372 Cb 0.56 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 38.08 3gvp h TYR 372 CO -0.24 0.80 0.03 0.00 -1.05 0.00 0.00 178.16 177.70 3gvp h ARG 375 N 0.99 0.11 0.15 0.00 3.08 -1.15 -1.84 114.38 115.72 3gvp h ARG 375 Ca 0.20 -0.01 -0.23 0.00 0.07 0.00 0.00 59.98 60.02 3gvp h ARG 375 Cb 0.38 -0.02 0.02 0.00 0.08 0.00 0.00 29.97 30.43 3gvp h ARG 375 CO 0.01 0.07 -1.05 0.93 -1.07 0.00 0.00 179.97 178.86 3gvp h GLU 376 N 0.11 0.32 -0.28 0.04 5.08 -1.45 -3.37 114.58 115.02 3gvp h GLU 376 Ca 0.40 -0.55 -0.09 0.00 -1.00 0.00 0.00 59.36 58.12 3gvp h GLU 376 Cb 0.70 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 3gvp h GLU 376 CO -0.64 1.26 -0.20 0.66 -1.00 0.00 0.00 179.01 179.09 3gvp h SER 377 N -0.28 0.51 -0.65 1.42 4.64 -0.37 -1.73 113.55 117.09 3gvp h SER 377 Ca -0.20 -0.16 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 3gvp h SER 377 Cb 1.75 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 63.67 3gvp h SER 377 CO 0.15 0.72 0.30 -0.29 -0.87 0.00 0.00 176.83 176.84 3gvp h ILE 378 N 0.46 1.22 -0.11 0.95 6.09 -1.52 0.26 117.51 124.86 3gvp h ILE 378 Ca 0.07 -0.66 -0.13 0.00 -1.37 0.00 0.00 64.86 62.78 3gvp h ILE 378 Cb 0.61 0.39 0.00 0.00 0.47 0.00 0.00 36.82 38.29 3gvp h ILE 378 CO 0.04 0.27 -0.42 -0.07 -3.07 0.00 0.00 178.15 174.91 3gvp h LEU 379 N 0.96 0.57 -0.31 2.19 3.38 -1.62 -2.10 115.31 118.37 3gvp h LEU 379 Ca 0.23 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.56 3gvp h LEU 379 Cb 0.14 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3gvp h LEU 379 CO -0.03 1.09 0.09 -0.78 0.09 0.00 0.00 178.44 178.91 3gvp h ASP 380 N 0.08 0.46 -0.70 -0.43 3.58 -0.92 -1.36 116.42 117.12 3gvp h ASP 380 Ca -0.02 -0.21 -0.01 0.00 0.42 0.00 0.00 57.03 57.21 3gvp h ASP 380 Cb 1.05 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.95 3gvp h ASP 380 CO 0.09 0.54 0.41 1.23 -2.88 0.00 0.00 179.24 178.63 3gvp h GLY 381 N 0.34 1.03 0.98 -0.78 0.00 -0.53 -1.28 103.07 102.83 3gvp h GLY 381 Ca 0.10 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 46.90 3gvp h GLY 381 CO -0.00 0.43 -0.08 1.41 0.00 0.00 0.00 176.54 178.30 3gvp h LEU 382 N 0.96 0.79 -0.29 3.11 3.38 -1.29 -2.34 115.31 119.63 3gvp h LEU 382 Ca 0.25 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3gvp h LEU 382 Cb -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3gvp h LEU 382 CO -0.04 0.95 0.15 0.11 0.09 0.00 0.00 178.44 179.70 3gvp h LYS 383 N 0.60 0.41 -0.91 1.13 1.79 -1.13 -1.92 116.57 116.55 3gvp h LYS 383 Ca 0.11 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 3gvp h LYS 383 Cb 0.60 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 31.13 3gvp h LYS 383 CO 0.04 0.37 0.58 -0.09 -1.08 0.00 0.00 179.45 179.26 3gvp h ARG 384 N 0.35 1.21 0.01 3.15 9.65 -1.22 0.14 114.38 127.66 3gvp h ARG 384 Ca 0.10 -0.09 -0.26 0.00 -1.10 0.00 0.00 59.98 58.64 3gvp h ARG 384 Cb 0.08 -0.26 -0.04 0.00 -1.39 0.00 0.00 29.97 28.36 3gvp h ARG 384 CO -0.02 0.82 -1.38 1.79 2.80 0.00 0.00 179.97 183.99 3gvp h THR 385 N 1.24 1.26 0.00 0.20 1.35 -1.37 -3.41 112.91 112.18 3gvp h THR 385 Ca 0.33 -3.04 0.00 0.00 -0.55 0.00 0.00 66.41 63.15 3gvp h THR 385 Cb -0.10 2.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.96 3gvp h THR 385 CO -0.07 0.73 -0.03 0.35 -0.25 0.00 0.00 175.52 176.26 3gvp n THR 386 N -3.22 0.00 -2.07 6.82 -2.24 -0.73 -4.96 114.28 107.88 3gvp n THR 386 Ca -0.09 -0.29 -0.15 0.00 -2.27 0.00 0.00 64.05 61.25 3gvp n THR 386 Cb 1.00 0.97 -0.03 0.00 -2.10 0.00 0.00 70.33 70.17 3gvp n THR 386 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3gvp n ASP 387 N -0.63 -4.24 -4.80 3.42 8.00 0.47 -4.93 116.55 113.84 3gvp n ASP 387 Ca 0.00 0.22 -0.31 0.00 0.71 0.00 0.00 54.79 55.41 3gvp n ASP 387 Cb 0.00 -3.69 0.06 0.00 -0.02 0.00 0.00 41.12 37.47 3gvp n ASP 387 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gvp s MET 388 N -4.39 2.78 -0.02 -1.24 0.23 -1.26 -5.04 119.30 110.35 3gvp s MET 388 Ca 0.00 1.07 -0.08 0.00 -1.03 0.00 0.00 55.69 55.65 3gvp s MET 388 Cb 0.00 -1.97 -0.05 0.00 -1.53 0.00 0.00 34.83 31.29 3gvp s MET 388 CO 0.00 -1.23 0.26 0.00 -2.03 0.00 0.00 175.02 172.03 3gvp s MET 389 N -4.84 3.61 0.02 3.16 0.23 -1.26 -4.86 119.30 115.36 3gvp s MET 389 Ca 0.60 -0.00 0.09 0.00 -1.03 0.00 0.00 55.69 55.35 3gvp s MET 389 Cb -0.15 -3.13 -0.23 0.00 -1.53 0.00 0.00 34.83 29.79 3gvp s MET 389 CO 0.52 0.69 0.89 0.74 -2.03 0.00 0.00 175.02 175.83 3gvp h PHE 390 N 4.35 0.05 -2.41 3.16 0.04 -1.96 -3.44 116.94 116.72 3gvp h PHE 390 Ca -0.52 -0.03 -0.56 0.00 2.80 0.00 0.00 57.97 59.66 3gvp h PHE 390 Cb 1.21 -0.00 0.05 0.00 2.20 0.00 0.00 35.95 39.41 3gvp h PHE 390 CO 0.71 1.05 0.94 0.41 -0.60 0.00 0.00 178.31 180.81 3gvp n GLY 391 N 1.50 1.37 3.28 -1.45 0.00 -1.23 -2.14 105.19 106.52 3gvp n GLY 391 Ca -0.11 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3gvp n GLY 391 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gvp n GLY 392 N 3.79 1.10 3.77 -0.02 0.00 0.41 -4.90 105.19 109.34 3gvp n GLY 392 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3gvp n GLY 392 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gvp s LYS 393 N -0.18 4.21 -0.24 1.61 -0.14 -0.91 -4.72 119.74 119.37 3gvp s LYS 393 Ca 0.00 2.42 -0.16 0.00 -1.36 0.00 0.00 55.97 56.87 3gvp s LYS 393 Cb 0.00 -3.03 -0.03 0.00 -1.68 0.00 0.00 37.83 33.08 3gvp s LYS 393 CO 0.00 -0.42 0.43 -0.65 -0.76 0.00 0.00 175.35 173.94 3gvp s GLN 394 N -1.47 4.09 -0.00 1.68 -0.21 -1.26 -0.30 119.66 122.18 3gvp s GLN 394 Ca 0.54 0.19 0.06 0.00 0.02 0.00 0.00 55.36 56.17 3gvp s GLN 394 Cb -0.44 -3.61 -0.02 0.00 1.00 0.00 0.00 33.01 29.94 3gvp s GLN 394 CO 0.54 -0.22 -0.20 0.08 -2.12 0.00 0.00 175.29 173.38 3gvp s VAL 395 N 1.87 1.56 -0.14 1.09 1.01 0.34 -0.05 120.40 126.09 3gvp s VAL 395 Ca 0.18 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.28 3gvp s VAL 395 Cb -0.15 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.92 3gvp s VAL 395 CO 0.09 0.39 -0.20 0.54 0.00 0.00 0.00 175.10 175.93 3gvp s VAL 396 N -0.52 2.26 -0.25 2.92 0.11 -0.47 -0.21 120.40 124.24 3gvp s VAL 396 Ca 0.07 -0.91 -0.06 0.00 -2.93 0.00 0.00 61.98 58.15 3gvp s VAL 396 Cb -0.08 -1.92 -0.02 0.00 -1.53 0.00 0.00 36.38 32.84 3gvp s VAL 396 CO -0.00 0.54 0.04 -0.69 -3.33 0.00 0.00 175.10 171.65 3gvp s VAL 397 N 0.79 3.99 -0.36 2.04 1.01 -0.24 -1.05 120.40 126.58 3gvp s VAL 397 Ca -0.07 -0.33 -0.22 0.00 0.00 0.00 0.00 61.98 61.36 3gvp s VAL 397 Cb -0.16 -2.88 0.01 0.00 0.00 0.00 0.00 36.38 33.35 3gvp s VAL 397 CO -0.01 0.33 0.72 0.00 0.00 0.00 0.00 175.10 176.15 3gvp n GLY 399 N 4.57 1.12 2.47 0.00 0.00 0.09 -0.34 105.19 113.10 3gvp n GLY 399 Ca 0.01 -1.36 -0.22 0.00 0.00 0.00 0.00 46.02 44.45 3gvp n GLY 399 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3gvp n TYR 400 N 2.41 2.84 -0.43 1.61 9.36 -1.26 -4.15 117.16 127.55 3gvp n TYR 400 Ca 0.00 -2.92 0.00 0.00 3.32 0.00 0.00 57.90 58.30 3gvp n TYR 400 Cb 0.00 -0.17 0.00 0.00 -0.63 0.00 0.00 39.34 38.54 3gvp n TYR 400 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3gvp n GLY 401 N -0.43 -0.06 0.22 2.98 0.00 -1.26 -4.57 105.19 102.07 3gvp n GLY 401 Ca 0.33 -1.71 -0.04 0.00 0.00 0.00 0.00 46.02 44.60 3gvp n GLY 401 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3gvp h GLU 402 N 0.00 0.53 -0.12 1.61 4.39 -1.95 0.13 114.58 119.17 3gvp h GLU 402 Ca 0.00 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 3gvp h GLU 402 Cb 0.00 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 3gvp h GLU 402 CO 0.00 0.35 -0.00 0.28 -1.16 0.00 0.00 179.01 178.47 3gvp h VAL 403 N 0.54 1.26 -0.54 3.13 2.07 -1.90 -2.14 116.25 118.67 3gvp h VAL 403 Ca 0.24 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 3gvp h VAL 403 Cb 0.14 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 3gvp h VAL 403 CO -0.16 0.24 0.32 1.23 0.02 0.00 0.00 177.57 179.21 3gvp h GLY 404 N -0.07 0.79 -0.07 2.17 0.00 -1.64 -1.66 103.07 102.59 