#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kdt n GLU 199 N 0.00 2.35 0.00 1.43 0.00 -1.26 -4.74 120.64 118.42 3kdt n GLU 199 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.28 3kdt n GLU 199 Cb 0.00 -0.85 0.70 0.00 0.00 0.00 0.00 31.44 31.29 3kdt n GLU 199 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3kdt n THR 200 N -1.33 0.00 0.23 6.31 -2.24 -1.26 -2.83 114.28 113.16 3kdt n THR 200 Ca 0.00 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 3kdt n THR 200 Cb 0.19 -0.59 0.53 0.00 -2.10 0.00 0.00 70.33 68.37 3kdt n THR 200 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kdt h ALA 201 N 3.51 1.32 -0.23 6.98 0.00 -2.00 -1.05 119.26 127.79 3kdt h ALA 201 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.73 3kdt h ALA 201 Cb 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3kdt h ALA 201 CO 0.00 0.29 0.01 -0.44 0.00 0.00 0.00 179.25 179.11 3kdt h ASP 202 N 0.00 -0.07 -0.06 0.00 3.32 -1.91 -3.18 116.42 114.52 3kdt h ASP 202 Ca -0.00 0.05 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 3kdt h ASP 202 Cb 0.51 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.14 3kdt h ASP 202 CO 0.03 -0.00 -0.35 -0.07 -1.72 0.00 0.00 179.24 177.12 3kdt h LEU 203 N 0.09 0.42 -1.94 1.55 3.38 -1.52 -2.91 115.31 114.38 3kdt h LEU 203 Ca 0.11 -0.66 0.07 0.00 0.09 0.00 0.00 57.88 57.49 3kdt h LEU 203 Cb 0.13 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3kdt h LEU 203 CO -0.17 1.02 0.21 0.50 0.09 0.00 0.00 178.44 180.08 3kdt h LYS 204 N -0.14 0.07 0.42 1.13 3.64 -1.34 -1.88 116.57 118.46 3kdt h LYS 204 Ca -0.03 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 3kdt h LYS 204 Cb 1.01 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 3kdt h LYS 204 CO 0.07 0.04 -0.20 1.03 -2.27 0.00 0.00 179.45 178.12 3kdt h SER 205 N 0.07 -0.48 -1.26 4.20 0.87 -1.52 -3.15 113.55 112.28 3kdt h SER 205 Ca 0.14 0.02 0.43 0.00 -1.23 0.00 0.00 61.79 61.14 3kdt h SER 205 Cb 0.46 0.12 -0.14 0.00 -0.44 0.00 0.00 62.40 62.41 3kdt h SER 205 CO -0.01 -0.31 0.79 0.25 -0.53 0.00 0.00 176.83 177.02 3kdt h LEU 206 N -0.63 0.27 -0.95 2.23 5.85 -1.18 0.23 115.31 121.13 3kdt h LEU 206 Ca -0.06 0.16 -0.08 0.00 0.84 0.00 0.00 57.88 58.74 3kdt h LEU 206 Cb 0.44 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 3kdt h LEU 206 CO 0.10 -0.22 -0.10 0.00 -0.34 0.00 0.00 178.44 177.87 3kdt h ALA 207 N 1.68 1.12 0.00 1.25 0.00 -1.37 -1.90 119.26 120.05 3kdt h ALA 207 Ca 0.83 -0.29 -0.23 0.00 0.00 0.00 0.00 54.91 55.22 3kdt h ALA 207 Cb 2.49 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 20.13 3kdt h ALA 207 CO -0.49 0.55 -0.96 1.57 0.00 0.00 0.00 179.25 179.92 3kdt h LYS 208 N 0.60 0.45 -0.67 0.00 5.09 -0.52 -2.75 116.57 118.77 3kdt h LYS 208 Ca 0.11 -0.49 -0.01 0.00 0.09 0.00 0.00 60.65 60.35 3kdt h LYS 208 Cb 0.52 0.14 -0.03 0.00 0.10 0.00 0.00 32.23 32.96 3kdt h LYS 208 CO 0.03 1.14 0.39 -0.09 -2.09 0.00 0.00 179.45 178.83 3kdt h ARG 209 N 0.25 0.92 -0.27 0.07 2.43 -1.12 0.19 114.38 116.85 3kdt h ARG 209 Ca -0.09 -0.09 -0.15 0.00 -0.81 0.00 0.00 59.98 58.84 3kdt h ARG 209 Cb 1.60 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.97 3kdt h ARG 209 CO 0.17 0.67 -0.41 0.82 -1.51 0.00 0.00 179.97 179.71 3kdt h ILE 210 N 0.91 1.30 -0.02 1.20 2.04 -1.44 -2.56 117.51 118.93 3kdt h ILE 210 Ca 0.24 -1.61 -0.11 0.00 1.00 0.00 0.00 64.86 64.38 3kdt h ILE 210 Cb -0.00 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3kdt h ILE 210 CO -0.04 0.52 -0.52 0.22 0.00 0.00 0.00 178.15 178.33 3kdt h TYR 211 N 0.51 0.07 -0.07 1.37 3.20 -1.22 0.22 116.97 121.05 3kdt h TYR 211 Ca 0.03 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3kdt h TYR 211 Cb 1.01 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.26 3kdt h TYR 211 CO 0.08 0.56 -0.04 0.93 -1.64 0.00 0.00 178.16 178.05 3kdt h GLU 212 N 0.05 0.14 -0.89 1.82 5.08 -0.67 -0.12 114.58 119.99 3kdt h GLU 212 Ca -0.00 -0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.42 3kdt h GLU 212 Cb 0.93 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.11 3kdt h GLU 212 CO 0.07 0.53 0.57 0.00 -1.00 0.00 0.00 179.01 179.19 3kdt h ALA 213 N 0.61 1.76 -0.32 3.43 0.00 -1.23 0.24 119.26 123.75 3kdt h ALA 213 Ca 0.01 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3kdt h ALA 213 Cb 0.49 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3kdt h ALA 213 CO 0.01 0.01 -0.03 -0.92 0.00 0.00 0.00 179.25 178.33 3kdt h TYR 214 N 0.76 0.65 -0.21 0.00 3.20 -0.30 -0.90 116.97 120.17 3kdt h TYR 214 Ca 0.44 -0.12 -0.13 0.00 3.14 0.00 0.00 58.73 62.05 3kdt h TYR 214 Cb 0.62 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 3kdt h TYR 214 CO -0.00 0.73 -0.43 -0.07 -1.64 0.00 0.00 178.16 176.75 3kdt h LEU 215 N 0.38 0.54 0.53 2.82 3.38 -0.06 -3.02 115.31 119.87 3kdt h LEU 215 Ca 0.09 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 3kdt h LEU 215 Cb 0.49 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.10 3kdt h LEU 215 CO 0.02 0.90 -0.25 0.50 0.09 0.00 0.00 178.44 179.70 3kdt h LYS 216 N 0.41 -0.68 -0.22 1.13 3.64 -0.55 -3.36 116.57 116.94 3kdt h LYS 216 Ca 0.03 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3kdt h LYS 216 Cb 0.93 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3kdt h LYS 216 CO 0.08 -0.40 0.00 0.09 -2.27 0.00 0.00 179.45 176.95 3kdt n ASN 217 N -5.26 1.31 -3.79 4.20 3.02 -0.35 -4.65 115.26 109.76 3kdt n ASN 217 Ca -0.10 -1.89 -0.29 0.00 -0.03 0.00 0.00 54.58 52.27 3kdt n ASN 217 Cb 0.30 -0.14 -0.16 0.00 -0.61 0.00 0.00 39.78 39.17 3kdt n ASN 217 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3kdt s PHE 218 N -1.71 1.67 0.53 3.10 0.40 -1.14 -4.66 117.98 116.17 3kdt s PHE 218 Ca 0.21 -1.46 0.19 0.00 -0.60 0.00 0.00 56.93 55.27 3kdt s PHE 218 Cb 0.11 -1.48 1.36 0.00 0.51 0.00 0.00 43.02 43.53 3kdt s PHE 218 CO 0.15 -0.76 2.14 -0.97 0.70 0.00 0.00 175.22 176.49 3kdt h ASN 219 N 8.10 0.00 -3.35 1.36 -0.73 -1.86 -3.41 115.58 115.69 3kdt h ASN 219 Ca -0.15 0.00 -0.66 0.00 1.87 0.00 0.00 56.30 57.36 3kdt h ASN 219 Cb 1.06 0.00 -0.29 0.00 0.27 0.00 0.00 38.32 39.37 3kdt h ASN 219 CO 0.41 0.00 -0.74 -0.32 -0.37 0.00 0.00 177.43 176.41 3kdt s MET 220 N -5.00 3.33 0.09 6.67 1.75 -1.26 -5.07 119.30 119.81 3kdt s MET 220 Ca -0.05 -0.65 0.03 0.00 -1.25 0.00 0.00 55.69 53.77 3kdt s MET 220 Cb 0.17 -2.93 -0.04 0.00 2.84 0.00 0.00 34.83 34.87 3kdt s MET 220 CO 0.66 -0.17 -0.09 0.54 -0.65 0.00 0.00 175.02 175.31 3kdt s ASN 221 N 1.37 1.26 0.19 1.11 2.20 -1.26 -5.05 114.94 114.76 3kdt s ASN 221 Ca 0.05 -0.82 -0.13 0.00 -0.94 0.00 0.00 52.86 51.01 3kdt s ASN 221 Cb -0.14 0.04 0.20 0.00 -2.00 0.00 0.00 41.25 39.34 3kdt s ASN 221 CO -0.04 -0.31 1.69 0.50 -2.94 0.00 0.00 177.10 175.99 3kdt h LYS 222 N 3.55 0.13 -0.55 3.55 3.64 -1.93 0.37 116.57 125.33 3kdt h LYS 222 Ca -0.36 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 3kdt h LYS 222 Cb 1.18 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 3kdt h LYS 222 CO 0.54 0.08 0.36 -0.24 -2.27 0.00 0.00 179.45 177.92 3kdt h VAL 223 N 0.13 1.14 -0.50 2.00 3.04 -1.97 0.32 116.25 120.41 3kdt h VAL 223 Ca 0.26 -0.27 -0.06 0.00 -1.01 0.00 0.00 66.70 65.61 3kdt h VAL 223 Cb 0.38 0.35 -0.02 0.00 -2.01 0.00 0.00 31.29 29.99 3kdt h VAL 223 CO -0.41 0.14 0.07 0.50 -1.01 0.00 0.00 177.57 176.85 3kdt h LYS 224 N 0.74 0.84 -0.12 4.17 3.64 -1.80 -2.57 116.57 121.45 3kdt h LYS 224 Ca 0.20 -0.23 -0.12 0.00 -1.27 0.00 0.00 60.65 59.23 3kdt h LYS 224 Cb -0.08 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 3kdt h LYS 224 CO -0.04 0.84 -0.45 0.00 -2.27 0.00 0.00 179.45 177.53 3kdt h ALA 225 N 0.96 1.00 -0.00 5.00 0.00 0.15 -2.41 119.26 123.97 3kdt h ALA 225 Ca 0.15 -0.45 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 3kdt h ALA 225 Cb 0.42 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3kdt h ALA 225 CO 0.01 0.63 -0.75 0.00 0.00 0.00 0.00 179.25 179.15 3kdt h ARG 226 N 0.24 0.02 -0.27 0.00 2.47 -0.35 -2.98 114.38 113.51 3kdt h ARG 226 Ca 0.02 -0.02 -0.16 0.00 -1.26 0.00 0.00 59.98 58.56 3kdt h ARG 226 Cb 0.90 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.22 3kdt h ARG 226 CO 0.07 0.76 -0.47 0.28 0.56 0.00 0.00 179.97 181.16 3kdt h VAL 227 N 0.01 1.29 0.33 2.04 2.07 -1.30 -3.13 116.25 117.56 3kdt h VAL 227 Ca -0.01 -1.67 -0.00 0.00 0.82 0.00 0.00 66.70 65.84 3kdt h VAL 227 Cb 1.32 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.75 3kdt h VAL 227 CO 0.10 0.54 -0.28 0.40 0.02 0.00 0.00 177.57 178.35 3kdt h ILE 228 N 0.55 0.41 0.00 4.57 2.04 -1.45 -3.01 117.51 120.63 3kdt h ILE 228 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.88 3kdt h ILE 228 Cb 1.08 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 3kdt h ILE 228 CO 0.11 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.44 3kdt n LEU 229 N -5.40 0.00 0.22 1.44 4.77 -1.13 -4.14 117.00 112.76 3kdt n LEU 229 Ca -0.10 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.80 3kdt n LEU 229 Cb 0.31 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 3kdt n LEU 229 CO 0.30 0.00 0.52 0.28 -1.33 0.00 0.00 177.39 177.16 3kdt h SER 230 N 0.00 -0.50 0.00 -1.43 0.02 -1.46 -3.47 113.55 106.71 3kdt h SER 230 