3gvp h GLY 404 Ca 0.03 -0.34 0.11 0.00 0.00 0.00 0.00 47.33 47.13 3gvp h GLY 404 CO 0.01 0.33 -0.13 0.50 0.00 0.00 0.00 176.54 177.24 3gvp h LYS 405 N 0.72 -0.00 -0.57 4.80 1.57 -0.73 0.59 116.57 122.95 3gvp h LYS 405 Ca 0.19 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 3gvp h LYS 405 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 3gvp h LYS 405 CO -0.03 -0.00 0.23 0.78 -0.57 0.00 0.00 179.45 179.85 3gvp h GLY 406 N -0.00 0.91 1.05 3.86 0.00 -1.07 -1.44 103.07 106.38 3gvp h GLY 406 Ca 0.26 -0.50 -0.13 0.00 0.00 0.00 0.00 47.33 46.96 3gvp h GLY 406 CO -0.55 0.47 -0.29 0.00 0.00 0.00 0.00 176.54 176.17 3gvp h ALA 409 N 1.14 0.61 -0.15 0.00 0.00 -1.20 -1.00 119.26 118.66 3gvp h ALA 409 Ca 0.13 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3gvp h ALA 409 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3gvp h ALA 409 CO -0.05 0.16 0.08 0.00 0.00 0.00 0.00 179.25 179.43 3gvp h ALA 410 N 1.08 0.20 -0.33 0.00 0.00 -1.18 -0.98 119.26 118.05 3gvp h ALA 410 Ca 0.16 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3gvp h ALA 410 Cb 0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3gvp h ALA 410 CO -0.02 -0.25 -0.03 -0.07 0.00 0.00 0.00 179.25 178.88 3gvp h LEU 411 N 0.13 0.59 -0.45 0.00 3.38 -1.21 -2.70 115.31 115.05 3gvp h LEU 411 Ca 0.05 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.75 3gvp h LEU 411 Cb 0.11 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 3gvp h LEU 411 CO -0.01 0.78 0.17 0.50 0.09 0.00 0.00 178.44 179.97 3gvp h LYS 412 N 0.39 0.34 -0.16 1.13 3.64 -1.18 -1.04 116.57 119.70 3gvp h LYS 412 Ca 0.09 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.50 3gvp h LYS 412 Cb 0.49 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 3gvp h LYS 412 CO 0.02 0.23 0.16 0.00 -2.27 0.00 0.00 179.45 177.59 3gvp h ALA 413 N 1.28 1.86 -0.38 5.00 0.00 -1.07 -0.86 119.26 125.10 3gvp h ALA 413 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3gvp h ALA 413 Cb 0.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3gvp h ALA 413 CO -0.20 -0.24 0.00 -1.33 0.00 0.00 0.00 179.25 177.48 3gvp n MET 414 N -3.98 2.03 -0.57 0.00 2.81 -0.46 -4.92 117.12 112.03 3gvp n MET 414 Ca 0.01 -1.59 0.00 0.00 -1.81 0.00 0.00 57.70 54.31 3gvp n MET 414 Cb 0.28 -1.39 0.00 0.00 -0.71 0.00 0.00 33.22 31.40 3gvp n MET 414 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gvp n GLY 415 N 1.24 0.67 3.83 3.03 0.00 -0.33 -3.48 105.19 110.16 3gvp n GLY 415 Ca 0.16 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 3gvp n GLY 415 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gvp s SER 416 N -2.32 6.80 -0.28 1.61 0.01 -0.78 -0.44 113.70 118.30 3gvp s SER 416 Ca 0.00 1.64 -0.11 0.00 1.31 0.00 0.00 55.95 58.78 3gvp s SER 416 Cb 0.00 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.66 3gvp s SER 416 CO 0.00 -0.46 0.20 -0.63 0.41 0.00 0.00 173.24 172.76 3gvp s ILE 417 N -2.38 5.30 -0.13 1.44 1.09 0.59 -4.26 121.20 122.85 3gvp s ILE 417 Ca 0.61 0.20 0.02 0.00 -1.10 0.00 0.00 60.65 60.38 3gvp s ILE 417 Cb -0.09 -3.54 0.00 0.00 -1.06 0.00 0.00 42.46 37.77 3gvp s ILE 417 CO 0.21 0.25 -0.21 -0.69 -0.10 0.00 0.00 174.94 174.40 3gvp s VAL 418 N 1.74 2.25 0.08 2.92 1.01 -1.26 -0.50 120.40 126.64 3gvp s VAL 418 Ca 0.08 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.15 3gvp s VAL 418 Cb -0.16 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 3gvp s VAL 418 CO 0.11 0.54 0.12 -0.31 0.00 0.00 0.00 175.10 175.57 3gvp s TYR 419 N 0.61 3.29 -0.01 5.22 2.02 0.71 -4.18 117.35 125.01 3gvp s TYR 419 Ca -0.11 0.13 0.05 0.00 -0.37 0.00 0.00 57.07 56.77 3gvp s TYR 419 Cb -0.16 -1.66 -0.01 0.00 -0.40 0.00 0.00 41.96 39.72 3gvp s TYR 419 CO 0.03 0.54 -0.18 0.08 -1.57 0.00 0.00 175.55 174.45 3gvp s VAL 420 N -1.44 1.38 0.06 0.71 1.01 -0.17 -1.08 120.40 120.87 3gvp s VAL 420 Ca 0.31 -0.76 0.07 0.00 0.00 0.00 0.00 61.98 61.60 3gvp s VAL 420 Cb -0.12 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 3gvp s VAL 420 CO 0.24 0.39 -0.14 0.42 0.00 0.00 0.00 175.10 176.01 3gvp s THR 421 N -0.42 3.13 0.09 3.92 -4.23 -0.58 -0.10 115.64 117.44 3gvp s THR 421 Ca 0.07 -1.17 -0.17 0.00 -1.18 0.00 0.00 61.69 59.24 3gvp s THR 421 Cb -0.07 -2.39 0.04 0.00 1.34 0.00 0.00 72.50 71.42 3gvp s THR 421 CO -0.01 0.26 0.41 -1.61 -0.54 0.00 0.00 174.62 173.13 3gvp s GLU 422 N -1.74 1.01 -0.00 3.99 0.41 -1.26 -0.73 118.70 120.38 3gvp s GLU 422 Ca 0.17 -0.55 0.15 0.00 -0.41 0.00 0.00 54.97 54.34 3gvp s GLU 422 Cb -0.11 0.45 -0.18 0.00 -1.78 0.00 0.00 34.13 32.51 3gvp s GLU 422 CO 0.09 -0.38 0.57 0.44 -0.49 0.00 0.00 175.26 175.49 3gvp n ILE 423 N 0.09 0.00 -3.70 -1.63 -5.35 -1.26 -4.96 119.36 102.56 3gvp n ILE 423 Ca -0.17 -0.19 -0.38 0.00 -0.27 0.00 0.00 62.75 61.74 3gvp n ILE 423 Cb 0.62 0.81 -0.12 0.00 -1.74 0.00 0.00 39.64 39.21 3gvp n ILE 423 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3gvp s ASP 424 N -2.72 5.37 0.59 7.28 -1.08 -1.26 -4.99 116.67 119.87 3gvp s ASP 424 Ca 0.03 -0.37 0.36 0.00 -0.52 0.00 0.00 52.55 52.05 3gvp s ASP 424 Cb 0.11 -1.97 1.83 0.00 -1.46 0.00 0.00 42.92 41.43 3gvp s ASP 424 CO 0.62 -0.12 2.17 1.55 0.52 0.00 0.00 175.17 179.92 3gvp h PRO 425 N 8.29 0.00 0.02 4.34 0.13 -1.98 -0.21 132.00 142.59 3gvp h PRO 425 Ca -0.35 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.62 3gvp h PRO 425 Cb 1.16 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.30 3gvp h PRO 425 CO 0.59 0.03 -0.64 0.82 -0.23 0.00 0.00 178.00 178.57 3gvp h ILE 426 N 0.00 1.43 -0.54 -3.56 2.04 -1.99 -1.40 117.51 113.50 3gvp h ILE 426 Ca -0.00 -2.14 -0.07 0.00 1.00 0.00 0.00 64.86 63.65 3gvp h ILE 426 Cb 0.24 2.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.96 3gvp h ILE 426 CO 0.00 0.62 0.04 0.00 0.00 0.00 0.00 178.15 178.82 3gvp h ALA 428 N 1.21 0.94 -0.58 0.00 0.00 -1.00 -1.92 119.26 117.92 3gvp h ALA 428 Ca 0.16 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3gvp h ALA 428 Cb 0.43 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3gvp h ALA 428 CO 0.02 0.47 0.09 1.25 0.00 0.00 0.00 179.25 181.08 3gvp h LEU 429 N 1.01 0.92 -0.87 0.00 5.85 -1.07 -2.41 115.31 118.75 3gvp h LEU 429 Ca 0.25 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.73 3gvp h LEU 429 Cb 0.08 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.81 3gvp h LEU 429 CO -0.04 0.95 0.57 1.56 -0.34 0.00 0.00 178.44 181.15 3gvp h GLN 430 N 0.86 1.12 -0.68 1.25 4.20 -0.99 -1.57 115.11 119.30 3gvp h GLN 430 Ca 0.18 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 3gvp h GLN 430 Cb 0.42 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 3gvp h GLN 430 CO 0.01 0.74 0.40 0.00 -0.67 0.00 0.00 178.83 179.31 3gvp h ALA 431 N 1.33 0.87 -0.02 3.87 0.00 -1.03 0.18 119.26 124.47 3gvp h ALA 431 Ca 0.33 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.16 3gvp h ALA 431 Cb -0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 3gvp h ALA 431 CO -0.09 0.36 -0.03 0.00 0.00 0.00 0.00 179.25 179.49 3gvp h MET 433 N -0.04 0.00 -0.01 0.00 2.07 -0.75 -1.55 114.93 114.65 3gvp h MET 433 Ca 0.02 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.65 3gvp h MET 433 Cb 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.80 3gvp h MET 433 CO -0.05 0.16 -0.06 -0.25 1.07 0.00 0.00 176.91 177.78 3gvp n ASP 434 N -3.62 0.85 0.00 1.22 8.00 0.59 -4.94 116.55 118.65 3gvp n ASP 434 Ca -0.01 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.40 3gvp n ASP 434 Cb 0.29 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 3gvp n ASP 434 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gvp n GLY 435 N 1.18 1.73 3.27 0.44 0.00 -0.58 -5.06 105.19 106.17 3gvp n GLY 435 Ca 0.18 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3gvp n GLY 435 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gvp s PHE 436 N -2.00 2.09 0.18 1.61 0.08 -0.69 -5.01 117.98 114.24 3gvp s PHE 436 Ca 0.00 -0.39 -0.31 0.00 0.12 0.00 0.00 