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3kdt h SER 230 Cb 0.00 0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3kdt h SER 230 CO 0.00 -0.34 0.00 0.61 -1.14 0.00 0.00 176.83 175.96 3kdt n GLY 231 N -1.28 1.32 2.09 -3.77 0.00 -1.26 -4.90 105.19 97.38 3kdt n GLY 231 Ca -0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 3kdt n GLY 231 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kdt n LYS 232 N -0.45 2.16 -0.15 1.61 4.01 -1.26 -4.86 118.16 119.23 3kdt n LYS 232 Ca 0.00 -2.25 0.28 0.00 -0.51 0.00 0.00 58.31 55.83 3kdt n LYS 232 Cb 0.00 -1.89 0.64 0.00 -0.51 0.00 0.00 35.03 33.27 3kdt n LYS 232 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3kdt h ALA 233 N 1.75 2.73 -5.56 7.82 0.00 -1.78 -3.46 119.26 120.76 3kdt h ALA 233 Ca 0.41 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 3kdt h ALA 233 Cb 0.85 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.71 3kdt h ALA 233 CO 1.08 -1.34 -0.48 -1.13 0.00 0.00 0.00 179.25 177.38 3kdt n SER 234 N -3.62 -7.42 0.00 0.00 3.41 -1.26 -4.69 113.62 100.05 3kdt n SER 234 Ca 0.19 0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 3kdt n SER 234 Cb 1.17 -4.68 0.00 0.00 -0.26 0.00 0.00 64.21 60.44 3kdt n SER 234 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3kdt n ASN 235 N -0.88 0.00 -4.84 4.04 5.15 -1.26 -4.98 115.26 112.49 3kdt n ASN 235 Ca 0.03 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.64 3kdt n ASN 235 Cb 0.51 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.71 3kdt n ASN 235 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3kdt s ASN 236 N -4.00 6.85 0.97 1.20 -0.87 -1.26 -5.11 114.94 112.71 3kdt s ASN 236 Ca 0.00 1.05 -0.12 0.00 -1.57 0.00 0.00 52.86 52.22 3kdt s ASN 236 Cb 0.00 -2.28 0.17 0.00 -0.02 0.00 0.00 41.25 39.12 3kdt s ASN 236 CO 0.00 0.20 1.11 -2.16 -2.57 0.00 0.00 177.10 173.68 3kdt s PRO 237 N -1.57 0.65 1.18 -0.60 0.04 -1.26 -4.94 135.00 128.50 3kdt s PRO 237 Ca 0.32 0.43 -0.17 0.00 0.04 0.00 0.00 61.00 61.61 3kdt s PRO 237 Cb -0.16 -1.77 0.24 0.00 0.04 0.00 0.00 34.50 32.85 3kdt s PRO 237 CO 0.18 -2.56 0.50 -2.30 0.04 0.00 0.00 177.00 172.86 3kdt n PRO 238 N -4.04 -3.02 -4.25 0.56 -0.02 -1.26 -5.03 135.00 117.94 3kdt n PRO 238 Ca 0.06 -0.89 -0.34 0.00 -2.02 0.00 0.00 63.50 60.31 3kdt n PRO 238 Cb 0.58 -1.69 -0.15 0.00 -0.02 0.00 0.00 33.50 32.21 3kdt n PRO 238 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3kdt s PHE 239 N -2.13 2.82 0.02 6.00 5.36 0.28 -4.95 117.98 125.37 3kdt s PHE 239 Ca 0.51 -1.24 -0.27 0.00 -0.96 0.00 0.00 56.93 54.96 3kdt s PHE 239 Cb -0.10 -1.95 -0.04 0.00 -0.34 0.00 0.00 43.02 40.59 3kdt s PHE 239 CO 0.47 -0.61 0.87 0.08 -1.46 0.00 0.00 175.22 174.57 3kdt s VAL 240 N 1.13 4.78 -0.23 3.12 1.01 -1.26 -0.87 120.40 128.09 3kdt s VAL 240 Ca 0.01 1.83 -0.08 0.00 0.00 0.00 0.00 61.98 63.74 3kdt s VAL 240 Cb -0.14 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 3kdt s VAL 240 CO -0.05 0.27 0.09 -0.63 0.00 0.00 0.00 175.10 174.77 3kdt s ILE 241 N 0.46 4.62 0.00 2.22 1.01 0.24 -4.85 121.20 124.90 3kdt s ILE 241 Ca 0.45 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 61.02 3kdt s ILE 241 Cb -0.21 -3.14 0.00 0.00 0.01 0.00 0.00 42.46 39.12 3kdt s ILE 241 CO 0.25 0.37 0.00 0.00 0.00 0.00 0.00 174.94 175.56 3kdt n HIS 242 N 4.48 0.00 -3.68 3.97 1.44 -1.26 -1.92 115.22 118.25 3kdt n HIS 242 Ca -0.16 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.52 3kdt n HIS 242 Cb 0.52 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.64 3kdt n HIS 242 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 3kdt n ASP 243 N -1.28 -1.22 -0.01 4.39 5.75 -1.26 -4.57 116.55 118.36 3kdt n ASP 243 Ca 0.00 -1.70 -0.00 0.00 -0.01 0.00 0.00 54.79 53.08 3kdt n ASP 243 Cb 0.00 1.99 -0.00 0.00 -1.03 0.00 0.00 41.12 42.08 3kdt n ASP 243 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 3kdt n MET 244 N -0.44 -0.01 -0.18 0.11 2.81 -1.26 -0.60 117.12 117.55 3kdt n MET 244 Ca -0.02 0.22 -0.05 0.00 -1.81 0.00 0.00 57.70 56.04 3kdt n MET 244 Cb 0.38 -0.33 0.01 0.00 -0.71 0.00 0.00 33.22 32.57 3kdt n MET 244 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 3kdt h GLU 245 N 0.00 -0.15 -0.06 0.03 4.81 -1.98 0.31 114.58 117.53 3kdt h GLU 245 Ca 0.00 0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.10 3kdt h GLU 245 Cb 0.01 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3kdt h GLU 245 CO -0.01 -0.10 -0.61 1.79 -0.73 0.00 0.00 179.01 179.34 3kdt h THR 246 N -0.16 1.39 -0.29 0.32 1.35 -1.68 -1.20 112.91 112.64 3kdt h THR 246 Ca 0.23 -2.01 -0.01 0.00 -0.55 0.00 0.00 66.41 64.07 3kdt h THR 246 Cb 0.53 2.02 -0.01 0.00 -1.73 0.00 0.00 68.15 68.96 3kdt h THR 246 CO -0.64 0.59 0.14 0.25 -0.25 0.00 0.00 175.52 175.61 3kdt h LEU 247 N 0.17 0.38 0.00 3.87 5.85 0.60 -0.54 115.31 125.63 3kdt h LEU 247 Ca -0.01 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.59 3kdt h LEU 247 Cb 1.12 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.05 3kdt h LEU 247 CO 0.09 0.40 -0.13 0.00 -0.34 0.00 0.00 178.44 178.46 3kdt h MET 249 N 0.00 0.00 0.01 0.00 2.86 -1.12 -2.85 114.93 113.82 3kdt h MET 249 Ca 0.00 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 3kdt h MET 249 Cb 0.89 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.56 3kdt h MET 249 CO 0.00 0.72 -0.42 0.00 1.06 0.00 0.00 176.91 178.27 3kdt h ALA 250 N 1.28 0.04 -0.06 6.32 0.00 -0.16 -2.77 119.26 123.92 3kdt h ALA 250 Ca -0.01 -0.52 0.02 0.00 0.00 0.00 0.00 54.91 54.40 3kdt h ALA 250 Cb 1.29 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 3kdt h ALA 250 CO 0.09 0.21 0.07 0.93 0.00 0.00 0.00 179.25 180.56 3kdt h GLU 251 N -0.34 0.00 0.00 0.00 5.08 -0.32 0.42 114.58 119.42 3kdt h GLU 251 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3kdt h GLU 251 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3kdt h GLU 251 CO 0.08 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.72 3kdt n LYS 252 N -3.70 0.00 0.25 2.33 4.76 -1.08 -4.23 118.16 116.49 3kdt n LYS 252 Ca -0.02 0.04 0.14 0.00 -2.87 0.00 0.00 58.31 55.61 3kdt n LYS 252 Cb 0.17 -0.92 0.43 0.00 -1.84 0.00 0.00 35.03 32.87 3kdt n LYS 252 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 3kdt h THR 253 N 0.00 0.07 0.00 -0.18 1.35 -1.16 -3.36 112.91 109.63 3kdt h THR 253 Ca 0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 3kdt h THR 253 Cb 0.00 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 3kdt h THR 253 CO 0.00 0.03 -0.74 0.18 -0.25 0.00 0.00 175.52 174.75 3kdt n LEU 254 N -3.12 0.49 0.00 3.87 4.77 0.14 -5.05 117.00 118.10 3kdt n LEU 254 Ca 0.02 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 3kdt n LEU 254 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3kdt n LEU 254 CO 0.31 0.12 0.00 1.33 -1.33 0.00 0.00 177.39 177.82 3kdt n VAL 255 N -1.39 0.00 -0.03 4.08 0.24 -1.25 -4.96 118.33 115.02 3kdt n VAL 255 Ca 0.02 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.27 3kdt n VAL 255 Cb 0.21 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.54 3kdt n VAL 255 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kdt n ALA 256 N -3.00 1.84 0.00 2.33 0.00 -1.26 -4.97 120.51 115.46 3kdt n ALA 256 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3kdt n ALA 256 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.70 3kdt n ALA 256 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3kdt n ILE 263 N -2.54 0.00 0.27 0.00 0.00 -1.26 -5.05 119.36 110.78 3kdt n ILE 263 Ca -0.12 0.00 0.12 0.00 0.00 0.00 0.00 62.75 62.75 3kdt n ILE 263 Cb 0.66 0.00 0.75 0.00 0.00 0.00 0.00 39.64 41.05 3kdt n ILE 263 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 3kdt h GLN 264 N 0.00 0.00 0.00 9.51 1.08 -1.99 -2.11 115.11 121.60 3kdt h GLN 264 Ca 0.00 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.17 3kdt h GLN 264 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3kdt h GLN 264 CO 0.00 0.07 -0.15 -0.97 -0.95 0.00 0.00 178.83 176.83 3kdt h ASN 265 N 0.00 0.00 -2.24 1.46 -0.73 -2.07 -3.47 115.58 108.53 3kdt h ASN 265 Ca -0.00 0.00 -0.50 0.00 1.87 0.00 0.00 56.30 57.67 3kdt h ASN 265 Cb 0.16 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 38.71 3kdt h ASN 265 CO 0.01 0.15 -0.51 -0.54 -0.37 0.00 0.00 177.43 176.17 3kdt s LYS 266 N -4.28 3.01 0.82 6.67 1.02 -0.79 -5.10 119.74 121.09 3kdt s LYS 266 Ca -0.03 -0.99 -0.14 0.00 0.02 0.00 0.00 55.97 54.83 3kdt s LYS 266 Cb 0.14 -2.63 0.01 0.00 -0.52 0.00 0.00 37.83 34.83 3kdt s LYS 266 CO 0.62 0.41 0.58 -1.91 -0.92 0.00 0.00 175.35 174.13 3kdt n GLU 267 N -1.14 0.06 0.19 1.68 2.13 -1.26 -4.87 120.64 117.43 3kdt n GLU 267 Ca -0.08 0.07 0.14 0.00 0.66 0.00 0.00 57.16 57.95 3kdt n GLU 267 Cb 0.57 -1.93 0.42 0.00 0.27 0.00 0.00 31.44 30.77 3kdt n GLU 267 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3kdt h ALA 268 N -0.90 1.00 -0.05 4.31 0.00 -1.99 -3.01 119.26 118.62 3kdt h ALA 268 Ca -0.45 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 3kdt h ALA 268 Cb 1.32 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.11 3kdt h ALA 268 CO 0.40 0.00 -0.37 0.93 0.00 0.00 0.00 179.25 180.21 3kdt h GLU 269 N 0.00 0.34 0.00 0.00 3.07 -2.00 -3.23 114.58 112.76 3kdt h GLU 269 Ca 0.00 -0.30 -0.12 0.00 -0.50 