56.93 56.35 3gvp s PHE 436 Cb 0.00 -1.33 -0.09 0.00 -0.57 0.00 0.00 43.02 41.02 3gvp s PHE 436 CO 0.00 -0.02 1.42 1.03 -0.10 0.00 0.00 175.22 177.55 3gvp s ARG 437 N -0.61 4.30 -0.34 0.44 1.81 -1.26 -3.88 118.95 119.41 3gvp s ARG 437 Ca 0.09 2.19 -0.09 0.00 -1.72 0.00 0.00 55.73 56.19 3gvp s ARG 437 Cb -0.09 -3.18 0.02 0.00 -0.45 0.00 0.00 34.95 31.25 3gvp s ARG 437 CO -0.01 -0.42 0.16 -1.17 -0.68 0.00 0.00 175.30 173.18 3gvp s LEU 438 N 0.44 4.38 0.21 2.53 2.96 -1.26 -1.00 118.68 126.93 3gvp s LEU 438 Ca 0.62 -0.87 0.04 0.00 -0.22 0.00 0.00 54.13 53.70 3gvp s LEU 438 Cb -0.39 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.28 3gvp s LEU 438 CO 0.36 -0.30 -0.05 0.68 -1.32 0.00 0.00 176.35 175.72 3gvp s VAL 439 N 1.53 1.17 0.30 1.68 -7.23 0.85 -4.97 120.40 113.74 3gvp s VAL 439 Ca 0.02 -2.06 -0.19 0.00 -1.81 0.00 0.00 61.98 57.93 3gvp s VAL 439 Cb -0.18 -2.18 -0.09 0.00 0.56 0.00 0.00 36.38 34.48 3gvp s VAL 439 CO 0.05 -0.47 0.80 -0.54 -0.31 0.00 0.00 175.10 174.63 3gvp s LYS 440 N -3.80 4.22 0.28 4.82 1.02 -1.26 -4.10 119.74 120.92 3gvp s LYS 440 Ca 0.25 0.91 0.01 0.00 0.02 0.00 0.00 55.97 57.16 3gvp s LYS 440 Cb 0.04 -2.62 0.56 0.00 -0.52 0.00 0.00 37.83 35.28 3gvp s LYS 440 CO 0.06 0.24 1.83 1.25 -0.92 0.00 0.00 175.35 177.81 3gvp h LEU 441 N 2.79 0.89 -2.32 3.17 5.85 -1.97 -1.26 115.31 122.45 3gvp h LEU 441 Ca -0.48 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.31 3gvp h LEU 441 Cb 1.18 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 3gvp h LEU 441 CO 0.65 0.46 0.04 0.78 -0.34 0.00 0.00 178.44 180.03 3gvp h ASN 442 N 0.95 0.00 0.53 1.25 2.35 -1.99 -0.85 115.58 117.82 3gvp h ASN 442 Ca 0.50 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.18 3gvp h ASN 442 Cb 0.52 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 3gvp h ASN 442 CO -0.28 0.00 -0.30 -0.33 -1.65 0.00 0.00 177.43 174.87 3gvp h GLU 443 N 0.00 0.00 0.00 0.81 5.08 -1.62 -3.32 114.58 115.53 3gvp h GLU 443 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3gvp h GLU 443 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3gvp h GLU 443 CO -0.00 0.30 0.00 1.33 -1.00 0.00 0.00 179.01 179.64 3gvp n VAL 444 N -3.79 0.00 0.00 3.13 0.24 -0.78 -4.81 118.33 112.33 3gvp n VAL 444 Ca -0.01 -0.43 0.08 0.00 -2.04 0.00 0.00 64.34 61.94 3gvp n VAL 444 Cb 0.39 1.10 0.48 0.00 -1.47 0.00 0.00 33.84 34.35 3gvp n VAL 444 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 3gvp h ILE 445 N 0.10 1.01 0.00 1.34 6.09 -1.28 -1.30 117.51 123.47 3gvp h ILE 445 Ca 0.00 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 3gvp h ILE 445 Cb 0.05 0.55 0.00 0.00 0.47 0.00 0.00 36.82 37.89 3gvp h ILE 445 CO 0.00 0.08 -0.05 0.54 -3.07 0.00 0.00 178.15 175.65 3gvp n ARG 446 N -4.48 0.02 -0.00 2.19 1.74 -1.26 -4.10 116.66 110.77 3gvp n ARG 446 Ca 0.05 0.02 0.02 0.00 -0.77 0.00 0.00 57.85 57.16 3gvp n ARG 446 Cb 0.19 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 3gvp n ARG 446 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gvp n GLN 447 N -1.56 2.28 -2.21 5.56 10.64 -0.53 -4.13 117.38 127.43 3gvp n GLN 447 Ca 0.07 -0.02 -0.34 0.00 -1.83 0.00 0.00 57.00 54.88 3gvp n GLN 447 Cb 0.35 -0.93 0.00 0.00 -0.86 0.00 0.00 30.24 28.80 3gvp n GLN 447 CO 0.00 0.00 0.00 0.14 -1.83 0.00 0.00 177.06 175.37 3gvp s VAL 448 N -1.91 3.43 -0.13 -0.39 -7.23 -0.96 -4.87 120.40 108.35 3gvp s VAL 448 Ca -0.00 0.82 0.19 0.00 -1.81 0.00 0.00 61.98 61.17 3gvp s VAL 448 Cb 0.02 -3.31 -0.21 0.00 0.56 0.00 0.00 36.38 33.44 3gvp s VAL 448 CO 0.15 -0.26 0.55 0.47 -0.31 0.00 0.00 175.10 175.69 3gvp n ASP 449 N -1.51 0.42 -3.80 4.85 8.00 0.93 -4.72 116.55 120.71 3gvp n ASP 449 Ca 0.10 0.18 -0.13 0.00 0.71 0.00 0.00 54.79 55.65 3gvp n ASP 449 Cb 0.52 0.85 -0.14 0.00 -0.02 0.00 0.00 41.12 42.33 3gvp n ASP 449 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gvp s ILE 450 N -2.97 -0.03 -0.13 0.53 1.01 -0.96 -1.20 121.20 117.45 3gvp s ILE 450 Ca -0.06 0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.72 3gvp s ILE 450 Cb 0.09 -0.15 0.00 0.00 0.01 0.00 0.00 42.46 42.42 3gvp s ILE 450 CO 0.84 0.04 -0.21 -0.69 0.00 0.00 0.00 174.94 174.92 3gvp s VAL 451 N 0.59 2.18 -0.10 2.92 1.01 0.73 -1.37 120.40 126.37 3gvp s VAL 451 Ca -0.05 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 60.99 3gvp s VAL 451 Cb -0.06 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.47 3gvp s VAL 451 CO -0.02 0.55 -0.13 -0.63 0.00 0.00 0.00 175.10 174.87 3gvp s ILE 452 N 0.62 1.29 -0.20 2.22 1.01 -0.21 -1.54 121.20 124.39 3gvp s ILE 452 Ca -0.11 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 3gvp s ILE 452 Cb -0.16 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.05 3gvp s ILE 452 CO 0.03 0.40 0.17 0.42 0.00 0.00 0.00 174.94 175.96 3gvp s THR 453 N 1.09 5.38 -0.22 2.92 -4.23 -0.84 -1.11 115.64 118.63 3gvp s THR 453 Ca -0.05 0.26 0.22 0.00 -1.18 0.00 0.00 61.69 60.93 3gvp s THR 453 Cb -0.14 -3.51 0.49 0.00 1.34 0.00 0.00 72.50 70.67 3gvp s THR 453 CO -0.02 0.41 1.13 0.00 -0.54 0.00 0.00 174.62 175.60 3gvp n THR 455 N -0.44 1.20 -1.01 0.00 -2.24 -1.21 -4.52 114.28 106.06 3gvp n THR 455 Ca 0.11 -0.79 -0.00 0.00 -2.27 0.00 0.00 64.05 61.09 3gvp n THR 455 Cb 0.87 -0.45 -0.00 0.00 -2.10 0.00 0.00 70.33 68.65 3gvp n THR 455 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gvp n GLY 456 N 1.65 0.39 3.60 3.38 0.00 -1.26 -5.02 105.19 107.92 3gvp n GLY 456 Ca -0.26 -0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.45 3gvp n GLY 456 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3gvp s ASN 457 N -2.05 3.86 0.14 1.61 3.84 -1.26 -4.97 114.94 116.11 3gvp s ASN 457 Ca 0.00 -1.26 0.06 0.00 0.21 0.00 0.00 52.86 51.87 3gvp s ASN 457 Cb 0.00 -0.39 -0.04 0.00 -0.55 0.00 0.00 41.25 40.27 3gvp s ASN 457 CO 0.00 -0.34 0.03 -1.59 -2.79 0.00 0.00 177.10 172.41 3gvp s LYS 458 N -3.68 2.55 -1.41 0.43 -2.85 -1.26 -3.89 119.74 109.63 3gvp s LYS 458 Ca 0.34 -0.97 -0.07 0.00 -1.00 0.00 0.00 55.97 54.27 3gvp s LYS 458 Cb 0.06 -2.48 0.04 0.00 -2.06 0.00 0.00 37.83 33.39 3gvp s LYS 458 CO 0.18 0.49 0.92 0.09 0.10 0.00 0.00 175.35 177.12 3gvp n ASN 459 N 0.07 -3.56 0.09 0.03 3.02 -0.50 -4.91 115.26 109.50 3gvp n ASN 459 Ca -0.10 -0.75 -0.18 0.00 -0.03 0.00 0.00 54.58 53.53 3gvp n ASN 459 Cb 0.54 -4.19 -0.11 0.00 -0.61 0.00 0.00 39.78 35.41 3gvp n ASN 459 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3gvp h VAL 460 N -2.09 1.39 -3.70 2.41 2.07 -0.77 -3.40 116.25 112.15 3gvp h VAL 460 Ca -0.59 -2.67 -0.69 0.00 0.82 0.00 0.00 66.70 63.57 3gvp h VAL 460 Cb 1.37 2.72 -0.32 0.00 -1.52 0.00 0.00 31.29 33.53 3gvp h VAL 460 CO 0.61 0.80 -0.66 -0.69 0.02 0.00 0.00 177.57 177.65 3gvp s VAL 461 N -2.93 3.20 0.60 2.57 1.01 -0.79 -5.02 120.40 119.03 3gvp s VAL 461 Ca -0.06 -1.45 0.00 0.00 0.00 0.00 0.00 61.98 60.47 3gvp s VAL 461 Cb 0.07 -2.90 0.05 0.00 0.00 0.00 0.00 36.38 33.61 3gvp s VAL 461 CO 0.90 -0.22 0.84 0.42 0.00 0.00 0.00 175.10 177.03 3gvp s THR 462 N 1.26 2.53 0.24 3.92 -4.23 -1.26 -1.24 115.64 116.87 3gvp s THR 462 Ca -0.02 -0.62 -0.04 0.00 -1.18 0.00 0.00 61.69 59.82 3gvp s THR 462 Cb -0.20 -2.91 0.21 0.00 1.34 0.00 0.00 72.50 70.94 3gvp s THR 462 CO -0.01 0.00 1.79 -0.09 -0.54 0.00 0.00 174.62 175.77 3gvp h ARG 463 N -0.10 0.67 -0.69 3.99 9.65 -1.94 -1.07 114.38 124.89 3gvp h ARG 463 Ca -0.41 -0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.44 3gvp h ARG 463 Cb 1.29 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 29.69 3gvp h ARG 463 CO 0.51 0.44 0.46 1.49 2.80 0.00 0.00 179.97 185.66 3gvp h GLU 464 N 0.69 0.90 -0.41 0.20 4.57 -1.99 0.42 114.58 118.96 3gvp h GLU 464 Ca 0.40 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.56 3gvp h GLU 464 Cb 0.43 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.78 3gvp h GLU 464 CO -0.28 0.60 0.19 0.45 -1.18 0.00 0.00 179.01 178.79 3gvp h HIS 465 N 0.93 0.35 -0.60 0.92 3.86 -1.75 -1.12 115.15 