0.00 0.00 59.36 58.44 3kdt h GLU 269 Cb 0.70 0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.66 3kdt h GLU 269 CO 0.00 0.96 -0.57 0.28 -1.40 0.00 0.00 179.01 178.28 3kdt h VAL 270 N -0.18 1.31 -0.49 3.13 2.07 -1.94 -1.13 116.25 119.01 3kdt h VAL 270 Ca -0.03 -2.01 0.09 0.00 0.82 0.00 0.00 66.70 65.56 3kdt h VAL 270 Cb 1.05 2.11 -0.07 0.00 -1.52 0.00 0.00 31.29 32.86 3kdt h VAL 270 CO 0.08 0.56 0.09 0.03 0.02 0.00 0.00 177.57 178.34 3kdt h ARG 271 N 0.00 0.22 0.17 1.57 3.08 -1.60 0.17 114.38 117.99 3kdt h ARG 271 Ca -0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3kdt h ARG 271 Cb 1.07 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.07 3kdt h ARG 271 CO 0.07 0.14 -0.08 0.82 -1.07 0.00 0.00 179.97 179.85 3kdt h ILE 272 N 0.22 0.94 -0.84 2.04 2.04 -1.50 -0.66 117.51 119.75 3kdt h ILE 272 Ca 0.25 -0.63 0.21 0.00 1.00 0.00 0.00 64.86 65.69 3kdt h ILE 272 Cb 0.34 1.31 -0.13 0.00 -0.74 0.00 0.00 36.82 37.60 3kdt h ILE 272 CO -0.33 0.14 0.20 0.15 0.00 0.00 0.00 178.15 178.32 3kdt h PHE 273 N -0.55 0.30 0.03 1.37 3.57 -0.80 0.51 116.94 121.38 3kdt h PHE 273 Ca -0.02 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 3kdt h PHE 273 Cb 0.41 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.15 3kdt h PHE 273 CO 0.02 -0.18 -0.01 1.25 -2.23 0.00 0.00 178.31 177.16 3kdt h HIS 274 N 0.22 -0.04 -1.03 0.41 2.76 -0.66 -3.20 115.15 113.62 3kdt h HIS 274 Ca 0.51 -0.00 0.26 0.00 -2.20 0.00 0.00 60.37 58.93 3kdt h HIS 274 Cb 0.97 0.01 -0.10 0.00 1.55 0.00 0.00 27.41 29.84 3kdt h HIS 274 CO -0.28 0.61 0.65 0.00 -1.30 0.00 0.00 177.93 177.61 3kdt h GLN 277 N 1.09 0.51 -0.87 0.00 4.20 -0.79 -1.73 115.11 117.52 3kdt h GLN 277 Ca 0.34 -0.31 0.13 0.00 0.06 0.00 0.00 58.65 58.86 3kdt h GLN 277 Cb -0.00 0.03 -0.09 0.00 0.30 0.00 0.00 27.48 27.73 3kdt h GLN 277 CO -0.11 0.92 0.49 0.00 -0.67 0.00 0.00 178.83 179.45 3kdt h THR 279 N 0.75 1.39 -0.24 0.00 2.02 -1.28 -3.01 112.91 112.54 3kdt h THR 279 Ca 0.45 -1.86 -0.12 0.00 0.77 0.00 0.00 66.41 65.65 3kdt h THR 279 Cb 0.54 2.31 -0.01 0.00 -1.74 0.00 0.00 68.15 69.25 3kdt h THR 279 CO -0.31 0.55 -0.37 0.77 0.37 0.00 0.00 175.52 176.54 3kdt h SER 280 N 0.01 0.57 -0.35 4.18 4.64 -1.00 -1.49 113.55 120.11 3kdt h SER 280 Ca -0.04 -0.24 -0.04 0.00 -0.47 0.00 0.00 61.79 61.00 3kdt h SER 280 Cb 1.14 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.06 3kdt h SER 280 CO 0.10 0.89 0.08 0.58 -0.87 0.00 0.00 176.83 177.61 3kdt h VAL 281 N 0.46 1.23 -0.34 0.95 2.07 -1.22 0.22 116.25 119.62 3kdt h VAL 281 Ca 0.05 -0.77 0.06 0.00 0.82 0.00 0.00 66.70 66.86 3kdt h VAL 281 Cb 0.85 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.62 3kdt h VAL 281 CO 0.07 0.26 -0.01 -0.33 0.02 0.00 0.00 177.57 177.58 3kdt h GLU 282 N 0.42 0.08 -0.62 1.57 5.08 -1.38 -1.39 114.58 118.34 3kdt h GLU 282 Ca 0.11 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 3kdt h GLU 282 Cb 0.31 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 3kdt h GLU 282 CO 0.00 0.06 0.26 1.15 -1.00 0.00 0.00 179.01 179.47 3kdt h THR 283 N 0.09 1.23 -0.92 1.13 2.02 -0.98 0.20 112.91 115.68 3kdt h THR 283 Ca 0.16 -0.71 0.11 0.00 0.77 0.00 0.00 66.41 66.75 3kdt h THR 283 Cb 0.23 0.54 -0.08 0.00 -1.74 0.00 0.00 68.15 67.10 3kdt h THR 283 CO -0.28 0.28 0.55 0.58 0.37 0.00 0.00 175.52 177.01 3kdt h VAL 284 N 0.86 0.90 -0.06 3.16 2.07 -0.31 0.37 116.25 123.24 3kdt h VAL 284 Ca 0.21 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 3kdt h VAL 284 Cb 0.19 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 29.90 3kdt h VAL 284 CO -0.02 0.16 0.01 0.74 0.02 0.00 0.00 177.57 178.48 3kdt h THR 285 N 0.88 1.22 -0.70 2.57 2.02 -0.38 -1.89 112.91 116.63 3kdt h THR 285 Ca 0.45 -0.66 0.04 0.00 0.77 0.00 0.00 66.41 67.01 3kdt h THR 285 Cb 0.45 1.55 -0.04 0.00 -1.74 0.00 0.00 68.15 68.37 3kdt h THR 285 CO -0.27 0.18 0.46 -0.33 0.37 0.00 0.00 175.52 175.94 3kdt h GLU 286 N -0.15 0.79 -0.07 6.66 5.08 -0.20 -2.17 114.58 124.51 3kdt h GLU 286 Ca 0.02 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.22 3kdt h GLU 286 Cb 0.28 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3kdt h GLU 286 CO 0.00 0.52 -0.47 -0.07 -1.00 0.00 0.00 179.01 177.99 3kdt h LEU 287 N 0.81 0.19 -0.15 1.33 3.38 0.01 -1.95 115.31 118.93 3kdt h LEU 287 Ca 0.29 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 3kdt h LEU 287 Cb 0.12 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3kdt h LEU 287 CO -0.09 0.64 -0.31 0.74 0.09 0.00 0.00 178.44 179.51 3kdt h THR 288 N 0.14 1.36 -0.63 0.22 2.02 -0.73 -0.38 112.91 114.92 3kdt h THR 288 Ca 0.01 -1.57 0.00 0.00 0.77 0.00 0.00 66.41 65.62 3kdt h THR 288 Cb 0.89 2.01 -0.03 0.00 -1.74 0.00 0.00 68.15 69.28 3kdt h THR 288 CO 0.07 0.47 0.41 -0.33 0.37 0.00 0.00 175.52 176.51 3kdt h GLU 289 N 0.08 0.83 -0.36 6.66 4.39 -1.39 -1.27 114.58 123.53 3kdt h GLU 289 Ca 0.00 -0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.50 3kdt h GLU 289 Cb 0.91 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 3kdt h GLU 289 CO 0.07 0.56 -0.35 0.35 -1.16 0.00 0.00 179.01 178.47 3kdt h PHE 290 N 0.86 0.98 -0.40 4.33 3.57 -1.28 -2.93 116.94 122.06 3kdt h PHE 290 Ca 0.23 -0.28 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 3kdt h PHE 290 Cb -0.09 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 3kdt h PHE 290 CO 0.00 1.06 0.09 0.00 -2.23 0.00 0.00 178.31 177.22 3kdt h ALA 291 N 0.91 0.53 0.00 2.41 0.00 -0.22 -2.52 119.26 120.36 3kdt h ALA 291 Ca 0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3kdt h ALA 291 Cb 0.91 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 3kdt h ALA 291 CO 0.08 0.22 -0.03 0.87 0.00 0.00 0.00 179.25 180.39 3kdt h LYS 292 N 0.51 0.00 -0.41 0.00 1.57 -1.31 -1.56 116.57 115.37 3kdt h LYS 292 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3kdt h LYS 292 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3kdt h LYS 292 CO 0.00 0.03 0.00 0.00 -0.57 0.00 0.00 179.45 178.91 3kdt n ALA 293 N -2.52 2.57 -2.66 3.86 0.00 -0.96 -4.49 120.51 116.31 3kdt n ALA 293 Ca -0.03 -0.58 -0.39 0.00 0.00 0.00 0.00 53.44 52.44 3kdt n ALA 293 Cb 0.11 -0.99 -0.07 0.00 0.00 0.00 0.00 19.45 18.51 3kdt n ALA 293 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3kdt s ILE 294 N -1.62 5.09 0.13 0.00 1.01 -0.59 -4.73 121.20 120.49 3kdt s ILE 294 Ca 0.21 0.99 -0.33 0.00 0.00 0.00 0.00 60.65 61.52 3kdt s ILE 294 Cb 0.12 -3.86 -0.13 0.00 0.01 0.00 0.00 42.46 38.60 3kdt s ILE 294 CO 0.12 0.17 1.69 -2.65 0.00 0.00 0.00 174.94 174.28 3kdt n PRO 295 N 4.79 2.38 0.00 2.79 -0.02 -1.26 -1.48 135.00 142.19 3kdt n PRO 295 Ca -0.04 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3kdt n PRO 295 Cb 0.50 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 3kdt n PRO 295 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kdt n GLY 296 N 3.80 2.83 0.10 -1.23 0.00 -1.26 -4.94 105.19 104.49 3kdt n GLY 296 Ca 0.18 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 3kdt n GLY 296 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3kdt h PHE 297 N 0.00 -0.05 -0.89 1.61 3.57 -1.53 -2.01 116.94 117.64 3kdt h PHE 297 Ca 0.00 0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.63 3kdt h PHE 297 Cb 0.00 0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.73 3kdt h PHE 297 CO 0.00 -0.05 0.57 0.00 -2.23 0.00 0.00 178.31 176.60 3kdt h ALA 298 N 1.18 1.68 0.00 2.41 0.00 -1.79 -2.57 119.26 120.18 3kdt h ALA 298 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3kdt h ALA 298 Cb 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3kdt h ALA 298 CO -0.18 0.12 0.05 -0.91 0.00 0.00 0.00 179.25 178.33 3kdt h ASN 299 N 0.83 0.00 -3.79 0.00 2.35 -1.73 -3.44 115.58 109.80 3kdt h ASN 299 Ca 0.42 0.00 -0.49 0.00 -0.55 0.00 0.00 56.30 55.69 3kdt h ASN 299 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 3kdt h ASN 299 CO -0.19 0.00 0.15 -0.76 -1.65 0.00 0.00 177.43 174.98 3kdt s LEU 300 N -4.99 3.92 0.16 1.61 1.43 -0.97 -4.99 118.68 114.85 3kdt s LEU 300 Ca -0.03 1.28 -0.32 0.00 -1.03 0.00 0.00 54.13 54.03 3kdt s LEU 300 Cb 0.08 -4.13 -0.17 0.00 0.03 0.00 0.00 46.19 42.00 3kdt s LEU 300 CO 0.25 -0.33 0.82 -0.67 0.23 0.00 0.00 176.35 176.65 3kdt n ASP 301 N -0.88 -0.20 -0.30 2.29 4.64 -1.26 -4.64 116.55 116.20 3kdt n ASP 301 Ca 0.04 1.14 -0.01 0.00 -1.38 0.00 0.00 54.79 54.58 3kdt n ASP 301 Cb 0.54 -1.03 0.05 0.00 -1.04 0.00 0.00 41.12 39.64 3kdt n ASP 301 CO 0.00 0.00 0.00 0.17 -0.82 0.00 0.00 177.20 176.55 3kdt h LEU 302 N 2.02 -1.13 0.00 -2.67 -0.00 -1.94 0.14 115.31 111.74 3kdt h LEU 302 Ca -0.37 0.27 0.00 0.00 -0.00 0.00 0.00 57.88 57.77 3kdt h LEU 302 Cb 1.41 0.62 0.00 0.00 -0.00 0.00 0.00 40.66 42.69 3kdt h LEU 302 CO 0.62 -0.29 0.00 0.59 -0.00 0.00 0.00 178.44 179.36 3kdt n ASN 303 N -5.49 0.00 0.01 0.17 3.02 -1.26 -1.52 115.26 110.18 3kdt n ASN 303 Ca 0.09 0.17 -0.16 0.00 -0.03 0.00 0.00 54.58 54.65 3kdt n ASN 303 Cb 0.40 -0.35 -0.14 0.00 -0.61 0.00 0.00 39.78 39.08 3kdt n ASN 303 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 3kdt h ASP 304 N 0.00 0.26 0.28 6.41 3.32 -1.12 -3.16 116.42 122.41 3kdt h ASP 304 Ca 0.00 -0.54 -0.03 0.00 0.02 0.00 0.00 57.03 56.48 3kdt h ASP 304 Cb 0.22 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 3kdt h ASP 304 CO 0.00 1.47 -0.16 1.56 -1.72 0.00 0.00 179.24 180.39 3kdt h GLN 305 N 0.05 0.00 0.00 3.56 4.20 -0.08 -2.41 115.11 120.43 3kdt h GLN 305 Ca -0.34 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.13 3kdt h GLN 305 Cb 2.02 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.77 3kdt h GLN 305 CO 0.10 0.16 -1.28 0.28 -0.67 0.00 0.00 178.83 177.42 3kdt h VAL 306 N 0.00 1.38 0.10 -0.54 2.07 -1.54 -3.29 116.25 114.43 3kdt h VAL 306 Ca -0.00 -3.14 -0.18 0.00 0.82 0.00 0.00 66.70 64.20 3kdt h VAL 306 Cb 0.35 2.68 0.02 0.00 -1.52 0.00 0.00 31.29 32.82 3kdt h VAL 306 CO 0.02 0.79 -0.75 0.74 0.02 0.00 0.00 177.57 178.39 3kdt h THR 307 N 0.00 1.49 -0.82 2.57 2.02 -1.44 -1.89 112.91 114.84 3kdt h THR 307 Ca -0.12 -2.41 0.04 0.00 0.77 0.00 0.00 66.41 64.70 3kdt h THR 307 Cb 1.87 3.04 -0.05 0.00 -1.74 0.00 0.00 68.15 71.26 3kdt h THR 307 CO 0.11 0.69 0.52 -0.07 0.37 0.00 0.00 175.52 177.14 3kdt h LEU 308 N -0.30 0.84 -1.12 2.58 3.38 -1.63 -1.49 115.31 117.58 3kdt h LEU 308 Ca -0.12 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3kdt h LEU 308 Cb 1.55 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 3kdt h LEU 308 CO 0.14 0.57 -0.22 -0.07 0.09 0.00 0.00 178.44 178.95 3kdt h LEU 309 N 0.99 0.34 0.36 1.67 3.38 -1.63 -0.50 115.31 119.92 3kdt h LEU 309 Ca 0.34 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 3kdt h LEU 309 Cb 0.06 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3kdt h LEU 309 CO -0.13 0.58 -0.17 0.50 0.09 0.00 0.00 178.44 179.30 3kdt h LYS 310 N 0.32 -0.47 0.00 1.13 3.64 -0.42 -2.68 116.57 118.09 3kdt h LYS 310 Ca 0.05 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3kdt h LYS 310 Cb 0.57 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 3kdt h LYS 310 CO 0.04 -0.19 -0.26 1.88 -2.27 0.00 0.00 179.45 178.65 3kdt h TYR 311 N -0.70 0.00 0.15 1.91 -1.99 -1.44 -3.36 116.97 111.54 3kdt h TYR 311 Ca -0.05 0.00 -0.34 0.00 2.00 0.00 0.00 58.73 60.34 3kdt h TYR 311 Cb 0.49 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.22 3kdt h TYR 311 CO -0.00 0.00 -1.70 0.78 -0.00 0.00 0.00 178.16 177.24 3kdt h GLY 312 N 4.24 0.37 0.42 3.88 0.00 -1.10 -3.41 103.07 107.48 3kdt h GLY 312 Ca 0.00 -0.95 0.12 0.00 0.00 0.00 0.00 47.33 46.50 3kdt h GLY 312 CO 0.00 0.83 0.55 -0.39 0.00 0.00 0.00 176.54 177.54 3kdt h VAL 313 N 0.09 0.87 0.05 4.60 -1.51 -1.62 -0.20 116.25 118.54 3kdt h VAL 313 Ca -0.31 -0.30 -0.00 0.00 -1.23 0.00 0.00 66.70 64.86 3kdt h VAL 313 Cb 2.07 -0.07 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 3kdt h VAL 313 CO 0.16 0.16 -0.02 1.88 -1.23 0.00 0.00 177.57 178.52 3kdt h TYR 314 N 0.86 -0.06 -0.97 5.19 -1.99 -1.83 0.62 116.97 118.79 3kdt h TYR 314 Ca 0.47 -0.00 0.27 0.00 2.00 0.00 0.00 58.73 61.47 3kdt h TYR 314 Cb 0.51 0.02 -0.14 0.00 2.00 0.00 0.00 36.73 39.12 3kdt h TYR 314 CO -0.03 0.44 0.49 0.93 -0.00 0.00 0.00 178.16 179.99 3kdt h GLU 315 N -0.61 0.38 -0.01 4.88 5.08 -1.63 0.96 114.58 123.63 3kdt h GLU 315 Ca -0.01 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.08 3kdt h GLU 315 Cb 0.53 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 29.71 3kdt h GLU 315 CO 0.01 0.25 -1.00 0.00 -1.00 0.00 0.00 179.01 177.27 3kdt h ALA 316 N 1.78 0.20 -0.22 3.43 0.00 -0.76 -2.37 119.26 121.33 3kdt h ALA 316 Ca 0.65 -0.69 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3kdt h ALA 316 Cb 1.36 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 3kdt h ALA 316 CO -0.57 0.72 0.12 0.82 0.00 0.00 0.00 179.25 180.34 3kdt h ILE 317 N 0.36 1.01 0.00 0.00 2.04 0.21 -1.79 117.51 119.34 3kdt h ILE 317 Ca -0.11 -0.09 -0.09 0.00 1.00 0.00 0.00 64.86 65.57 3kdt h ILE 317 Cb 1.65 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 3kdt h ILE 317 CO 0.19 0.05 -0.44 -0.26 0.00 0.00 0.00 178.15 177.69 3kdt h PHE 318 N 0.25 0.00 -0.36 1.37 0.04 -0.91 0.28 116.94 117.60 3kdt h PHE 318 Ca 0.09 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.75 3kdt h PHE 318 Cb 0.01 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 3kdt h PHE 318 CO -0.08 0.44 -0.21 0.00 -0.60 0.00 0.00 178.31 177.85 3kdt h ALA 319 N 1.56 0.52 0.00 2.45 0.00 -1.19 -3.16 119.26 119.44 3kdt h ALA 319 Ca -0.00 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 3kdt h ALA 319 Cb 0.90 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3kdt h ALA 319 CO 0.06 0.48 -0.71 0.52 0.00 0.00 0.00 179.25 179.60 3kdt h MET 320 N 0.58 0.00 -0.48 0.00 2.86 -1.02 -3.00 114.93 113.86 3kdt h MET 320 Ca 0.08 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.85 3kdt h MET 320 Cb 0.77 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 3kdt h MET 320 CO 0.06 0.71 0.41 1.25 1.06 0.00 0.00 176.91 180.39 3kdt h LEU 321 N 0.00 0.00 -1.12 1.22 5.85 -0.42 -1.26 115.31 119.58 3kdt h LEU 321 Ca -0.01 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 3kdt h LEU 321 Cb 1.39 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.40 3kdt h LEU 321 CO 0.09 0.00 -0.13 0.28 -0.34 0.00 0.00 178.44 178.34 3kdt h SER 322 N 0.00 0.45 -0.77 1.25 0.02 -1.52 -2.63 113.55 110.34 3kdt h SER 322 Ca 0.23 -0.11 0.17 0.00 -0.84 0.00 0.00 61.79 61.23 3kdt h SER 322 Cb 1.04 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.41 3kdt h SER 322 CO -0.00 0.61 0.52 0.28 -1.14 0.00 0.00 176.83 177.10 3kdt h SER 323 N 0.43 0.33 -0.50 3.07 0.02 -1.41 -2.07 113.55 113.42 3kdt h SER 323 Ca 0.08 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3kdt h SER 323 Cb 0.49 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.99 3kdt h SER 323 CO 0.03 0.16 0.00 1.33 -1.14 0.00 0.00 176.83 177.21 3kdt n VAL 324 N -4.46 1.22 -4.65 2.27 0.24 -1.00 -4.60 118.33 107.34 3kdt n VAL 324 Ca 0.15 -1.10 -0.31 0.00 -2.04 0.00 0.00 64.34 61.04 3kdt n VAL 324 Cb 0.60 0.39 -0.12 0.00 -1.47 0.00 0.00 33.84 33.24 3kdt n VAL 324 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3kdt s MET 325 N -1.26 2.29 0.00 7.34 -1.94 -0.78 -0.25 119.30 124.69 3kdt s MET 325 Ca 0.36 -0.86 0.00 0.00 -1.71 0.00 0.00 55.69 53.49 3kdt s MET 325 Cb 0.21 -2.31 0.00 0.00 2.01 0.00 0.00 34.83 34.74 3kdt s MET 325 CO 0.22 0.57 0.00 0.27 -0.01 0.00 0.00 175.02 176.07 3kdt n ASN 326 N 1.69 1.26 0.25 3.03 0.23 -0.43 -4.95 115.26 116.35 3kdt n ASN 326 Ca -0.16 -0.42 0.13 0.00 -0.53 0.00 0.00 54.58 53.60 3kdt n ASN 326 Cb 0.52 0.00 0.57 0.00 -2.08 0.00 0.00 39.78 38.79 3kdt n ASN 326 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 3kdt h LYS 327 N 0.00 0.00 0.03 -3.83 2.10 -2.00 -3.29 116.57 109.58 3kdt h LYS 327 Ca 0.00 0.00 -0.36 0.00 -2.00 0.00 0.00 60.65 58.29 3kdt h LYS 327 Cb 0.00 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.28 3kdt h LYS 327 CO 0.00 0.14 -2.21 -0.25 -2.00 0.00 0.00 179.45 175.13 3kdt n ASP 328 N -3.33 1.33 0.00 7.07 8.00 -1.26 -4.77 116.55 123.59 3kdt n ASP 328 Ca -0.00 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.57 3kdt n ASP 328 Cb 0.36 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 3kdt n ASP 328 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kdt n GLY 329 N 1.95 1.57 3.05 0.44 0.00 -1.24 0.12 105.19 111.08 3kdt n GLY 329 Ca -0.34 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 3kdt n GLY 329 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3kdt s MET 330 N 1.10 0.48 -0.38 1.61 0.23 -1.02 -1.31 119.30 120.02 3kdt s MET 330 Ca 0.00 -0.91 -0.28 0.00 -1.03 0.00 0.00 55.69 53.47 3kdt s MET 330 Cb 0.00 0.17 0.02 0.00 -1.53 0.00 0.00 34.83 33.49 3kdt s MET 330 CO 0.00 -0.09 1.05 -0.51 -2.03 0.00 0.00 175.02 173.44 3kdt s LEU 331 N -2.22 3.87 0.00 0.18 1.43 0.65 -2.30 118.68 120.30 3kdt s LEU 331 Ca -0.04 0.74 0.04 0.00 -1.03 0.00 0.00 54.13 53.85 3kdt s LEU 331 Cb -0.01 -3.46 0.04 0.00 0.03 0.00 0.00 46.19 42.80 3kdt s LEU 331 CO -0.06 -0.97 0.37 1.33 0.23 0.00 0.00 176.35 177.25 3kdt n VAL 332 N 6.16 0.00 -3.77 -1.59 0.24 -1.12 -4.70 118.33 113.56 3kdt n VAL 332 Ca 0.10 -1.91 -0.28 0.00 -2.04 0.00 0.00 64.34 60.21 3kdt n VAL 332 Cb 0.48 -0.10 0.01 0.00 -1.47 0.00 0.00 33.84 32.76 3kdt n VAL 332 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kdt n ALA 333 N -2.01 -2.45 -1.18 2.33 0.00 -1.26 -0.69 120.51 115.25 3kdt n ALA 333 Ca -0.15 -0.34 -0.06 0.00 0.00 0.00 0.00 53.44 52.88 3kdt n ALA 333 Cb 0.55 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.78 3kdt n ALA 333 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3kdt n TYR 334 N -3.14 0.00 0.00 0.00 4.02 -1.26 -0.58 117.16 116.20 3kdt n TYR 334 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.69 3kdt n TYR 334 Cb 0.54 -2.41 0.00 0.00 -0.02 0.00 0.00 39.34 37.45 3kdt n TYR 334 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kdt n GLY 335 N 0.54 0.44 0.18 2.72 0.00 0.13 -4.95 105.19 104.24 3kdt n GLY 335 Ca -0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.02 3kdt n GLY 335 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3kdt h ASN 336 N 0.00 0.00 -0.61 1.61 2.35 -0.63 -3.42 115.58 114.88 3kdt h ASN 336 Ca 0.00 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.16 3kdt h ASN 336 Cb 0.00 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 3kdt h ASN 336 CO 0.00 0.32 -0.33 -0.83 -1.65 0.00 