117.74 3gvp h HIS 465 Ca 0.26 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.47 3gvp h HIS 465 Cb -0.10 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.25 3gvp h HIS 465 CO -0.03 0.17 0.32 -0.07 0.86 0.00 0.00 177.93 179.19 3gvp h LEU 466 N 0.39 0.75 -1.35 2.43 3.38 -0.68 -0.99 115.31 119.24 3gvp h LEU 466 Ca 0.18 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3gvp h LEU 466 Cb 0.11 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3gvp h LEU 466 CO -0.14 0.63 0.44 0.44 0.09 0.00 0.00 178.44 179.90 3gvp h ASP 467 N 0.81 0.76 1.35 -0.43 3.32 -0.70 -2.96 116.42 118.56 3gvp h ASP 467 Ca 0.21 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3gvp h ASP 467 Cb 0.05 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3gvp h ASP 467 CO -0.03 0.54 -0.19 0.03 -1.72 0.00 0.00 179.24 177.87 3gvp h ARG 468 N 0.89 0.00 -6.97 3.56 3.08 -0.40 -3.46 114.38 111.08 3gvp h ARG 468 Ca 0.25 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.76 3gvp h ARG 468 Cb -0.09 0.00 0.11 0.00 0.08 0.00 0.00 29.97 30.07 3gvp h ARG 468 CO -0.05 0.00 0.71 -1.64 -1.07 0.00 0.00 179.97 177.92 3gvp s MET 469 N -3.14 3.86 0.75 0.04 -1.94 -0.45 -4.13 119.30 114.29 3gvp s MET 469 Ca 0.09 2.43 -0.11 0.00 -1.71 0.00 0.00 55.69 56.39 3gvp s MET 469 Cb 0.12 -2.77 0.04 0.00 2.01 0.00 0.00 34.83 34.23 3gvp s MET 469 CO 0.64 -0.68 1.08 -1.59 -0.01 0.00 0.00 175.02 174.46 3gvp s LYS 470 N -2.31 2.43 0.17 2.03 -2.85 -1.26 -4.95 119.74 113.01 3gvp s LYS 470 Ca 0.58 1.04 -0.34 0.00 -1.00 0.00 0.00 55.97 56.26 3gvp s LYS 470 Cb -0.44 -1.93 -0.14 0.00 -2.06 0.00 0.00 37.83 33.27 3gvp s LYS 470 CO 0.57 -1.48 1.54 -1.71 0.10 0.00 0.00 175.35 174.37 3gvp n ASN 471 N -3.40 2.99 0.00 0.03 5.15 -1.26 -2.33 115.26 116.44 3gvp n ASN 471 Ca 0.08 1.09 0.00 0.00 -0.60 0.00 0.00 54.58 55.16 3gvp n ASN 471 Cb 0.53 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 38.37 3gvp n ASN 471 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3gvp n SER 472 N 3.17 -1.51 -4.75 1.20 3.41 0.17 -4.98 113.62 110.33 3gvp n SER 472 Ca 0.16 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.35 3gvp n SER 472 Cb 0.29 -0.25 -0.01 0.00 -0.26 0.00 0.00 64.21 63.98 3gvp n SER 472 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gvp s ILE 474 N -0.44 5.29 -0.07 0.00 1.01 -0.35 -0.21 121.20 126.44 3gvp s ILE 474 Ca 0.60 0.14 0.02 0.00 0.00 0.00 0.00 60.65 61.41 3gvp s ILE 474 Cb -0.50 -3.36 0.02 0.00 0.01 0.00 0.00 42.46 38.62 3gvp s ILE 474 CO 0.55 0.51 -0.10 -0.69 0.00 0.00 0.00 174.94 175.21 3gvp s VAL 475 N -0.18 1.00 0.21 2.92 1.01 0.41 -0.19 120.40 125.58 3gvp s VAL 475 Ca 0.10 -0.38 -0.14 0.00 0.00 0.00 0.00 61.98 61.56 3gvp s VAL 475 Cb -0.12 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.33 3gvp s VAL 475 CO 0.01 0.33 0.46 0.00 0.00 0.00 0.00 175.10 175.90 3gvp s ASN 477 N -2.95 2.29 -0.01 0.00 2.47 -1.26 -1.99 114.94 113.49 3gvp s ASN 477 Ca 0.16 -0.40 0.04 0.00 0.42 0.00 0.00 52.86 53.08 3gvp s ASN 477 Cb -0.00 -1.04 0.11 0.00 -1.45 0.00 0.00 41.25 38.87 3gvp s ASN 477 CO 0.03 0.04 1.08 0.23 -3.72 0.00 0.00 177.10 174.76 3gvp n MET 478 N 3.96 2.84 0.00 0.43 2.81 0.52 -1.55 117.12 126.13 3gvp n MET 478 Ca -0.20 -1.75 0.00 0.00 -1.81 0.00 0.00 57.70 53.94 3gvp n MET 478 Cb 0.52 -1.12 0.00 0.00 -0.71 0.00 0.00 33.22 31.90 3gvp n MET 478 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gvp n GLY 479 N -0.32 0.09 3.16 3.03 0.00 -0.85 -4.84 105.19 105.45 3gvp n GLY 479 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 3gvp n GLY 479 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3gvp s HIS 480 N 1.58 1.03 0.00 1.61 -3.43 -1.26 -4.91 115.29 109.91 3gvp s HIS 480 Ca 0.00 -0.61 0.00 0.00 -0.80 0.00 0.00 55.06 53.65 3gvp s HIS 480 Cb 0.00 -0.57 0.00 0.00 -1.43 0.00 0.00 32.58 30.58 3gvp s HIS 480 CO 0.00 -0.00 0.00 0.45 -2.00 0.00 0.00 174.74 173.19 3gvp n SER 481 N 0.76 0.00 -0.58 7.38 2.88 -1.26 -4.05 113.62 118.74 3gvp n SER 481 Ca -0.17 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.39 3gvp n SER 481 Cb 0.57 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.07 3gvp n SER 481 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3gvp n ASN 482 N -0.60 0.64 -0.19 -3.46 6.94 -1.26 -3.88 115.26 113.45 3gvp n ASN 482 Ca 0.00 -2.27 0.03 0.00 -0.02 0.00 0.00 54.58 52.32 3gvp n ASN 482 Cb 0.00 -0.27 0.01 0.00 -2.36 0.00 0.00 39.78 37.16 3gvp n ASN 482 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 3gvp n THR 483 N -0.22 0.00 -0.12 5.53 -2.24 -1.26 -4.45 114.28 111.52 3gvp n THR 483 Ca 0.05 -0.46 -0.09 0.00 -2.27 0.00 0.00 64.05 61.27 3gvp n THR 483 Cb 0.76 1.10 -0.01 0.00 -2.10 0.00 0.00 70.33 70.08 3gvp n THR 483 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3gvp h GLU 484 N 0.95 0.55 -5.93 -0.78 5.08 -1.74 -1.33 114.58 111.37 3gvp h GLU 484 Ca 0.00 -0.10 -0.58 0.00 -1.00 0.00 0.00 59.36 57.68 3gvp h GLU 484 Cb 0.24 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 3gvp h GLU 484 CO 0.00 0.53 -0.09 0.42 -1.00 0.00 0.00 179.01 178.88 3gvp s ILE 485 N -5.54 5.04 -1.35 3.13 1.01 -1.26 -0.14 121.20 122.09 3gvp s ILE 485 Ca -0.13 1.08 -0.15 0.00 0.00 0.00 0.00 60.65 61.44 3gvp s ILE 485 Cb 0.10 -3.86 0.08 0.00 0.01 0.00 0.00 42.46 38.79 3gvp s ILE 485 CO 0.75 0.40 1.90 -0.67 0.00 0.00 0.00 174.94 177.32 3gvp n ASP 486 N 3.00 4.59 -0.06 3.58 -0.08 -0.37 -4.74 116.55 122.46 3gvp n ASP 486 Ca -0.08 -2.92 -0.04 0.00 -1.51 0.00 0.00 54.79 50.25 3gvp n ASP 486 Cb 0.51 -1.67 0.19 0.00 2.34 0.00 0.00 41.12 42.50 3gvp n ASP 486 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 3gvp h VAL 487 N 4.67 1.24 -0.98 5.18 2.07 -1.88 -2.56 116.25 123.99 3gvp h VAL 487 Ca 0.47 -1.05 0.19 0.00 0.82 0.00 0.00 66.70 67.12 3gvp h VAL 487 Cb 0.76 1.03 -0.09 0.00 -1.52 0.00 0.00 31.29 31.46 3gvp h VAL 487 CO 1.62 0.36 0.61 0.00 0.02 0.00 0.00 177.57 180.18 3gvp h ALA 488 N 1.29 1.79 0.00 1.67 0.00 -1.90 0.34 119.26 122.46 3gvp h ALA 488 Ca 0.11 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3gvp h ALA 488 Cb 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3gvp h ALA 488 CO 0.03 -0.12 0.00 0.66 0.00 0.00 0.00 179.25 179.81 3gvp h SER 489 N 0.71 0.00 -0.06 0.00 4.64 -1.86 -1.48 113.55 115.50 3gvp h SER 489 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 3gvp h SER 489 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 3gvp h SER 489 CO -0.32 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.82 3gvp n LEU 490 N -2.90 1.71 -1.69 5.97 4.77 0.11 -4.12 117.00 120.85 3gvp n LEU 490 Ca -0.02 -0.61 -0.04 0.00 -0.03 0.00 0.00 56.01 55.31 3gvp n LEU 490 Cb 0.09 -0.03 0.23 0.00 -2.33 0.00 0.00 43.42 41.39 3gvp n LEU 490 CO 0.19 0.30 0.86 0.54 -1.33 0.00 0.00 177.39 177.96 3gvp n ARG 491 N 0.34 3.11 -2.45 3.23 5.12 -0.56 -4.83 116.66 120.61 3gvp n ARG 491 Ca 0.18 -2.30 -0.34 0.00 -1.93 0.00 0.00 57.85 53.46 3gvp n ARG 491 Cb 0.38 -1.99 -0.02 0.00 -1.16 0.00 0.00 32.46 29.66 3gvp n ARG 491 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 3gvp s THR 492 N -2.36 3.58 -0.26 0.55 -4.23 -1.26 -4.94 115.64 106.72 3gvp s THR 492 Ca 0.41 1.00 0.26 0.00 -1.18 0.00 0.00 61.69 62.19 3gvp s THR 492 Cb 0.33 -3.41 0.28 0.00 1.34 0.00 0.00 72.50 71.04 3gvp s THR 492 CO 0.10 -0.20 1.79 1.55 -0.54 0.00 0.00 174.62 177.33 3gvp h PRO 493 N 1.50 0.00 0.00 3.99 0.13 -1.98 -2.67 132.00 132.97 3gvp h PRO 493 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3gvp h PRO 493 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3gvp h PRO 493 CO 0.59 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.41 3gvp h GLU 494 N 0.00 0.00 -6.39 0.86 9.09 -1.97 -3.44 114.58 112.73 3gvp h GLU 494 Ca 0.00 0.00 -0.55 0.00 0.05 0.00 0.00 59.36 58.86 3gvp h GLU 494 Cb 0.33 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.39 3gvp h GLU 494 CO 0.00 0.00 0.01 -0.51 0.05 0.00 0.00 179.01 178.56 3gvp s LEU 495 N -4.72 4.42 -0.16 3.06 1.43 -1.01 -4.30 118.68 117.41 3gvp s LEU 495 Ca 0.09 1.28 -0.02 0.00 -1.03 0.00 0.00 54.13 54.45 3gvp s LEU 495 Cb 0.11 -3.25 -0.02 0.00 0.03 0.00 0.00 46.19 43.06 3gvp s LEU 495 CO 0.56 0.14 -0.08 -0.89 0.23 0.00 0.00 176.35 176.31 3gvp s THR 496 N -1.35 3.37 -0.19 5.49 2.01 -0.64 -4.92 115.64 119.41 3gvp s THR 496 Ca 0.36 -0.54 -0.08 0.00 0.31 0.00 0.00 61.69 61.75 3gvp s THR 496 Cb -0.18 -2.46 -0.04 0.00 0.01 0.00 0.00 72.50 69.83 3gvp s THR 496 CO 0.20 0.49 0.08 0.26 -0.69 0.00 0.00 174.62 174.97 3gvp s TRP 497 N 0.59 3.29 -0.12 4.92 0.52 -1.26 -0.56 118.94 126.32 3gvp s TRP 497 Ca -0.05 0.13 0.01 0.00 0.02 0.00 0.00 56.10 56.21 3gvp s TRP 497 Cb -0.15 -2.11 0.02 0.00 -1.15 0.00 0.00 33.47 30.08 3gvp s TRP 497 CO 0.03 0.18 -0.15 -1.21 0.02 0.00 0.00 176.95 175.81 3gvp s GLU 498 N 0.41 2.30 -0.53 4.98 2.02 0.02 -4.98 118.70 122.91 3gvp s GLU 498 Ca 0.04 -0.58 -0.28 0.00 0.02 0.00 0.00 54.97 54.17 3gvp s GLU 498 Cb -0.12 -1.98 0.03 0.00 0.10 0.00 0.00 34.13 32.15 3gvp s GLU 498 CO -0.00 -0.10 1.22 0.50 0.02 0.00 0.00 175.26 176.89 3gvp s ARG 499 N 1.10 3.57 -0.01 1.61 6.06 -1.26 -0.51 118.95 129.50 3gvp s ARG 499 Ca -0.04 0.43 0.22 0.00 -2.50 0.00 0.00 55.73 53.84 3gvp s ARG 499 Cb -0.14 -3.99 -0.27 0.00 0.06 0.00 0.00 34.95 30.60 3gvp s ARG 499 CO -0.04 -1.60 0.71 1.33 -2.50 0.00 0.00 175.30 173.20 3gvp n VAL 500 N 6.79 0.01 -3.54 7.11 0.24 -0.34 -5.00 118.33 123.60 3gvp n VAL 500 Ca 0.11 -0.24 -0.07 0.00 -2.04 0.00 0.00 64.34 62.10 3gvp n VAL 500 Cb 0.49 0.50 -0.02 0.00 -1.47 0.00 0.00 33.84 33.34 3gvp n VAL 500 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3gvp s ARG 501 N -3.25 0.71 0.08 7.34 3.52 -1.22 -5.04 118.95 121.10 3gvp s ARG 501 Ca 0.00 -0.28 -0.36 0.00 -0.13 0.00 0.00 55.73 54.97 3gvp s ARG 501 Cb 0.15 0.32 -0.15 0.00 -1.56 0.00 0.00 34.95 33.71 3gvp s ARG 501 CO 0.89 -0.31 1.50 0.45 -0.81 0.00 0.00 175.30 177.02 3gvp n SER 502 N -0.23 2.42 -0.30 -2.12 2.88 -1.26 -1.42 113.62 113.60 3gvp n SER 502 Ca -0.06 1.09 -0.04 0.00 -1.33 0.00 0.00 58.87 58.53 3gvp n SER 502 Cb 0.61 -1.30 -0.02 0.00 -0.75 0.00 0.00 64.21 62.75 3gvp n SER 502 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3gvp n GLN 503 N 3.38 -1.06 -3.92 -1.46 1.13 -1.26 -4.94 117.38 109.24 3gvp n GLN 503 Ca 0.19 0.49 -0.28 0.00 -1.94 0.00 0.00 57.00 55.46 3gvp n GLN 503 Cb 0.23 -4.41 -0.17 0.00 0.11 0.00 0.00 30.24 26.00 3gvp n GLN 503 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3gvp s VAL 504 N -1.75 1.12 -0.11 5.09 1.01 -0.50 0.20 120.40 125.47 3gvp s VAL 504 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.55 3gvp s VAL 504 Cb 0.00 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 3gvp s VAL 504 CO 0.00 0.31 -0.12 -1.81 0.00 0.00 0.00 175.10 173.48 3gvp s ASP 505 N 1.66 4.14 -0.18 3.32 1.01 -0.42 -1.19 116.67 125.00 3gvp s ASP 505 Ca 0.04 -0.26 -0.18 0.00 0.71 0.00 0.00 52.55 52.87 3gvp s ASP 505 Cb -0.13 -1.41 -0.04 0.00 1.01 0.00 0.00 42.92 42.35 3gvp s ASP 505 CO -0.08 0.22 0.48 -1.00 0.21 0.00 0.00 175.17 175.00 3gvp s HIS 506 N 0.01 3.40 -0.24 4.23 3.76 0.33 -0.47 115.29 126.32 3gvp s HIS 506 Ca -0.03 0.75 -0.06 0.00 -0.15 0.00 0.00 55.06 55.57 3gvp s HIS 506 Cb -0.14 -2.61 -0.02 0.00 1.11 0.00 0.00 32.58 30.92 3gvp s HIS 506 CO 0.04 -0.02 0.04 0.08 -0.85 0.00 0.00 174.74 174.03 3gvp s VAL 507 N 1.34 4.09 -0.13 -0.90 1.01 -0.55 -0.80 120.40 124.46 3gvp s VAL 507 Ca 0.23 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.98 3gvp s VAL 507 Cb -0.15 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.33 3gvp s VAL 507 CO 0.09 0.36 -0.20 -0.63 0.00 0.00 0.00 175.10 174.72 3gvp s ILE 508 N 1.56 2.32 0.61 2.22 1.01 0.28 -1.14 121.20 128.05 3gvp s ILE 508 Ca 0.06 -0.91 -0.10 0.00 0.00 0.00 0.00 60.65 59.70 3gvp s ILE 508 Cb -0.15 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 3gvp s ILE 508 CO 0.02 0.54 0.99 0.26 0.00 0.00 0.00 174.94 176.75 3gvp s TRP 509 N 0.58 3.57 0.45 3.97 0.51 0.11 -1.62 118.94 126.51 3gvp s TRP 509 Ca -0.12 1.16 0.21 0.00 -2.12 0.00 0.00 56.10 55.23 3gvp s TRP 509 Cb -0.16 -2.69 1.18 0.00 -0.81 0.00 0.00 33.47 30.99 3gvp s TRP 509 CO 0.03 -0.69 1.87 -1.35 -0.51 0.00 0.00 176.95 176.31 3gvp h PRO 510 N -0.26 0.29 -0.00 4.98 0.11 -1.89 0.17 132.00 135.40 3gvp h PRO 510 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3gvp h PRO 510 Cb 1.20 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3gvp h PRO 510 CO 0.62 0.19 -0.02 -0.40 -0.21 0.00 0.00 178.00 178.19 3gvp n ASP 511 N -4.46 0.19 0.00 -2.05 5.75 -1.26 -4.90 116.55 109.83 3gvp n ASP 511 Ca 0.19 -0.75 0.00 0.00 -0.01 0.00 0.00 54.79 54.22 3gvp n ASP 511 Cb 0.75 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.76 3gvp n ASP 511 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3gvp n GLY 512 N 1.13 0.18 3.76 6.12 0.00 0.60 -5.06 105.19 111.93 3gvp n GLY 512 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3gvp n GLY 512 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gvp s LYS 513 N -0.93 4.12 -0.03 1.61 2.20 -1.26 -4.70 119.74 120.73 3gvp s LYS 513 Ca 0.00 2.58 0.06 0.00 -0.36 0.00 0.00 55.97 58.25 3gvp s LYS 513 Cb 0.00 -3.00 -0.02 0.00 -1.51 0.00 0.00 37.83 33.30 3gvp s LYS 513 CO 0.00 -0.59 -0.22 0.50 -0.36 0.00 0.00 175.35 174.69 3gvp s ARG 514 N -1.28 2.28 0.24 4.03 3.52 -1.26 0.10 118.95 126.59 3gvp s ARG 514 Ca 0.58 -0.84 0.11 0.00 -0.13 0.00 0.00 55.73 55.45 3gvp s ARG 514 Cb -0.47 -2.17 -0.05 0.00 -1.56 0.00 0.00 34.95 30.70 3gvp s ARG 514 CO 0.55 0.57 -0.18 0.96 -0.81 0.00 0.00 175.30 176.40 3gvp s ILE 515 N -0.62 2.64 -0.33 4.11 -5.25 -0.30 -0.66 121.20 120.80 3gvp s ILE 515 Ca 0.10 -2.15 -0.06 0.00 -0.99 0.00 0.00 60.65 57.54 3gvp s ILE 515 Cb -0.10 -2.35 0.03 0.00 2.95 0.00 0.00 42.46 42.99 3gvp s ILE 515 CO -0.00 -0.28 0.10 -0.69 -1.79 0.00 0.00 174.94 172.27 3gvp s VAL 516 N -2.15 3.80 -0.22 8.37 1.01 0.71 -1.48 120.40 130.44 3gvp s VAL 516 Ca 0.27 -1.05 -0.10 0.00 0.00 0.00 0.00 61.98 61.10 3gvp s VAL 516 Cb -0.06 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.16 3gvp s VAL 516 CO 0.14 -0.12 0.13 -0.22 0.00 0.00 0.00 175.10 175.03 3gvp s LEU 517 N 1.42 4.05 -0.15 3.92 2.96 0.38 -0.44 118.68 130.82 3gvp s LEU 517 Ca -0.01 0.12 -0.08 0.00 -0.22 0.00 0.00 54.13 53.94 3gvp s LEU 517 Cb -0.19 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 3gvp s LEU 517 CO 0.03 0.11 0.12 -0.76 -1.32 0.00 0.00 176.35 174.53 3gvp s LEU 518 N 0.79 4.24 -1.28 -0.68 1.43 -0.57 -1.30 118.68 121.31 3gvp s LEU 518 Ca 0.07 0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 3gvp s LEU 518 Cb -0.13 -2.05 0.00 0.00 0.03 0.00 0.00 46.19 44.04 3gvp s LEU 518 CO 0.02 0.32 0.00 0.00 0.23 0.00 0.00 176.35 176.92 3gvp n ALA 519 N 2.57 -0.63 -2.80 4.21 0.00 0.13 -1.61 120.51 122.38 3gvp n ALA 519 Ca -0.18 0.14 -0.17 0.00 0.00 0.00 0.00 53.44 53.23 3gvp n ALA 519 Cb 0.54 -1.62 -0.00 0.00 0.00 0.00 0.00 19.45 18.37 3gvp n ALA 519 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3gvp n GLU 520 N -2.65 -2.88 -0.95 0.00 1.02 -1.26 -0.99 120.64 112.92 3gvp n GLU 520 Ca -0.16 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.57 3gvp n GLU 520 Cb 0.59 -5.26 0.00 0.00 -0.02 0.00 0.00 31.44 26.75 3gvp n GLU 520 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gvp n GLY 521 N -1.00 0.57 3.92 0.62 0.00 -0.63 -4.94 105.19 103.72 3gvp n GLY 521 Ca -0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 3gvp n GLY 521 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gvp s ARG 522 N -0.33 1.35 -0.11 1.61 0.52 -0.16 -4.18 118.95 117.64 3gvp s ARG 522 Ca 0.00 -0.19 -0.31 0.00 -0.52 0.00 0.00 55.73 54.70 3gvp s ARG 522 Cb 0.00 -1.93 -0.09 0.00 0.52 0.00 0.00 34.95 33.46 3gvp s ARG 522 CO 0.00 -1.96 2.05 1.28 0.02 0.00 0.00 175.30 176.69 3gvp n LEU 523 N -3.49 3.51 -0.30 2.53 4.32 -1.25 -4.25 117.00 118.08 3gvp n LEU 523 Ca 0.12 0.67 -0.03 0.00 -0.02 0.00 0.00 56.01 56.74 3gvp n LEU 523 Cb 0.60 -1.47 0.08 0.00 -1.62 0.00 0.00 43.42 41.02 3gvp n LEU 523 CO 0.51 -0.22 1.21 0.25 -1.22 0.00 0.00 177.39 177.92 3gvp h LEU 524 N 11.72 0.90 -1.31 2.23 5.85 -1.63 -2.61 115.31 130.46 3gvp h LEU 524 Ca -0.45 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.19 3gvp h LEU 524 Cb 1.26 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 3gvp h LEU 524 CO 0.96 0.65 -0.23 -0.55 -0.34 0.00 0.00 178.44 178.92 3gvp h ASN 525 N 1.07 0.17 -0.28 1.25 -1.07 -1.88 0.98 115.58 115.80 3gvp h ASN 525 Ca 0.30 -0.04 -0.03 0.00 0.07 0.00 0.00 56.30 56.60 3gvp h ASN 525 Cb -0.08 -0.04 -0.02 0.00 -2.07 0.00 0.00 38.32 36.10 3gvp h ASN 525 CO -0.08 0.41 0.08 -0.07 0.07 0.00 0.00 177.43 177.84 3gvp h LEU 526 N 0.16 0.48 0.00 6.14 3.38 -1.76 -2.73 115.31 120.99 3gvp h LEU 526 Ca 0.03 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3gvp h LEU 526 Cb 0.50 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3gvp h LEU 526 CO 0.03 0.49 -0.97 -1.54 0.09 0.00 0.00 178.44 176.55 3gvp n SER 527 N -4.34 1.61 -0.01 -0.43 3.41 -1.10 -4.72 113.62 108.05 3gvp n SER 527 Ca 0.02 -0.36 0.01 0.00 -0.26 0.00 0.00 58.87 58.28 3gvp n SER 527 Cb 0.19 1.24 0.01 0.00 -0.26 0.00 0.00 64.21 65.38 3gvp n SER 527 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gvp s SER 529 N -1.03 0.05 -0.03 0.00 0.15 -1.03 -3.74 113.70 108.07 3gvp s SER 529 Ca 0.02 -1.13 0.07 0.00 0.70 0.00 0.00 55.95 55.60 3gvp s SER 529 Cb 0.02 0.46 -0.02 0.00 -1.71 0.00 0.00 66.02 64.78 3gvp s SER 529 CO 0.00 -0.96 -0.23 -0.89 1.20 0.00 0.00 173.24 172.36 3gvp s THR 530 N -4.07 1.84 -0.11 6.45 2.01 -1.26 -4.75 115.64 115.73 3gvp s THR 530 Ca 0.29 -0.98 -0.30 0.00 0.31 0.00 0.00 61.69 61.01 3gvp s THR 530 Cb 0.04 -1.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.99 3gvp s THR 530 CO 0.09 0.52 1.23 -0.69 -0.69 0.00 0.00 174.62 175.07 3gvp s VAL 531 N -0.42 4.28 0.59 3.82 1.01 -1.26 -5.00 120.40 123.42 3gvp s VAL 531 Ca 0.05 1.58 -0.20 0.00 0.00 0.00 0.00 61.98 63.41 3gvp s VAL 531 Cb -0.10 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 3gvp s VAL 531 CO 0.00 -0.07 1.34 -2.84 0.00 0.00 0.00 175.10 173.53 3gvp s PRO 532 N 2.88 2.89 0.36 2.72 0.02 -1.26 -4.84 135.00 137.77 3gvp s PRO 532 Ca 0.55 2.18 0.04 0.00 0.02 0.00 0.00 61.00 63.80 3gvp s PRO 532 Cb -0.23 -2.09 0.70 0.00 0.02 0.00 0.00 34.50 32.90 3gvp s PRO 532 CO 0.18 -1.37 2.00 1.15 -0.33 0.00 0.00 177.00 178.62 3gvp h THR 533 N 1.08 1.10 -0.99 0.99 2.02 -1.94 -1.08 112.91 114.09 3gvp h THR 533 Ca -0.51 -0.27 0.09 0.00 0.77 0.00 0.00 66.41 66.49 3gvp h THR 533 Cb 1.32 0.24 -0.08 0.00 -1.74 0.00 0.00 68.15 67.89 3gvp h THR 533 CO 0.55 0.14 0.62 0.15 0.37 0.00 0.00 175.52 177.36 3gvp h PHE 534 N 0.79 1.14 -0.15 3.16 3.57 -1.91 0.26 116.94 123.81 3gvp h PHE 534 Ca 0.26 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.59 3gvp h PHE 534 Cb 0.05 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.42 3gvp h PHE 534 CO -0.00 0.52 -0.71 0.28 -2.23 0.00 0.00 178.31 176.16 3gvp h VAL 535 N 1.05 1.31 -0.48 1.41 2.07 -1.58 -1.69 116.25 118.35 3gvp h VAL 535 Ca 0.46 -1.98 0.01 0.00 0.82 0.00 0.00 66.70 66.01 3gvp h VAL 535 Cb 0.34 1.96 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 3gvp h VAL 535 CO -0.22 0.62 0.32 -0.07 0.02 0.00 0.00 177.57 178.23 3gvp h LEU 536 N 0.46 0.53 -0.57 2.57 3.38 -0.71 -2.09 115.31 118.88 3gvp h LEU 536 Ca -0.03 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 3gvp h LEU 536 Cb 1.32 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 3gvp h LEU 536 CO 0.14 0.38 -0.09 -1.28 0.09 0.00 0.00 178.44 177.68 3gvp h SER 537 N 0.62 1.05 -0.35 -0.43 0.87 -0.15 -0.31 113.55 114.85 3gvp h SER 537 Ca 0.18 -0.34 0.01 0.00 -1.23 0.00 0.00 61.79 60.41 3gvp h SER 537 Cb -0.03 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.62 3gvp h SER 537 CO -0.04 1.14 0.21 0.40 -0.53 0.00 0.00 176.83 178.01 3gvp h ILE 538 N 0.94 1.04 -0.08 2.23 1.08 -0.71 -0.67 117.51 121.34 3gvp h ILE 538 Ca 0.15 -0.15 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 3gvp h ILE 538 Cb 0.66 0.58 -0.00 0.00 -3.07 0.00 0.00 36.82 34.99 3gvp h ILE 538 CO 0.05 0.08 0.04 0.74 -0.69 0.00 0.00 178.15 178.36 3gvp h THR 539 N 0.42 1.08 -0.80 -0.27 2.02 -1.26 -2.13 112.91 111.98 3gvp h THR 539 Ca 0.14 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 3gvp h THR 539 Cb -0.00 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.48 3gvp h THR 539 CO -0.06 0.07 0.43 0.00 0.37 0.00 0.00 175.52 176.33 3gvp h ALA 540 N 0.95 1.03 -0.38 6.16 0.00 -0.84 -1.62 119.26 124.55 3gvp h ALA 540 Ca 0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 3gvp h ALA 540 Cb 0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3gvp h ALA 540 CO -0.00 0.55 -0.11 1.15 0.00 0.00 0.00 179.25 180.84 3gvp h THR 541 N 1.12 1.28 -0.89 0.00 2.02 -1.10 -0.18 112.91 115.16 3gvp h THR 541 Ca 0.28 -1.21 0.06 0.00 0.77 0.00 0.00 66.41 66.31 3gvp h THR 541 Cb 0.05 1.28 -0.06 0.00 -1.74 0.00 0.00 68.15 67.67 3gvp h THR 541 CO -0.04 0.40 0.56 0.74 0.37 0.00 0.00 175.52 177.55 3gvp h THR 542 N 0.54 1.07 -0.34 3.16 2.02 -1.04 -1.12 112.91 117.21 3gvp h THR 542 Ca 0.09 -0.35 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 3gvp h THR 542 Cb 0.64 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 3gvp h THR 542 CO 0.04 0.19 -0.04 1.56 0.37 0.00 0.00 175.52 177.64 3gvp h GLN 543 N 1.03 0.62 -0.05 6.66 4.20 -0.94 -1.44 115.11 125.19 3gvp h GLN 543 Ca 0.38 -0.22 0.02 0.00 0.06 0.00 0.00 58.65 58.90 3gvp h GLN 543 Cb 0.15 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3gvp h GLN 543 CO -0.17 0.77 -0.06 0.00 -0.67 0.00 0.00 178.83 178.70 3gvp h ALA 544 N 0.83 -0.01 -0.38 3.87 0.00 -0.73 -1.87 119.26 120.96 3gvp h ALA 544 Ca 0.09 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 3gvp h ALA 544 Cb 0.51 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3gvp h ALA 544 CO 0.02 -0.53 0.03 -0.07 0.00 0.00 0.00 179.25 178.70 3gvp h LEU 545 N -0.08 0.55 -0.22 0.00 3.38 -1.17 -1.60 115.31 116.18 3gvp h LEU 545 Ca 0.04 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3gvp h LEU 545 Cb 0.14 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3gvp h LEU 545 CO -0.10 0.59 0.03 0.00 0.09 0.00 0.00 178.44 179.06 3gvp h ALA 546 N 1.48 0.29 -0.36 1.53 0.00 -1.12 0.99 119.26 122.06 3gvp h ALA 546 Ca 0.12 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3gvp h ALA 546 Cb 0.31 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3gvp h ALA 546 CO 0.01 -0.03 0.16 -0.07 0.00 0.00 0.00 179.25 179.31 3gvp h LEU 547 N 0.16 0.21 -0.87 0.00 3.38 -0.99 -0.94 115.31 116.26 3gvp h LEU 547 Ca 0.07 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3gvp h LEU 547 Cb 0.32 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 3gvp h LEU 547 CO 0.00 0.16 0.57 0.40 0.09 0.00 0.00 178.44 179.67 3gvp h ILE 548 N 0.33 1.23 -0.55 1.22 2.04 -1.19 -1.05 117.51 119.54 3gvp h ILE 548 Ca 0.16 -0.42 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 3gvp h ILE 548 Cb 0.10 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.10 3gvp h ILE 548 CO -0.13 0.22 0.06 -0.08 0.00 0.00 0.00 178.15 178.22 3gvp h GLU 549 N 1.19 0.92 -0.11 2.37 4.57 -0.11 -2.64 114.58 120.77 3gvp h GLU 549 Ca 0.32 -0.26 -0.09 0.00 -1.18 0.00 0.00 59.36 58.15 3gvp h GLU 549 Cb -0.13 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.36 3gvp h GLU 549 CO -0.07 0.90 -0.27 -0.07 -1.18 0.00 0.00 179.01 178.33 3gvp h LEU 550 N 0.81 0.43 -1.01 1.64 3.38 -1.07 -3.00 115.31 116.48 3gvp h LEU 550 Ca 0.16 -0.58 -0.07 0.00 0.09 0.00 0.00 57.88 57.48 3gvp h LEU 550 Cb 0.44 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3gvp h LEU 550 CO 0.02 0.93 -0.08 0.22 0.09 0.00 0.00 178.44 179.61 3gvp h TYR 551 N -0.06 0.66 -0.74 1.13 3.20 -1.19 -2.84 116.97 117.13 3gvp h TYR 551 Ca -0.00 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.77 