0.00 177.43 174.94 3kdt s GLY 337 N -4.36 2.42 -0.30 2.83 0.00 -0.88 -0.56 107.32 106.47 3kdt s GLY 337 Ca 0.04 -1.23 -0.10 0.00 0.00 0.00 0.00 44.72 43.43 3kdt s GLY 337 CO 0.71 -1.95 0.77 -0.12 0.00 0.00 0.00 173.10 172.50 3kdt s PHE 338 N -2.77 -1.14 -0.17 1.90 5.36 -0.05 -2.80 117.98 118.32 3kdt s PHE 338 Ca 0.32 1.80 -0.01 0.00 -0.96 0.00 0.00 56.93 58.08 3kdt s PHE 338 Cb -0.02 0.62 -0.01 0.00 -0.34 0.00 0.00 43.02 43.27 3kdt s PHE 338 CO 0.20 -0.58 -0.11 -1.50 -1.46 0.00 0.00 175.22 171.77 3kdt s ILE 339 N 2.76 3.02 0.53 3.12 2.07 -0.97 0.80 121.20 132.53 3kdt s ILE 339 Ca -0.01 -0.64 -0.22 0.00 -1.41 0.00 0.00 60.65 58.37 3kdt s ILE 339 Cb -0.11 -2.31 -0.05 0.00 0.13 0.00 0.00 42.46 40.12 3kdt s ILE 339 CO -0.18 0.49 1.30 0.42 -1.91 0.00 0.00 174.94 175.05 3kdt s THR 340 N 0.86 2.36 0.17 4.00 -4.23 -0.81 -2.42 115.64 115.58 3kdt s THR 340 Ca -0.03 0.27 -0.11 0.00 -1.18 0.00 0.00 61.69 60.63 3kdt s THR 340 Cb -0.15 -3.13 0.08 0.00 1.34 0.00 0.00 72.50 70.63 3kdt s THR 340 CO 0.00 -0.01 1.70 -0.09 -0.54 0.00 0.00 174.62 175.69 3kdt h ARG 341 N 1.50 0.94 -0.07 3.99 2.43 0.68 -2.60 114.38 121.26 3kdt h ARG 341 Ca -0.50 -0.20 0.04 0.00 -0.81 0.00 0.00 59.98 58.50 3kdt h ARG 341 Cb 1.29 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.65 3kdt h ARG 341 CO 0.58 0.84 -0.29 0.93 -1.51 0.00 0.00 179.97 180.52 3kdt h GLU 342 N 0.87 -0.38 -0.90 0.20 4.39 -1.91 -0.83 114.58 116.02 3kdt h GLU 342 Ca 0.20 0.03 0.12 0.00 0.34 0.00 0.00 59.36 60.05 3kdt h GLU 342 Cb 0.29 0.09 -0.08 0.00 -0.10 0.00 0.00 28.75 28.94 3kdt h GLU 342 CO -0.01 -0.25 0.52 0.35 -1.16 0.00 0.00 179.01 178.46 3kdt h PHE 343 N -0.39 0.93 -0.36 4.33 3.57 -1.78 0.35 116.94 123.58 3kdt h PHE 343 Ca 0.08 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 3kdt h PHE 343 Cb 0.51 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 3kdt h PHE 343 CO -0.35 0.32 -0.05 -0.07 -2.23 0.00 0.00 178.31 175.93 3kdt h LEU 344 N 0.80 0.56 -0.19 0.59 3.38 -1.02 -2.79 115.31 116.64 3kdt h LEU 344 Ca 0.46 -0.13 -0.22 0.00 0.09 0.00 0.00 57.88 58.08 3kdt h LEU 344 Cb 0.52 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3kdt h LEU 344 CO -0.30 0.67 -0.92 0.11 0.09 0.00 0.00 178.44 178.10 3kdt h LYS 345 N 0.55 0.43 -1.78 1.13 1.57 0.28 -3.21 116.57 115.55 3kdt h LYS 345 Ca 0.11 -0.44 -0.19 0.00 -1.87 0.00 0.00 60.65 58.26 3kdt h LYS 345 Cb 0.43 0.12 -0.08 0.00 0.08 0.00 0.00 32.23 32.79 3kdt h LYS 345 CO 0.02 1.10 0.19 -1.13 -0.57 0.00 0.00 179.45 179.07 3kdt n SER 346 N -3.76 5.93 -4.63 0.86 3.41 0.11 -4.78 113.62 110.76 3kdt n SER 346 Ca -0.07 -2.76 -0.26 0.00 -0.26 0.00 0.00 58.87 55.52 3kdt n SER 346 Cb 0.82 -1.12 -0.08 0.00 -0.26 0.00 0.00 64.21 63.57 3kdt n SER 346 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3kdt s LEU 347 N -0.97 3.19 0.63 1.04 1.43 -1.18 -4.95 118.68 117.87 3kdt s LEU 347 Ca 0.21 -0.50 -0.14 0.00 -1.03 0.00 0.00 54.13 52.67 3kdt s LEU 347 Cb 0.15 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 3kdt s LEU 347 CO -0.01 0.08 1.07 0.00 0.23 0.00 0.00 176.35 177.71 3kdt s ARG 348 N -3.05 3.12 0.73 1.70 1.70 -1.26 -4.27 118.95 117.62 3kdt s ARG 348 Ca 0.27 1.17 -0.16 0.00 -0.47 0.00 0.00 55.73 56.55 3kdt s ARG 348 Cb -0.09 -2.01 0.04 0.00 -0.57 0.00 0.00 34.95 32.32 3kdt s ARG 348 CO 0.18 -0.97 1.25 0.15 -1.08 0.00 0.00 175.30 174.83 3kdt s LYS 349 N -4.33 2.10 -0.01 3.89 -0.14 -1.26 -2.21 119.74 117.78 3kdt s LYS 349 Ca 0.63 1.91 0.10 0.00 -1.36 0.00 0.00 55.97 57.24 3kdt s LYS 349 Cb -0.16 -1.81 0.30 0.00 -1.68 0.00 0.00 37.83 34.48 3kdt s LYS 349 CO 0.42 -1.91 1.23 -0.35 -0.76 0.00 0.00 175.35 173.99 3kdt n PRO 350 N -2.60 1.87 0.12 -1.68 -0.05 -1.26 -4.90 135.00 126.50 3kdt n PRO 350 Ca 0.15 -1.23 0.10 0.00 -0.05 0.00 0.00 63.50 62.46 3kdt n PRO 350 Cb 0.49 -1.31 0.46 0.00 -0.05 0.00 0.00 33.50 33.09 3kdt n PRO 350 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 175.50 176.64 3kdt n PHE 351 N 0.47 0.61 0.15 0.54 3.01 -0.94 -2.04 117.46 119.26 3kdt n PHE 351 Ca 0.11 0.28 0.11 0.00 1.01 0.00 0.00 57.45 58.97 3kdt n PHE 351 Cb 0.32 -0.95 -0.07 0.00 -0.01 0.00 0.00 39.48 38.77 3kdt n PHE 351 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3kdt n ASP 353 N -2.37 0.00 0.00 0.00 10.43 -0.86 -3.97 116.55 119.78 3kdt n ASP 353 Ca -0.01 -0.01 0.00 0.00 2.57 0.00 0.00 54.79 57.34 3kdt n ASP 353 Cb 0.54 -0.30 0.00 0.00 1.84 0.00 0.00 41.12 43.20 3kdt n ASP 353 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 3kdt n ILE 354 N -1.30 0.00 0.06 0.53 2.08 -1.23 -4.48 119.36 115.02 3kdt n ILE 354 Ca 0.10 1.01 -0.07 0.00 0.56 0.00 0.00 62.75 64.36 3kdt n ILE 354 Cb 0.18 -2.01 -0.11 0.00 -0.75 0.00 0.00 39.64 36.95 3kdt n ILE 354 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 3kdt h MET 355 N 0.00 0.00 -0.50 0.38 2.86 -1.79 -3.37 114.93 112.51 3kdt h MET 355 Ca 0.00 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 57.73 3kdt h MET 355 Cb 0.00 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 31.56 3kdt h MET 355 CO 0.00 0.94 -0.37 1.49 1.06 0.00 0.00 176.91 180.03 3kdt h GLU 356 N 0.00 -0.22 -0.27 1.72 4.57 -1.79 -1.59 114.58 117.00 3kdt h GLU 356 Ca -0.03 0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.25 3kdt h GLU 356 Cb 1.76 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 30.39 3kdt h GLU 356 CO 0.12 -0.15 0.24 -1.35 -1.18 0.00 0.00 179.01 176.69 3kdt h PRO 357 N -0.23 0.00 -0.13 0.92 0.11 -1.80 -0.08 132.00 130.79 3kdt h PRO 357 Ca 0.19 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.12 3kdt h PRO 357 Cb 0.56 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.66 3kdt h PRO 357 CO -0.62 0.00 -0.66 0.87 -0.21 0.00 0.00 178.00 177.37 3kdt h LYS 358 N 0.00 0.50 -0.58 1.05 6.56 -1.53 -2.05 116.57 120.51 3kdt h LYS 358 Ca 0.13 -0.37 -0.05 0.00 -1.06 0.00 0.00 60.65 59.30 3kdt h LYS 358 Cb 0.61 0.06 -0.02 0.00 -0.57 0.00 0.00 32.23 32.31 3kdt h LYS 358 CO -0.00 0.99 0.17 0.74 -2.06 0.00 0.00 179.45 179.28 3kdt h PHE 359 N 0.36 0.95 0.23 -1.35 0.04 -0.75 0.38 116.94 116.79 3kdt h PHE 359 Ca -0.02 -0.10 0.01 0.00 2.80 0.00 0.00 57.97 60.66 3kdt h PHE 359 Cb 1.23 -0.27 -0.03 0.00 2.20 0.00 0.00 35.95 39.07 3kdt h PHE 359 CO 0.05 0.80 -0.38 -0.44 -0.60 0.00 0.00 178.31 177.74 3kdt h ASP 360 N 0.82 -1.08 -0.54 2.17 3.45 -1.25 -1.21 116.42 118.79 3kdt h ASP 360 Ca 0.18 0.11 0.11 0.00 0.43 0.00 0.00 57.03 57.86 3kdt h ASP 360 Cb 0.31 0.39 -0.10 0.00 -0.56 0.00 0.00 39.33 39.37 3kdt h ASP 360 CO -0.00 -0.49 -0.12 0.15 -1.57 0.00 0.00 179.24 177.21 3kdt h PHE 361 N -0.68 -0.27 -0.75 4.55 3.57 -1.17 -2.63 116.94 119.56 3kdt h PHE 361 Ca 0.00 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 3kdt h PHE 361 Cb 0.67 0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 3kdt h PHE 361 CO -0.28 -0.22 0.29 0.00 -2.23 0.00 0.00 178.31 175.86 3kdt h ALA 362 N 1.53 1.08 -0.12 2.41 0.00 -0.33 0.23 119.26 124.06 3kdt h ALA 362 Ca 0.26 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3kdt h ALA 362 Cb 0.40 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3kdt h ALA 362 CO -0.55 0.65 0.06 0.52 0.00 0.00 0.00 179.25 179.93 3kdt h MET 363 N 1.10 0.18 -0.48 0.00 2.86 -0.89 0.65 114.93 118.36 3kdt h MET 363 Ca 0.25 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.88 3kdt h MET 363 Cb 0.23 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 3kdt h MET 363 CO -0.02 0.24 0.31 0.87 1.06 0.00 0.00 176.91 179.37 3kdt h LYS 364 N 0.07 0.60 -0.06 1.72 1.57 -1.19 -2.17 116.57 117.12 3kdt h LYS 364 Ca 0.04 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kdt h LYS 364 Cb 0.12 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 3kdt h LYS 364 CO -0.01 0.40 0.02 0.35 -0.57 0.00 0.00 179.45 179.64 3kdt h PHE 365 N 0.62 0.09 0.00 -1.35 3.57 0.07 -2.79 116.94 117.14 3kdt h PHE 365 Ca 0.18 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.68 3kdt h PHE 365 Cb -0.04 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.68 3kdt h PHE 365 CO -0.05 0.21 0.00 -0.91 -2.23 0.00 0.00 178.31 175.33 3kdt h ASN 366 N -0.07 0.00 -0.28 0.41 2.35 0.35 -0.54 115.58 117.81 3kdt h ASN 366 Ca 0.02 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.78 3kdt h ASN 366 Cb 0.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3kdt h ASN 366 CO -0.00 0.00 0.18 0.00 -1.65 0.00 0.00 177.43 175.96 3kdt h ALA 367 N 2.08 1.83 0.00 -0.83 0.00 -1.10 0.16 119.26 121.39 3kdt h ALA 367 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3kdt h ALA 367 Cb 0.40 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3kdt h ALA 367 CO 0.00 0.15 -0.04 -0.07 0.00 0.00 0.00 179.25 179.30 3kdt h LEU 368 N 0.35 0.00 -1.97 0.00 3.38 -1.12 -3.47 115.31 112.49 3kdt h LEU 368 Ca 0.10 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.67 3kdt h LEU 368 Cb -0.01 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.81 3kdt h LEU 368 CO -0.02 0.04 -0.84 -0.62 0.09 0.00 0.00 178.44 177.08 3kdt n GLU 369 N -3.21 -4.40 -1.60 1.13 1.02 0.54 -4.95 120.64 109.17 3kdt n GLU 369 Ca -0.01 0.63 -0.31 0.00 -0.02 0.00 0.00 57.16 57.45 3kdt n GLU 369 Cb 0.23 -5.14 0.06 0.00 -0.02 0.00 0.00 31.44 26.57 3kdt n GLU 369 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3kdt s LEU 370 N -6.55 2.98 0.35 -4.62 1.43 -1.26 -5.09 118.68 105.91 3kdt s LEU 370 Ca 0.08 1.49 0.07 0.00 -1.03 0.00 0.00 54.13 54.74 3kdt s LEU 370 Cb -0.02 -4.31 -0.07 0.00 0.03 0.00 0.00 46.19 41.82 3kdt s LEU 370 CO 0.81 -1.54 -0.02 1.51 0.23 0.00 0.00 176.35 177.34 3kdt s ASP 371 N -3.88 3.36 0.42 2.29 1.47 -1.26 -4.98 116.67 114.09 3kdt s ASP 371 Ca 0.59 -1.29 0.20 0.00 1.18 0.00 0.00 52.55 53.22 3kdt s ASP 371 Cb -0.14 -0.29 1.14 0.00 -0.34 0.00 0.00 42.92 43.30 3kdt s ASP 371 CO 0.55 -0.39 1.81 0.44 0.68 0.00 0.00 175.17 178.26 3kdt h ASP 372 N 2.00 0.38 -0.54 2.11 3.32 -1.97 0.57 116.42 122.28 3kdt h ASP 372 Ca -0.42 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.66 3kdt h ASP 372 Cb 1.24 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 3kdt h ASP 372 CO 0.74 0.11 0.23 0.77 -1.72 0.00 0.00 179.24 179.37 3kdt h SER 373 N 0.35 0.73 -0.42 6.45 4.64 -1.96 0.82 113.55 124.16 3kdt h SER 373 Ca 0.53 -0.16 -0.06 0.00 -0.47 0.00 0.00 61.79 61.64 3kdt h SER 373 Cb 1.43 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 3kdt h SER 373 CO -0.21 0.69 0.05 0.44 -0.87 0.00 0.00 176.83 176.93 3kdt h ASP 374 N 0.73 0.69 0.05 4.97 3.32 -0.40 -3.21 116.42 122.58 3kdt h ASP 374 Ca 0.18 -0.27 -0.12 0.00 0.02 0.00 0.00 57.03 56.84 3kdt h ASP 374 Cb 0.17 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 3kdt h ASP 374 CO -0.02 0.79 -0.39 0.40 -1.72 0.00 0.00 179.24 178.31 3kdt h ILE 375 N 0.57 1.30 0.19 0.35 2.04 -0.50 -0.62 117.51 120.84 3kdt h ILE 375 Ca 0.13 -1.52 0.01 0.00 1.00 0.00 0.00 64.86 64.47 3kdt h ILE 375 Cb 0.41 1.58 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 3kdt h ILE 375 CO 0.01 0.47 -0.51 0.77 0.00 0.00 0.00 178.15 178.90 3kdt h SER 376 N 0.37 -1.50 -0.58 1.72 4.64 -0.87 0.32 113.55 117.64 3kdt h SER 376 Ca 0.04 0.15 -0.05 0.00 -0.47 0.00 0.00 61.79 61.46 3kdt h SER 376 Cb 0.85 0.55 -0.02 0.00 -0.31 0.00 0.00 62.40 63.46 3kdt h SER 376 CO 0.07 -0.57 0.17 -0.07 -0.87 0.00 0.00 176.83 175.56 3kdt h LEU 377 N -0.79 0.85 0.00 5.97 3.38 -1.49 -0.48 115.31 122.76 3kdt h LEU 377 Ca -0.01 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.77 3kdt h LEU 377 Cb 0.77 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 3kdt h LEU 377 CO -0.24 0.84 -0.13 0.15 0.09 0.00 0.00 178.44 179.15 3kdt h PHE 378 N 0.82 -0.34 -0.86 1.13 3.57 -1.02 0.74 116.94 120.98 3kdt h PHE 378 Ca 0.19 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.74 3kdt h PHE 378 Cb 0.30 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.14 3kdt h PHE 378 CO 0.02 -0.20 0.55 0.28 -2.23 0.00 0.00 178.31 176.73 3kdt h VAL 379 N -0.23 1.11 -0.25 1.41 2.07 -0.55 -1.63 116.25 118.19 3kdt h VAL 379 Ca 0.05 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 3kdt h VAL 379 Cb 0.28 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 3kdt h VAL 379 CO -0.13 0.19 -0.01 0.00 0.02 0.00 0.00 177.57 177.64 3kdt h ALA 380 N 1.37 1.53 0.00 1.67 0.00 -0.21 -1.16 119.26 122.46 3kdt h ALA 380 Ca 0.35 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 3kdt h ALA 380 Cb 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3kdt h ALA 380 CO -0.13 0.34 -0.26 0.00 0.00 0.00 0.00 179.25 179.20 3kdt h ALA 381 N 1.64 1.09 0.04 0.00 0.00 0.05 -1.50 119.26 120.58 3kdt h ALA 381 Ca 0.08 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3kdt h ALA 381 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3kdt h ALA 381 CO 0.01 0.33 -0.02 0.82 0.00 0.00 0.00 179.25 180.39 3kdt h ILE 382 N 0.00 1.35 0.01 0.00 2.04 -0.68 -3.32 117.51 116.90 3kdt h ILE 382 Ca -0.00 -1.62 0.01 0.00 1.00 0.00 0.00 64.86 64.25 3kdt h ILE 382 Cb 0.71 2.38 -0.01 0.00 -0.74 0.00 0.00 36.82 39.15 3kdt h ILE 382 CO 0.03 0.39 -0.06 0.40 0.00 0.00 0.00 178.15 178.91 3kdt h ILE 383 N -0.81 0.84 -0.31 -0.67 2.04 -1.35 -3.33 117.51 113.93 3kdt h ILE 383 Ca -0.01 0.00 -0.71 0.00 1.00 0.00 0.00 64.86 65.14 3kdt h ILE 383 Cb 0.68 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 3kdt h ILE 383 CO 0.01 0.00 3.07 0.00 0.00 0.00 0.00 178.15 181.23 3kdt n GLY 386 N 3.51 -0.04 0.16 0.00 0.00 -1.26 -3.77 105.19 103.78 3kdt n GLY 386 Ca -0.19 -0.40 -0.22 0.00 0.00 0.00 0.00 46.02 45.20 3kdt n GLY 386 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3kdt h ASP 387 N 2.03 0.80 -0.57 1.61 3.45 -1.97 -3.47 116.42 118.30 3kdt h ASP 387 Ca 0.00 -0.78 -0.81 0.00 0.43 0.00 0.00 57.03 55.86 3kdt h ASP 387 Cb 0.44 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.94 3kdt h ASP 387 CO 0.00 1.60 1.02 0.54 -1.57 0.00 0.00 179.24 180.83 3kdt n ARG 388 N -3.73 0.10 -1.45 3.56 5.12 -1.25 -4.84 116.66 114.17 3kdt n ARG 388 Ca -0.14 0.03 -0.38 0.00 -1.93 0.00 0.00 57.85 55.43 3kdt n ARG 388 Cb 1.03 -1.56 0.04 0.00 -1.16 0.00 0.00 32.46 30.80 3kdt n ARG 388 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 3kdt n PRO 389 N 5.84 0.49 -1.09 5.56 -0.04 -1.26 -3.35 135.00 141.15 3kdt n PRO 389 Ca 0.42 0.20 -0.03 0.00 -0.04 0.00 0.00 63.50 64.05 3kdt n PRO 389 Cb -0.03 -1.72 -0.01 0.00 -0.04 0.00 0.00 33.50 31.70 3kdt n PRO 389 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kdt n GLY 390 N 1.77 0.58 3.76 0.55 0.00 -1.26 -5.00 105.19 105.59 3kdt n GLY 390 Ca 0.11 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 3kdt n GLY 390 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kdt s LEU 391 N -0.74 3.68 -0.19 0.99 1.43 -1.21 -4.99 118.68 117.65 3kdt s LEU 391 Ca 0.00 2.31 -0.15 0.00 -1.03 0.00 0.00 54.13 55.26 3kdt s LEU 391 Cb 0.00 -4.59 -0.07 0.00 0.03 0.00 0.00 46.19 41.55 3kdt s LEU 391 CO 0.00 -1.49 -0.24 0.18 0.23 0.00 0.00 176.35 175.03 3kdt n LEU 392 N -1.55 1.89 -3.78 1.79 4.77 -1.26 -4.58 117.00 114.28 3kdt n LEU 392 Ca 0.13 0.43 -0.42 0.00 -0.03 0.00 0.00 56.01 56.12 3kdt n LEU 392 Cb 0.50 -0.82 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 3kdt n LEU 392 CO 0.44 -0.14 1.86 -3.20 -1.33 0.00 0.00 177.39 175.02 3kdt n ASN 393 N -4.47 6.26 -0.28 -1.43 2.85 -1.26 -4.82 115.26 112.10 3kdt n ASN 393 Ca -0.20 -3.23 0.10 0.00 -0.11 0.00 0.00 54.58 51.14 3kdt n ASN 393 Cb 0.52 -1.38 0.34 0.00 1.24 0.00 0.00 39.78 40.49 3kdt n ASN 393 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 3kdt h VAL 394 N 3.27 0.88 -0.13 3.44 2.07 -1.96 -2.38 116.25 121.44 3kdt h VAL 394 Ca 0.44 -0.27 -0.11 0.00 0.82 0.00 0.00 66.70 67.58 3kdt h VAL 394 Cb 0.52 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 3kdt h VAL 394 CO 1.50 0.14 -0.42 1.23 0.02 0.00 0.00 177.57 180.04 3kdt h GLY 395 N 0.78 0.33 0.94 2.17 0.00 -1.98 -2.48 103.07 102.84 3kdt h GLY 395 Ca 0.44 -0.33 -0.33 0.00 0.00 0.00 0.00 47.33 47.12 3kdt h GLY 395 CO -0.21 0.30 -1.75 0.84 0.00 0.00 0.00 176.54 175.72 3kdt h HIS 396 N 0.26 0.45 -0.97 5.60 6.17 -1.86 -2.32 115.15 122.48 3kdt h HIS 396 Ca 0.02 -0.33 0.09 0.00 0.71 0.00 0.00 60.37 60.86 3kdt h HIS 396 Cb 0.85 -0.02 -0.07 0.00 2.52 0.00 0.00 27.41 30.69 3kdt h HIS 396 CO 0.02 1.52 0.61 0.82 0.71 0.00 0.00 177.93 181.61 3kdt h ILE 397 N 0.07 1.00 -0.26 6.26 2.04 -1.49 0.25 117.51 125.36 3kdt h ILE 397 Ca -0.33 -0.36 -0.04 0.00 1.00 0.00 0.00 64.86 65.14 3kdt h ILE 397 Cb 2.04 -0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 3kdt h ILE 397 CO 0.13 0.19 0.03 -0.33 0.00 0.00 0.00 178.15 178.17 3kdt h GLU 398 N 1.04 0.45 -0.52 2.37 5.08 -1.46 0.44 114.58 121.98 3kdt h GLU 398 Ca 0.45 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.66 3kdt h GLU 398 Cb 0.32 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 3kdt h GLU 398 CO -0.22 0.59 0.22 0.87 -1.00 0.00 0.00 179.01 179.47 3kdt h LYS 399 N 0.25 0.74 -0.01 2.33 1.57 -1.06 0.21 116.57 120.60 3kdt h LYS 399 Ca 0.08 -0.10 -0.15 0.00 -1.87 0.00 0.00 60.65 58.61 3kdt h LYS 399 Cb 0.37 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3kdt h LYS 399 CO 0.01 0.60 -0.68 1.98 -0.57 0.00 0.00 179.45 180.78 3kdt h MET 400 N 0.73 0.07 0.20 3.15 4.05 -0.28 -2.77 114.93 120.09 3kdt h MET 400 Ca 0.18 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.53 3kdt h MET 400 Cb 0.13 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 30.94 3kdt h MET 400 CO -0.02 0.72 -0.10 0.37 0.23 0.00 0.00 176.91 178.12 3kdt h GLN 401 N 0.05 -0.26 -0.16 0.39 4.15 0.69 -2.95 115.11 117.02 3kdt h GLN 401 Ca -0.01 0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.47 3kdt h GLN 401 Cb 1.21 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.95 3kdt h GLN 401 CO 0.09 0.13 0.43 1.49 -1.93 0.00 0.00 178.83 179.04 3kdt h GLU 402 N -0.89 0.00 0.19 1.69 4.81 -0.65 0.11 114.58 119.84 3kdt h GLU 402 Ca -0.03 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 58.94 3kdt h GLU 402 Cb 0.51 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.91 3kdt h GLU 402 CO 0.05 0.00 -1.18 0.78 -0.73 0.00 0.00 179.01 177.92 3kdt h GLY 403 N 0.00 0.46 1.31 1.92 0.00 -1.47 -2.80 103.07 102.49 3kdt h GLY 403 Ca 0.07 -1.17 -0.21 0.00 0.00 0.00 0.00 47.33 46.02 3kdt h GLY 403 CO -0.00 1.03 -0.77 -2.22 0.00 0.00 0.00 176.54 174.58 3kdt h ILE 404 N -0.13 1.31 -0.88 2.60 2.04 -0.81 -2.98 117.51 118.66 3kdt h ILE 404 Ca -0.21 -2.03 0.14 0.00 1.00 0.00 0.00 64.86 63.76 3kdt h ILE 404 Cb 1.89 2.02 -0.09 0.00 -0.74 0.00 0.00 36.82 39.91 