3gvp h TYR 551 Cb 0.87 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.96 3gvp h TYR 551 CO 0.11 0.68 0.00 0.09 -1.64 0.00 0.00 178.16 177.40 3gvp n ASN 552 N -4.20 4.02 -4.75 -2.11 3.02 -1.00 -4.98 115.26 105.27 3gvp n ASN 552 Ca 0.01 -2.02 -0.41 0.00 -0.03 0.00 0.00 54.58 52.13 3gvp n ASN 552 Cb 0.32 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 38.96 3gvp n ASN 552 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gvp s ALA 553 N -1.04 3.52 0.66 5.41 0.00 -1.07 -5.00 121.76 124.24 3gvp s ALA 553 Ca 0.50 1.17 -0.17 0.00 0.00 0.00 0.00 51.96 53.46 3gvp s ALA 553 Cb 0.26 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 3gvp s ALA 553 CO 0.34 -0.56 0.92 -0.35 0.00 0.00 0.00 175.76 176.10 3gvp n PRO 554 N 1.87 0.70 -0.06 0.00 -0.04 -1.26 -4.89 135.00 131.31 3gvp n PRO 554 Ca 0.04 0.28 0.08 0.00 -0.04 0.00 0.00 63.50 63.86 3gvp n PRO 554 Cb 0.42 -2.15 0.45 0.00 -0.04 0.00 0.00 33.50 32.18 3gvp n PRO 554 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3gvp h GLU 555 N 0.14 0.49 -0.35 0.54 9.09 -1.94 -1.89 114.58 120.66 3gvp h GLU 555 Ca -0.48 -0.03 0.05 0.00 0.05 0.00 0.00 59.36 58.95 3gvp h GLU 555 Cb 1.36 -0.11 -0.04 0.00 -1.65 0.00 0.00 28.75 28.30 3gvp h GLU 555 CO 0.49 0.32 0.08 0.78 0.05 0.00 0.00 179.01 180.74 3gvp h GLY 556 N 0.51 0.41 0.98 1.06 0.00 -2.04 -3.38 103.07 100.60 3gvp h GLY 556 Ca 0.23 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 3gvp h GLY 556 CO -0.06 -0.01 0.24 -0.09 0.00 0.00 0.00 176.54 176.62 3gvp h ARG 557 N 0.21 0.57 -4.98 4.80 2.43 -1.70 -3.42 114.38 112.30 3gvp h ARG 557 Ca 0.16 -0.06 -0.61 0.00 -0.81 0.00 0.00 59.98 58.67 3gvp h ARG 557 Cb 0.17 -0.12 -0.33 0.00 -0.42 0.00 0.00 29.97 29.27 3gvp h ARG 557 CO -0.20 0.44 -0.85 0.71 -1.51 0.00 0.00 179.97 178.56 3gvp s TYR 558 N -5.95 2.07 -0.26 2.20 1.51 -1.26 -5.11 117.35 110.55 3gvp s TYR 558 Ca -0.13 -0.83 -0.10 0.00 -1.01 0.00 0.00 57.07 54.99 3gvp s TYR 558 Cb 0.11 -1.43 0.11 0.00 -0.11 0.00 0.00 41.96 40.63 3gvp s TYR 558 CO 0.74 -0.37 0.58 0.15 -1.11 0.00 0.00 175.55 175.54 3gvp s LYS 559 N 0.52 0.52 -1.46 -0.62 1.02 -1.26 -4.84 119.74 113.62 3gvp s LYS 559 Ca -0.16 1.27 -0.08 0.00 0.02 0.00 0.00 55.97 57.01 3gvp s LYS 559 Cb -0.17 0.56 0.04 0.00 -0.52 0.00 0.00 37.83 37.73 3gvp s LYS 559 CO 0.06 -0.20 0.79 1.04 -0.92 0.00 0.00 175.35 176.12 3gvp n GLN 560 N 5.16 -5.40 -3.83 1.68 6.02 -1.26 -4.87 117.38 114.89 3gvp n GLN 560 Ca -0.13 0.74 -0.07 0.00 -0.01 0.00 0.00 57.00 57.53 3gvp n GLN 560 Cb 0.51 -5.63 0.00 0.00 1.02 0.00 0.00 30.24 26.15 3gvp n GLN 560 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3gvp s ASP 561 N -2.96 -0.12 -0.21 1.08 -1.08 -1.25 -4.75 116.67 107.37 3gvp s ASP 561 Ca 0.46 -0.83 -0.16 0.00 -0.52 0.00 0.00 52.55 51.50 3gvp s ASP 561 Cb -0.22 0.74 -0.04 0.00 -1.46 0.00 0.00 42.92 41.95 3gvp s ASP 561 CO 0.57 -1.43 0.41 -0.69 0.52 0.00 0.00 175.17 174.56 3gvp s VAL 562 N -3.03 5.18 0.16 1.11 1.01 -1.26 -1.14 120.40 122.43 3gvp s VAL 562 Ca 0.14 0.73 0.08 0.00 0.00 0.00 0.00 61.98 62.93 3gvp s VAL 562 Cb -0.05 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 3gvp s VAL 562 CO 0.08 0.23 -0.07 -0.31 0.00 0.00 0.00 175.10 175.04 3gvp s TYR 563 N 1.46 2.73 0.38 5.22 1.51 0.86 -4.96 117.35 124.55 3gvp s TYR 563 Ca 0.19 -0.18 -0.13 0.00 -1.01 0.00 0.00 57.07 55.95 3gvp s TYR 563 Cb -0.15 -1.36 -0.08 0.00 -0.11 0.00 0.00 41.96 40.27 3gvp s TYR 563 CO 0.08 0.49 0.77 -0.51 -1.11 0.00 0.00 175.55 175.28 3gvp s LEU 564 N -2.70 3.91 0.15 -1.29 1.43 -1.26 -0.30 118.68 118.62 3gvp s LEU 564 Ca 0.25 1.22 -0.34 0.00 -1.03 0.00 0.00 54.13 54.23 3gvp s LEU 564 Cb -0.10 -4.08 -0.14 0.00 0.03 0.00 0.00 46.19 41.91 3gvp s LEU 564 CO 0.16 -0.34 1.61 -0.11 0.23 0.00 0.00 176.35 177.90 3gvp n LEU 565 N -0.95 3.18 -4.75 1.79 7.94 -1.23 -4.86 117.00 118.11 3gvp n LEU 565 Ca 0.03 1.07 -0.38 0.00 -1.11 0.00 0.00 56.01 55.63 3gvp n LEU 565 Cb 0.54 -1.43 0.04 0.00 0.53 0.00 0.00 43.42 43.09 3gvp n LEU 565 CO 0.45 -0.24 0.93 -2.84 -1.11 0.00 0.00 177.39 174.57 3gvp s PRO 566 N 1.13 3.06 0.21 1.96 0.02 -1.26 -4.86 135.00 135.26 3gvp s PRO 566 Ca 0.79 2.08 -0.09 0.00 0.02 0.00 0.00 61.00 63.81 3gvp s PRO 566 Cb -0.67 -2.14 0.23 0.00 0.02 0.00 0.00 34.50 31.95 3gvp s PRO 566 CO 0.38 -1.21 1.83 -0.22 -0.33 0.00 0.00 177.00 177.46 3gvp h LYS 567 N 1.25 0.78 -0.92 5.54 1.63 -1.92 -1.42 116.57 121.50 3gvp h LYS 567 Ca -0.51 -0.05 0.10 0.00 -0.85 0.00 0.00 60.65 59.35 3gvp h LYS 567 Cb 1.30 -0.18 -0.07 0.00 -0.60 0.00 0.00 32.23 32.69 3gvp h LYS 567 CO 0.56 0.51 0.59 0.87 -3.45 0.00 0.00 179.45 178.54 3gvp h LYS 568 N 0.80 0.88 -0.41 1.90 1.79 -1.95 0.64 116.57 120.22 3gvp h LYS 568 Ca 0.30 -0.05 -0.10 0.00 -2.18 0.00 0.00 60.65 58.62 3gvp h LYS 568 Cb 0.11 -0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 30.55 3gvp h LYS 568 CO -0.15 0.58 -0.15 0.52 -1.08 0.00 0.00 179.45 179.18 3gvp h MET 569 N 0.91 0.76 -0.43 3.15 2.86 -1.64 -1.71 114.93 118.83 3gvp h MET 569 Ca 0.43 -0.27 -0.13 0.00 -2.06 0.00 0.00 59.70 57.68 3gvp h MET 569 Cb 0.44 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 3gvp h MET 569 CO -0.20 0.87 -0.23 0.22 1.06 0.00 0.00 176.91 178.63 3gvp h ASP 570 N 0.68 0.90 -0.77 1.22 3.58 -0.71 -1.60 116.42 119.72 3gvp h ASP 570 Ca 0.11 -0.34 0.01 0.00 0.42 0.00 0.00 57.03 57.23 3gvp h ASP 570 Cb 0.63 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 41.39 3gvp h ASP 570 CO 0.04 1.09 0.51 -0.33 -2.88 0.00 0.00 179.24 177.68 3gvp h GLU 571 N 0.76 1.02 -0.39 0.28 5.08 -0.81 -2.08 114.58 118.45 3gvp h GLU 571 Ca 0.10 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 3gvp h GLU 571 Cb 0.78 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 3gvp h GLU 571 CO 0.06 0.68 -0.39 -0.92 -1.00 0.00 0.00 179.01 177.44 3gvp h TYR 572 N 1.05 1.13 -0.33 4.33 3.20 -1.03 0.12 116.97 125.44 3gvp h TYR 572 Ca 0.28 -0.34 0.07 0.00 3.14 0.00 0.00 58.73 61.88 3gvp h TYR 572 Cb -0.12 -0.24 -0.06 0.00 1.54 0.00 0.00 36.73 37.85 3gvp h TYR 572 CO 0.00 1.17 -0.09 0.28 -1.64 0.00 0.00 178.16 177.89 3gvp h VAL 573 N 0.77 0.66 0.02 1.81 2.07 -0.90 0.13 116.25 120.82 3gvp h VAL 573 Ca 0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 3gvp h VAL 573 Cb 0.98 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3gvp h VAL 573 CO 0.10 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.67 3gvp h ALA 574 N 1.32 -0.03 -0.75 1.67 0.00 -1.19 -2.98 119.26 117.29 3gvp h ALA 574 Ca 0.16 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.10 3gvp h ALA 574 Cb 0.25 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 3gvp h ALA 574 CO -0.34 -0.47 0.41 1.03 0.00 0.00 0.00 179.25 179.87 3gvp h SER 575 N -0.13 0.57 0.17 0.00 0.87 -0.47 -0.07 113.55 114.49 3gvp h SER 575 Ca -0.00 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3gvp h SER 575 Cb 0.12 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.03 3gvp h SER 575 CO 0.01 0.33 -0.00 -0.07 -0.53 0.00 0.00 176.83 176.56 3gvp h LEU 576 N 0.70 0.00 -0.08 2.23 3.38 -0.61 -2.76 115.31 118.18 3gvp h LEU 576 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3gvp h LEU 576 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3gvp h LEU 576 CO -0.25 0.00 -0.89 1.41 0.09 0.00 0.00 178.44 178.81 3gvp n HIS 577 N -3.12 0.00 -0.04 1.13 8.25 -0.07 -4.35 115.22 117.02 3gvp n HIS 577 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 3gvp n HIS 577 Cb 0.11 -0.04 0.30 0.00 1.12 0.00 0.00 29.99 31.49 3gvp n HIS 577 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3gvp h LEU 578 N 0.18 0.57 -2.79 2.41 3.38 -1.17 -2.40 115.31 115.49 3gvp h LEU 578 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3gvp h LEU 578 Cb 0.52 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3gvp h LEU 578 CO 0.00 0.56 0.03 -0.65 0.09 0.00 0.00 178.44 178.47 3gvp h PRO 579 N 0.61 0.00 -0.34 1.13 0.11 -1.79 -0.85 132.00 130.87 3gvp h PRO 579 Ca 0.14 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.30 3gvp h PRO 579 Cb 0.