3kdt h ILE 404 CO 0.20 0.63 0.48 0.58 0.00 0.00 0.00 178.15 180.04 3kdt h VAL 405 N 0.46 0.76 -0.10 1.67 2.07 -1.03 -1.13 116.25 118.96 3kdt h VAL 405 Ca -0.05 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 3kdt h VAL 405 Cb 1.38 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3kdt h VAL 405 CO 0.15 0.13 0.02 -0.74 0.02 0.00 0.00 177.57 177.14 3kdt h HIS 406 N 0.69 0.18 -0.61 1.57 -0.00 -1.36 -0.62 115.15 115.00 3kdt h HIS 406 Ca 0.47 -0.03 -0.09 0.00 -0.00 0.00 0.00 60.37 60.72 3kdt h HIS 406 Cb 0.63 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.41 27.97 3kdt h HIS 406 CO -0.07 0.37 0.01 -0.24 -0.00 0.00 0.00 177.93 178.00 3kdt h VAL 407 N -0.07 1.26 -0.38 5.26 3.04 -1.44 -1.69 116.25 122.23 3kdt h VAL 407 Ca 0.03 -1.13 0.03 0.00 -1.01 0.00 0.00 66.70 64.62 3kdt h VAL 407 Cb 0.29 0.78 -0.03 0.00 -2.01 0.00 0.00 31.29 30.32 3kdt h VAL 407 CO 0.00 0.41 0.18 0.25 -1.01 0.00 0.00 177.57 177.41 3kdt h LEU 408 N 0.97 0.26 -0.02 3.16 5.85 -1.12 0.18 115.31 124.59 3kdt h LEU 408 Ca 0.17 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.94 3kdt h LEU 408 Cb 0.54 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 3kdt h LEU 408 CO 0.03 0.19 -0.10 -0.09 -0.34 0.00 0.00 178.44 178.13 3kdt h ARG 409 N 0.38 -0.16 -0.04 1.25 2.43 -0.75 -1.91 114.38 115.58 3kdt h ARG 409 Ca 0.16 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.22 3kdt h ARG 409 Cb 0.08 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3kdt h ARG 409 CO -0.12 -0.11 -0.54 -0.07 -1.51 0.00 0.00 179.97 177.62 3kdt h LEU 410 N -0.17 0.13 -0.31 3.80 3.38 -1.18 -2.80 115.31 118.17 3kdt h LEU 410 Ca 0.04 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 3kdt h LEU 410 Cb 0.22 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3kdt h LEU 410 CO -0.12 0.65 0.02 -0.74 0.09 0.00 0.00 178.44 178.35 3kdt h HIS 411 N 0.09 0.57 0.00 1.13 2.76 -0.46 -2.23 115.15 117.01 3kdt h HIS 411 Ca -0.00 -0.09 -0.03 0.00 -2.20 0.00 0.00 60.37 58.05 3kdt h HIS 411 Cb 0.99 -0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.79 3kdt h HIS 411 CO 0.01 0.64 -0.15 -0.07 -1.30 0.00 0.00 177.93 177.06 3kdt h LEU 412 N 0.34 0.00 -0.13 0.26 3.38 -1.28 0.69 115.31 118.56 3kdt h LEU 412 Ca 0.09 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 3kdt h LEU 412 Cb 0.39 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3kdt h LEU 412 CO 0.01 0.15 -0.70 1.56 0.09 0.00 0.00 178.44 179.55 3kdt h GLN 413 N 0.00 0.00 0.09 1.13 4.20 -1.22 0.39 115.11 119.70 3kdt h GLN 413 Ca -0.00 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.44 3kdt h GLN 413 Cb 0.35 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.15 3kdt h GLN 413 CO 0.02 0.70 -1.10 0.77 -0.67 0.00 0.00 178.83 178.54 3kdt h SER 414 N 0.00 0.81 0.58 1.46 0.02 -0.74 -3.28 113.55 112.40 3kdt h SER 414 Ca -0.01 -0.81 -0.28 0.00 -0.84 0.00 0.00 61.79 59.85 3kdt h SER 414 Cb 1.48 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.73 3kdt h SER 414 CO 0.09 1.54 -1.53 -1.13 -1.14 0.00 0.00 176.83 174.66 3kdt h ASN 415 N 0.19 0.10 -2.14 3.07 -1.24 -0.90 -3.39 115.58 111.28 3kdt h ASN 415 Ca -0.16 -0.17 -0.56 0.00 0.71 0.00 0.00 56.30 56.11 3kdt h ASN 415 Cb 1.79 -0.03 -0.41 0.00 0.73 0.00 0.00 38.32 40.40 3kdt h ASN 415 CO 0.21 1.15 -0.83 1.41 -1.29 0.00 0.00 177.43 178.08 3kdt n HIS 416 N -3.22 2.27 0.25 0.67 8.25 0.14 -4.87 115.22 118.71 3kdt n HIS 416 Ca -0.14 -3.92 0.10 0.00 -0.26 0.00 0.00 57.72 53.50 3kdt n HIS 416 Cb 1.02 -0.47 0.67 0.00 1.12 0.00 0.00 29.99 32.33 3kdt n HIS 416 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3kdt h PRO 417 N 3.54 0.00 0.00 -0.41 0.11 -1.71 -1.99 132.00 131.53 3kdt h PRO 417 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3kdt h PRO 417 Cb 0.72 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.83 3kdt h PRO 417 CO 0.69 0.12 0.00 -0.40 -0.21 0.00 0.00 178.00 178.20 3kdt n ASP 418 N -3.96 0.50 -3.44 -2.05 5.75 -1.26 -3.90 116.55 108.19 3kdt n ASP 418 Ca -0.02 0.67 -0.22 0.00 -0.01 0.00 0.00 54.79 55.21 3kdt n ASP 418 Cb 0.21 -0.76 -0.11 0.00 -1.03 0.00 0.00 41.12 39.44 3kdt n ASP 418 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3kdt s ASP 419 N -3.92 2.25 0.03 -1.12 2.15 -0.75 -5.00 116.67 110.30 3kdt s ASP 419 Ca 0.02 -1.15 0.23 0.00 0.43 0.00 0.00 52.55 52.08 3kdt s ASP 419 Cb 0.07 0.19 0.98 0.00 -0.30 0.00 0.00 42.92 43.87 3kdt s ASP 419 CO 0.27 -0.38 1.75 0.00 -0.17 0.00 0.00 175.17 176.63 3kdt n ILE 420 N 5.03 0.43 -0.44 4.11 0.13 -1.25 -2.68 119.36 124.68 3kdt n ILE 420 Ca -0.00 0.08 0.10 0.00 -1.10 0.00 0.00 62.75 61.83 3kdt n ILE 420 Cb 0.44 -0.71 0.30 0.00 -0.84 0.00 0.00 39.64 38.83 3kdt n ILE 420 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 3kdt n PHE 421 N -1.59 1.05 -0.18 9.51 3.01 -1.26 -4.54 117.46 123.47 3kdt n PHE 421 Ca 0.05 -0.55 -0.02 0.00 1.01 0.00 0.00 57.45 57.95 3kdt n PHE 421 Cb 0.28 -0.09 0.08 0.00 -0.01 0.00 0.00 39.48 39.74 3kdt n PHE 421 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 3kdt h LEU 422 N 3.76 0.22 0.01 4.37 5.85 -1.86 -2.40 115.31 125.26 3kdt h LEU 422 Ca 0.00 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.80 3kdt h LEU 422 Cb 1.11 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 3kdt h LEU 422 CO 0.08 0.15 -0.10 0.15 -0.34 0.00 0.00 178.44 178.38 3kdt h PHE 423 N 0.40 -0.25 -0.88 1.25 3.57 -1.86 -0.84 116.94 118.33 3kdt h PHE 423 Ca 0.26 0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.98 3kdt h PHE 423 Cb 0.28 0.11 -0.12 0.00 2.79 0.00 0.00 35.95 39.02 3kdt h PHE 423 CO -0.16 -0.15 0.39 -1.35 -2.23 0.00 0.00 178.31 174.81 3kdt h PRO 424 N -0.17 0.42 0.00 6.41 0.11 -1.84 -1.12 132.00 135.81 3kdt h PRO 424 Ca 0.04 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.06 3kdt h PRO 424 Cb 0.22 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 3kdt h PRO 424 CO -0.10 0.28 -0.31 0.87 -0.21 0.00 0.00 178.00 178.53 3kdt h LYS 425 N 0.43 0.00 0.00 1.05 1.57 -0.73 -2.61 116.57 116.29 3kdt h LYS 425 Ca 0.54 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 59.13 3kdt h LYS 425 Cb 0.97 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.27 3kdt h LYS 425 CO -0.50 0.31 -0.85 -0.07 -0.57 0.00 0.00 179.45 177.77 3kdt h LEU 426 N 0.00 0.16 -1.64 2.94 3.38 0.02 -2.14 115.31 118.03 3kdt h LEU 426 Ca -0.00 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 3kdt h LEU 426 Cb 0.67 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 3kdt h LEU 426 CO 0.04 0.93 -0.19 -0.07 0.09 0.00 0.00 178.44 179.25 3kdt h LEU 427 N 0.07 0.00 -0.16 1.67 3.38 -0.98 0.13 115.31 119.42 3kdt h LEU 427 Ca -0.03 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.77 3kdt h LEU 427 Cb 1.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.23 3kdt h LEU 427 CO 0.12 0.19 -0.56 1.56 0.09 0.00 0.00 178.44 179.84 3kdt h GLN 428 N 0.00 0.67 -0.58 1.13 4.20 -1.28 -2.75 115.11 116.51 3kdt h GLN 428 Ca -0.00 -0.50 -0.03 0.00 0.06 0.00 0.00 58.65 58.18 3kdt h GLN 428 Cb 0.34 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 3kdt h GLN 428 CO 0.02 1.12 0.22 0.87 -0.67 0.00 0.00 178.83 180.39 3kdt h LYS 429 N 0.35 0.84 -0.76 1.46 1.79 -1.01 0.41 116.57 119.65 3kdt h LYS 429 Ca -0.02 -0.13 0.05 0.00 -2.18 0.00 0.00 60.65 58.36 3kdt h LYS 429 Cb 1.18 -0.15 -0.05 0.00 -1.58 0.00 0.00 32.23 31.63 3kdt h LYS 429 CO 0.12 0.70 0.47 1.98 -1.08 0.00 0.00 179.45 181.63 3kdt h MET 430 N 0.83 0.85 0.49 3.15 4.05 -0.99 0.87 114.93 124.17 3kdt h MET 430 Ca 0.20 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.54 3kdt h MET 430 Cb 0.18 -0.19 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 3kdt h MET 430 CO -0.02 0.56 -0.23 0.00 0.23 0.00 0.00 176.91 177.45 3kdt h ALA 431 N 1.36 -0.65 -0.36 0.39 0.00 -0.80 -2.83 119.26 116.36 3kdt h ALA 431 Ca 0.33 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 55.16 3kdt h ALA 431 Cb 0.12 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3kdt h ALA 431 CO -0.15 -0.77 0.34 -0.44 0.00 0.00 0.00 179.25 178.22 3kdt h ASP 432 N -0.84 0.00 -0.21 0.00 3.32 0.15 -1.14 116.42 117.70 3kdt h ASP 432 Ca -0.07 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.78 3kdt h ASP 432 Cb 0.58 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.13 3kdt h ASP 432 CO 0.11 0.00 -0.64 -0.07 -1.72 0.00 0.00 179.24 176.91 3kdt h LEU 433 N 0.00 0.93 -0.65 1.55 3.38 -0.71 -1.58 115.31 118.23 3kdt h LEU 433 Ca 0.17 -0.58 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 3kdt h LEU 433 Cb 0.84 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 3kdt h LEU 433 CO -0.00 1.36 0.32 -0.09 0.09 0.00 0.00 178.44 180.11 3kdt h ARG 434 N 0.56 0.94 -0.09 1.13 2.43 -0.96 -0.09 114.38 118.30 3kdt h ARG 434 Ca -0.02 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3kdt h ARG 434 Cb 1.27 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3kdt h ARG 434 CO 0.14 0.74 0.04 0.37 -1.51 0.00 0.00 179.97 179.75 3kdt h GLN 435 N 0.90 0.14 -0.97 0.20 5.75 -1.58 -1.42 115.11 118.13 3kdt h GLN 435 Ca 0.23 -0.02 0.16 0.00 -0.15 0.00 0.00 58.65 58.87 3kdt h GLN 435 Cb 0.11 -0.02 -0.10 0.00 1.07 0.00 0.00 27.48 28.54 3kdt h GLN 435 CO -0.03 0.23 0.58 1.25 -2.65 0.00 0.00 178.83 178.21 3kdt h LEU 436 N 0.01 0.77 -0.09 -2.39 5.85 -0.96 0.20 115.31 118.71 3kdt h LEU 436 Ca 0.03 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 3kdt h LEU 436 Cb 0.14 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 3kdt h LEU 436 CO -0.00 0.32 -0.12 0.58 -0.34 0.00 0.00 178.44 178.88 3kdt h VAL 437 N 0.80 1.38 -0.05 1.05 2.07 -0.92 -0.19 116.25 120.40 3kdt h VAL 437 Ca 0.53 -1.35 0.04 0.00 0.82 0.00 0.00 66.70 66.75 3kdt h VAL 437 Cb 0.74 2.07 -0.06 0.00 -1.52 0.00 0.00 31.29 32.53 3kdt h VAL 437 CO -0.35 0.38 -0.35 0.74 0.02 0.00 0.00 177.57 178.01 3kdt h THR 438 N -0.21 0.25 -0.89 2.57 2.02 -0.69 0.61 112.91 116.57 3kdt h THR 438 Ca 0.01 0.00 0.24 0.00 0.77 0.00 0.00 66.41 67.43 3kdt h THR 438 Cb 0.67 0.25 -0.14 0.00 -1.74 0.00 0.00 68.15 67.18 3kdt h THR 438 CO 0.03 0.00 0.30 -0.08 0.37 0.00 0.00 175.52 176.13 3kdt h GLU 439 N -0.48 0.25 -0.21 6.66 4.81 -0.67 -2.16 114.58 122.77 3kdt h GLU 439 Ca 0.07 -0.01 -0.20 0.00 -0.13 0.00 0.00 59.36 59.08 3kdt h GLU 439 Cb 0.59 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3kdt h GLU 439 CO -0.31 0.16 -0.68 1.25 -0.73 0.00 0.00 179.01 178.71 3kdt h HIS 440 N 0.25 1.05 -0.98 0.92 2.76 0.64 -2.82 115.15 116.97 3kdt h HIS 440 Ca 0.57 -0.42 0.19 0.00 -2.20 0.00 0.00 60.37 58.51 3kdt h HIS 440 Cb 1.15 -0.18 -0.11 0.00 1.55 0.00 0.00 27.41 29.82 3kdt h HIS 440 CO -0.22 1.25 0.58 0.00 -1.30 0.00 0.00 177.93 178.24 3kdt h ALA 441 N 0.65 1.61 0.09 5.26 0.00 0.80 -1.59 119.26 126.08 3kdt h ALA 441 Ca -0.02 0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 3kdt h ALA 441 Cb 1.29 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.04 3kdt h ALA 441 CO 0.14 -0.09 -0.75 1.96 0.00 0.00 0.00 179.25 180.52 3kdt h GLN 442 N 0.71 0.20 -0.61 0.00 4.20 -1.39 -0.65 115.11 117.57 3kdt h GLN 442 Ca 0.57 -0.34 0.18 0.00 0.06 0.00 0.00 58.65 59.11 3kdt h GLN 442 Cb 0.90 0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.78 3kdt h GLN 442 CO -0.40 1.16 0.45 -0.07 -0.67 0.00 0.00 178.83 179.31 3kdt h LEU 443 N -0.55 0.00 0.03 1.46 3.38 -1.43 0.30 115.31 118.50 3kdt h LEU 443 Ca -0.15 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.69 3kdt h LEU 443 Cb 1.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.25 3kdt h LEU 443 CO 0.08 0.00 -0.52 0.58 0.09 0.00 0.00 178.44 178.67 3kdt h VAL 444 N 0.00 1.50 0.37 1.22 2.07 -1.23 -2.80 116.25 117.38 3kdt h VAL 444 Ca 0.29 -2.16 -0.00 0.00 0.82 0.00 0.00 66.70 65.64 3kdt h VAL 444 Cb 1.19 2.83 -0.03 0.00 -1.52 0.00 0.00 31.29 33.76 3kdt h VAL 444 CO -0.00 0.61 -0.48 1.56 0.02 0.00 0.00 177.57 179.28 3kdt h GLN 445 N -0.33 -0.85 -0.37 1.57 1.08 0.52 -1.86 115.11 114.87 3kdt h GLN 445 Ca -0.07 0.06 0.07 0.00 -1.45 0.00 0.00 58.65 57.26 3kdt h GLN 445 Cb 1.29 0.19 -0.09 0.00 -0.05 0.00 0.00 27.48 28.82 3kdt h GLN 445 CO 0.10 -0.57 -0.34 0.82 -0.95 0.00 0.00 178.83 177.89 3kdt h ILE 446 N -0.88 0.22 -0.31 2.54 2.04 -0.62 0.55 117.51 121.04 3kdt h ILE 446 Ca -0.04 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.85 3kdt h ILE 446 Cb 0.80 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 3kdt h ILE 446 CO -0.13 0.00 0.21 0.40 0.00 0.00 0.00 178.15 178.63 3kdt h ILE 447 N -0.28 1.03 -0.20 -0.67 2.04 -1.36 0.12 117.51 118.19 3kdt h ILE 447 Ca 0.16 -0.12 -0.16 0.00 1.00 0.00 0.00 64.86 65.75 3kdt h ILE 447 Cb 0.55 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 3kdt h ILE 447 CO -0.52 0.06 -0.48 0.50 0.00 0.00 0.00 178.15 177.71 3kdt h LYS 448 N 0.34 0.68 -0.00 2.37 3.11 -0.22 -2.47 116.57 120.38 3kdt h LYS 448 Ca 0.12 -0.46 0.00 0.00 -2.81 0.00 0.00 60.65 57.50 3kdt h LYS 448 Cb 0.08 0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.38 3kdt h LYS 448 CO -0.03 1.08 -0.14 1.63 -2.81 0.00 0.00 179.45 179.19 3kdt n LYS 449 N -4.16 0.61 0.00 1.90 5.02 0.01 -4.50 118.16 117.03 3kdt n LYS 449 Ca -0.06 -0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 3kdt n LYS 449 Cb 0.58 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 3kdt n LYS 449 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3kdt n THR 450 N -1.00 0.00 -1.67 -0.18 -2.24 0.33 -5.05 114.28 104.47 3kdt n THR 450 Ca 0.13 0.00 -0.62 0.00 -2.27 0.00 0.00 64.05 61.29 3kdt n THR 450 Cb 0.29 -0.49 -0.09 0.00 -2.10 0.00 0.00 70.33 67.94 3kdt n THR 450 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3kdt n GLU 451 N -0.63 0.55 0.21 -0.78 -0.58 -0.93 -4.83 120.64 113.65 3kdt n GLU 451 Ca 0.00 0.20 0.07 0.00 -0.42 0.00 0.00 57.16 57.01 3kdt n GLU 451 Cb 0.00 -1.81 0.48 0.00 -0.57 0.00 0.00 31.44 29.54 3kdt n GLU 451 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 3kdt h SER 452 N 6.70 0.00 -0.49 1.62 0.02 -1.91 -1.87 113.55 117.62 3kdt h SER 452 Ca -0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 3kdt h SER 452 Cb 1.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.89 3kdt h SER 452 CO 0.98 0.28 0.00 -0.67 -1.14 0.00 0.00 176.83 176.28 3kdt n ASP 453 N -3.72 4.41 -4.59 3.07 2.03 -1.26 -4.96 116.55 111.53 3kdt n ASP 453 Ca -0.01 -2.60 -0.42 0.00 0.52 0.00 0.00 54.79 52.27 3kdt n ASP 453 Cb 0.38 -0.53 -0.04 0.00 -0.72 0.00 0.00 41.12 40.21 3kdt n ASP 453 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3kdt s ALA 454 N -2.11 3.40 -0.34 -1.67 0.00 -0.71 -4.98 121.76 115.35 3kdt s ALA 454 Ca 0.45 -0.56 -0.04 0.00 0.00 0.00 0.00 51.96 51.81 3kdt s ALA 454 Cb 0.31 -3.48 0.06 0.00 0.00 0.00 0.00 23.12 20.01 3kdt s ALA 454 CO 0.18 -1.61 0.10 0.00 0.00 0.00 0.00 175.76 174.43 3kdt s ALA 455 N 3.36 3.01 -0.47 0.00 0.00 -1.26 -4.84 121.76 121.55 3kdt s ALA 455 Ca 0.35 -1.92 -0.20 0.00 0.00 0.00 0.00 51.96 50.19 3kdt s ALA 455 Cb -0.12 -2.21 0.04 0.00 0.00 0.00 0.00 23.12 20.82 3kdt s ALA 455 CO 0.19 -1.42 0.66 -1.17 0.00 0.00 0.00 175.76 174.02 3kdt s LEU 456 N 1.31 4.65 0.05 0.00 2.96 -1.26 -4.88 118.68 121.51 3kdt s LEU 456 Ca -0.01 -0.57 -0.34 0.00 -0.22 0.00 0.00 54.13 52.99 3kdt s LEU 456 Cb -0.20 -2.62 -0.18 0.00 0.50 0.00 0.00 46.19 43.69 3kdt s LEU 456 CO 0.00 -0.86 0.85 1.57 -1.32 0.00 0.00 176.35 176.59 3kdt n HIS 457 N 6.32 0.31 0.24 5.38 -0.00 -1.26 -4.69 115.22 121.52 3kdt n HIS 457 Ca -0.03 0.95 0.07 0.00 -0.00 0.00 0.00 57.72 58.70 3kdt n HIS 457 Cb 0.47 -1.89 0.57 0.00 -0.00 0.00 0.00 29.99 29.14 3kdt n HIS 457 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3kdt h PRO 458 N 2.26 0.00 0.20 1.57 0.13 -1.98 -0.31 132.00 133.86 3kdt h PRO 458 Ca -0.41 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.71 3kdt h PRO 458 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3kdt h PRO 458 CO 0.58 0.11 -0.09 1.25 -0.23 0.00 0.00 178.00 179.61 3kdt h LEU 459 N 0.00 -0.22 -1.36 1.56 5.85 -2.00 -2.42 115.31 116.71 3kdt h LEU 459 Ca -0.00 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.51 3kdt h LEU 459 Cb 0.20 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 3kdt h LEU 459 CO 0.01 0.14 0.45 -0.07 -0.34 0.00 0.00 178.44 178.64 3kdt h LEU 460 N -0.62 0.73 -0.35 2.25 3.38 -1.86 -1.87 115.31 116.96 3kdt h LEU 460 Ca -0.03 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.00 3kdt h LEU 460 Cb 0.45 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 3kdt h LEU 460 CO 0.04 0.51 -0.04 1.56 0.09 0.00 0.00 178.44 180.61 3kdt h GLN 461 N 0.85 0.05 -0.58 1.13 4.20 -1.02 -1.77 115.11 117.98 3kdt h GLN 461 Ca 0.27 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.95 3kdt h GLN 461 Cb 0.03 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 3kdt h GLN 461 CO -0.07 0.04 0.26 1.49 -0.67 0.00 0.00 178.83 179.88 3kdt h GLU 462 N 0.06 0.84 -0.80 1.46 4.57 -0.85 0.33 114.58 120.18 3kdt h GLU 462 Ca 0.17 -0.13 0.09 0.00 -1.18 0.00 0.00 59.36 58.31 3kdt h GLU 462 Cb 0.25 -0.15 -0.07 0.00 -0.16 0.00 0.00 28.75 28.62 3kdt h GLU 462 CO -0.32 0.69 0.45 0.82 -1.18 0.00 0.00 179.01 179.47 3kdt h ILE 463 N 0.78 0.91 0.00 2.32 2.04 -1.06 -1.39 117.51 121.11 3kdt h ILE 463 Ca 0.20 -0.26 -0.11 0.00 1.00 0.00 0.00 64.86 65.68 3kdt h ILE 463 Cb 0.14 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.28 3kdt h ILE 463 CO -0.02 0.14 -0.53 1.88 0.00 0.00 0.00 178.15 179.62 3kdt h TYR 464 N 0.77 0.00 -1.63 1.37 -1.99 -0.60 -3.44 116.97 111.45 3kdt h TYR 464 Ca 0.39 0.00 -0.71 0.00 2.00 0.00 0.00 58.73 60.40 3kdt h TYR 464 Cb 0.35 0.00 0.02 0.00 2.00 0.00 0.00 36.73 39.10 3kdt h TYR 464 CO -0.07 0.53 0.84 -2.13 -0.00 0.00 0.00 178.16 177.33 3kdt n ARG 465 N -3.60 1.27 -3.41 4.88 0.63 0.04 -0.64 116.66 115.82 3kdt n ARG 465 Ca -0.00 0.46 -0.17 0.00 -0.92 0.00 0.00 57.85 57.21 3kdt n ARG 465 Cb 0.60 -2.16 0.07 0.00 0.45 0.00 0.00 32.46 31.43 3kdt n ARG 465 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 3kdt n ASP 466 N 4.96 -3.62 -4.51 6.15 2.03 -1.26 -4.86 116.55 115.44 3kdt n ASP 466 Ca 0.25 -0.69 -0.31 0.00 0.52 0.00 0.00 54.79 54.56 3kdt n ASP 466 Cb 0.16 -4.96 -0.05 0.00 -0.72 0.00 0.00 41.12 35.54 3kdt n ASP 466 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 3kdt n MET 467 N -3.85 1.76 0.00 -0.67 2.81 0.18 -5.16 117.12 112.20 3kdt n MET 467 Ca -0.21 -2.51 0.00 0.00 -1.81 0.00 0.00 57.70 53.17 3kdt n MET 467 Cb 0.65 -3.65 0.00 0.00 -0.71 0.00 0.00 33.22 29.51 3kdt n MET 467 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46