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.29 3gvp h PRO 579 CO -0.01 0.00 0.23 1.15 -0.21 0.00 0.00 178.00 179.16 3gvp h THR 580 N 0.00 0.97 -0.21 -1.15 2.02 -1.75 -2.82 112.91 109.97 3gvp h THR 580 Ca 0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 3gvp h THR 580 Cb 0.07 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 3gvp h THR 580 CO -0.00 0.05 0.00 0.49 0.37 0.00 0.00 175.52 176.43 3gvp n PHE 581 N -4.48 0.26 -3.46 3.16 3.72 -0.37 -4.95 117.46 111.34 3gvp n PHE 581 Ca 0.04 -0.15 -0.25 0.00 -0.05 0.00 0.00 57.45 57.03 3gvp n PHE 581 Cb 0.21 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.77 3gvp n PHE 581 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3gvp n ASP 582 N 1.25 -4.84 -4.76 4.37 8.00 -1.06 -4.95 116.55 114.55 3gvp n ASP 582 Ca 0.15 -0.49 -0.40 0.00 0.71 0.00 0.00 54.79 54.76 3gvp n ASP 582 Cb 0.54 -3.92 -0.05 0.00 -0.02 0.00 0.00 41.12 37.67 3gvp n ASP 582 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gvp s ALA 583 N -3.13 3.40 -0.32 2.24 0.00 -0.93 -5.02 121.76 118.01 3gvp s ALA 583 Ca 0.47 0.29 -0.01 0.00 0.00 0.00 0.00 51.96 52.71 3gvp s ALA 583 Cb -0.23 -2.96 0.06 0.00 0.00 0.00 0.00 23.12 19.99 3gvp s ALA 583 CO 0.58 0.15 0.02 -1.01 0.00 0.00 0.00 175.76 175.50 3gvp s HIS 584 N -0.43 3.35 0.32 0.00 3.76 -1.26 -4.64 115.29 116.39 3gvp s HIS 584 Ca 0.37 -2.06 -0.28 0.00 -0.15 0.00 0.00 55.06 52.94 3gvp s HIS 584 Cb -0.21 -2.31 -0.09 0.00 1.11 0.00 0.00 32.58 31.07 3gvp s HIS 584 CO 0.24 -0.84 1.15 -1.17 -0.85 0.00 0.00 174.74 173.26 3gvp s LEU 585 N 1.20 4.43 0.18 0.89 2.96 -1.26 -5.05 118.68 122.03 3gvp s LEU 585 Ca -0.03 2.34 -0.11 0.00 -0.22 0.00 0.00 54.13 56.12 3gvp s LEU 585 Cb -0.20 -3.75 -0.07 0.00 0.50 0.00 0.00 46.19 42.67 3gvp s LEU 585 CO -0.02 -0.35 0.53 -0.89 -1.32 0.00 0.00 176.35 174.30 3gvp s THR 586 N -1.25 4.93 -0.12 3.68 2.01 -1.26 -5.09 115.64 118.54 3gvp s THR 586 Ca 0.49 0.60 -0.03 0.00 0.31 0.00 0.00 61.69 63.05 3gvp s THR 586 Cb -0.32 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 3gvp s THR 586 CO 0.42 0.10 0.01 -0.70 -0.69 0.00 0.00 174.62 173.75 3gvp s GLU 587 N -2.37 3.29 0.36 4.92 2.12 -1.26 -5.09 118.70 120.67 3gvp s GLU 587 Ca 0.42 -0.40 -0.27 0.00 0.36 0.00 0.00 54.97 55.07 3gvp s GLU 587 Cb -0.13 -2.90 -0.10 0.00 0.26 0.00 0.00 34.13 31.26 3gvp s GLU 587 CO 0.20 0.55 1.28 -0.51 -0.54 0.00 0.00 175.26 176.24 3gvp s LEU 588 N -0.46 4.34 0.87 2.70 1.43 -1.26 -5.05 118.68 121.25 3gvp s LEU 588 Ca 0.08 2.61 -0.12 0.00 -1.03 0.00 0.00 54.13 55.68 3gvp s LEU 588 Cb -0.12 -3.77 0.11 0.00 0.03 0.00 0.00 46.19 42.44 3gvp s LEU 588 CO 0.02 -0.63 1.10 0.42 0.23 0.00 0.00 176.35 177.50 3gvp s THR 589 N -1.21 2.66 0.25 5.49 -4.23 -1.26 -4.85 115.64 112.49 3gvp s THR 589 Ca 0.52 0.22 -0.05 0.00 -1.18 0.00 0.00 61.69 61.20 3gvp s THR 589 Cb -0.38 -2.85 0.17 0.00 1.34 0.00 0.00 72.50 70.79 3gvp s THR 589 CO 0.49 -0.28 1.83 0.44 -0.54 0.00 0.00 174.62 176.56 3gvp h ASP 590 N -1.39 0.97 0.04 3.99 3.32 -1.99 -0.34 116.42 121.02 3gvp h ASP 590 Ca -0.49 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 56.42 3gvp h ASP 590 Cb 1.29 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.59 3gvp h ASP 590 CO 0.58 0.86 -0.02 -0.08 -1.72 0.00 0.00 179.24 178.86 3gvp h GLU 591 N 1.04 -0.05 -0.53 3.56 4.81 -1.99 -0.81 114.58 120.60 3gvp h GLU 591 Ca 0.24 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.49 3gvp h GLU 591 Cb 0.19 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 3gvp h GLU 591 CO -0.02 0.07 0.34 1.96 -0.73 0.00 0.00 179.01 180.63 3gvp h GLN 592 N -0.16 0.68 -0.24 1.92 4.20 -1.88 0.11 115.11 119.72 3gvp h GLN 592 Ca -0.01 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.71 3gvp h GLN 592 Cb 0.15 -0.15 -0.05 0.00 0.30 0.00 0.00 27.48 27.73 3gvp h GLN 592 CO 0.01 0.45 -0.06 0.00 -0.67 0.00 0.00 178.83 178.56 3gvp h ALA 593 N 1.20 0.16 -0.69 3.87 0.00 -0.94 -0.26 119.26 122.60 3gvp h ALA 593 Ca 0.20 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3gvp h ALA 593 Cb -0.06 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3gvp h ALA 593 CO -0.05 -0.47 0.41 -0.22 0.00 0.00 0.00 179.25 178.92 3gvp h LYS 594 N 0.00 0.94 -0.60 0.00 3.64 -0.93 0.39 116.57 120.01 3gvp h LYS 594 Ca 0.12 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3gvp h LYS 594 Cb 0.18 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3gvp h LYS 594 CO -0.25 0.67 0.34 -0.92 -2.27 0.00 0.00 179.45 177.03 3gvp h TYR 595 N 0.94 0.79 0.00 1.91 3.20 -0.10 -2.52 116.97 121.18 3gvp h TYR 595 Ca 0.25 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.11 3gvp h TYR 595 Cb -0.02 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 37.99 3gvp h TYR 595 CO -0.01 0.54 -0.69 1.28 -1.64 0.00 0.00 178.16 177.63 3gvp n LEU 596 N -4.40 0.61 -1.43 2.82 4.77 -0.17 -4.97 117.00 114.22 3gvp n LEU 596 Ca 0.06 -0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.96 3gvp n LEU 596 Cb 0.08 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 41.02 3gvp n LEU 596 CO 0.37 0.08 0.07 0.61 -1.33 0.00 0.00 177.39 177.19 3gvp n GLY 597 N 1.44 0.49 3.17 -0.72 0.00 -0.04 -5.05 105.19 104.48 3gvp n GLY 597 Ca 0.04 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.53 3gvp n GLY 597 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gvp s LEU 598 N -2.89 2.41 0.24 0.99 1.43 -0.22 -5.03 118.68 115.60 3gvp s LEU 598 Ca 0.16 -0.82 -0.30 0.00 -1.03 0.00 0.00 54.13 52.15 3gvp s LEU 598 Cb -0.07 -0.26 -0.09 0.00 0.03 0.00 0.00 46.19 45.80 3gvp s LEU 598 CO 0.22 -0.28 0.97 0.21 0.23 0.00 0.00 176.35 177.69 3gvp s ASN 599 N -2.45 7.58 0.48 2.29 3.84 -1.26 -4.35 114.94 121.07 3gvp s ASN 599 Ca 0.05 2.00 0.22 0.00 0.21 0.00 0.00 52.86 55.34 3gvp s ASN 599 Cb -0.02 -2.61 1.25 0.00 -0.55 0.00 0.00 41.25 39.32 3gvp s ASN 599 CO -0.01 0.10 1.92 0.11 -2.79 0.00 0.00 177.10 176.44 3gvp h LYS 600 N 4.15 0.20 -0.54 0.43 1.57 -1.93 -0.07 116.57 120.38 3gvp h LYS 600 Ca -0.45 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3gvp h LYS 600 Cb 1.20 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3gvp h LYS 600 CO 0.68 0.13 0.00 0.09 -0.57 0.00 0.00 179.45 179.78 3gvp n ASN 601 N -4.41 2.93 0.00 0.86 3.02 -1.26 -4.73 115.26 111.67 3gvp n ASN 601 Ca 0.15 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 3gvp n ASN 601 Cb 0.68 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 3gvp n ASN 601 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gvp n GLY 602 N 1.37 -2.24 3.77 7.41 0.00 -0.04 -4.91 105.19 110.55 3gvp n GLY 602 Ca 0.18 -1.52 -0.38 0.00 0.00 0.00 0.00 46.02 44.31 3gvp n GLY 602 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gvp s PRO 603 N -0.52 3.74 0.18 1.61 0.04 -1.26 -4.53 135.00 134.26 3gvp s PRO 603 Ca 0.00 1.87 0.21 0.00 0.04 0.00 0.00 61.00 63.12 3gvp s PRO 603 Cb 0.00 -2.45 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 3gvp s PRO 603 CO 0.00 -0.59 1.03 0.74 0.04 0.00 0.00 177.00 178.22 3gvp h PHE 604 N 2.10 0.00 -3.87 0.56 -1.00 -1.91 -3.42 116.94 109.40 3gvp h PHE 604 Ca -0.49 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.03 3gvp h PHE 604 Cb 1.25 0.00 -0.18 0.00 3.61 0.00 0.00 35.95 40.64 3gvp h PHE 604 CO 0.53 0.16 -0.71 0.15 -1.61 0.00 0.00 178.31 176.82 3gvp s LYS 605 N -3.23 0.72 1.05 1.51 1.02 -1.26 -5.07 119.74 114.48 3gvp s LYS 605 Ca -0.01 -1.10 -0.18 0.00 0.02 0.00 0.00 55.97 54.71 3gvp s LYS 605 Cb 0.09 -0.27 0.27 0.00 -0.52 0.00 0.00 37.83 37.40 3gvp s LYS 605 CO 0.79 0.02 0.63 -2.30 -0.92 0.00 0.00 175.35 173.57 3gvp n PRO 606 N 0.60 -4.02 -0.93 -1.68 -0.02 -1.26 -5.00 135.00 122.69 3gvp n PRO 606 Ca -0.17 -1.06 0.00 0.00 -2.02 0.00 0.00 63.50 60.25 3gvp n PRO 606 Cb 0.58 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 3gvp n PRO 606 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57