#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3it6 s MET 201 N 0.00 3.56 -0.03 -2.82 1.75 -1.26 -5.03 119.30 115.47 3it6 s MET 201 Ca 0.00 -0.53 0.05 0.00 -1.25 0.00 0.00 55.69 53.96 3it6 s MET 201 Cb 0.00 -3.26 -0.03 0.00 2.84 0.00 0.00 34.83 34.39 3it6 s MET 201 CO 0.00 -0.20 -0.18 -0.51 -0.65 0.00 0.00 175.02 173.48 3it6 s LEU 202 N 1.58 2.55 -0.12 4.11 1.43 -1.26 -2.82 118.68 124.16 3it6 s LEU 202 Ca 0.06 -0.30 -0.06 0.00 -1.03 0.00 0.00 54.13 52.80 3it6 s LEU 202 Cb -0.15 -1.50 0.05 0.00 0.03 0.00 0.00 46.19 44.62 3it6 s LEU 202 CO 0.02 0.32 0.27 0.00 0.23 0.00 0.00 176.35 177.19 3it6 s VAL 204 N 1.49 2.46 -0.12 0.00 1.01 -1.26 -0.94 120.40 123.04 3it6 s VAL 204 Ca -0.07 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 3it6 s VAL 204 Cb -0.10 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 3it6 s VAL 204 CO -0.09 0.51 -0.04 -0.76 0.00 0.00 0.00 175.10 174.72 3it6 s LEU 205 N 1.23 3.29 0.13 3.92 1.43 0.20 -4.97 118.68 123.91 3it6 s LEU 205 Ca 0.03 -0.06 0.09 0.00 -1.03 0.00 0.00 54.13 53.16 3it6 s LEU 205 Cb -0.14 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 3it6 s LEU 205 CO -0.08 0.25 -0.22 0.42 0.23 0.00 0.00 176.35 176.94 3it6 s THR 206 N -0.10 1.92 -0.19 5.49 -4.23 -1.26 -0.54 115.64 116.73 3it6 s THR 206 Ca 0.02 -1.71 -0.17 0.00 -1.18 0.00 0.00 61.69 58.65 3it6 s THR 206 Cb -0.13 -1.76 0.05 0.00 1.34 0.00 0.00 72.50 72.00 3it6 s THR 206 CO 0.02 -0.08 0.51 0.28 -0.54 0.00 0.00 174.62 174.82 3it6 s THR 207 N -1.34 -0.00 -2.61 3.99 -1.32 -0.09 -4.91 115.64 109.36 3it6 s THR 207 Ca 0.11 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.86 3it6 s THR 207 Cb -0.09 -0.71 0.44 0.00 -1.51 0.00 0.00 72.50 70.63 3it6 s THR 207 CO 0.06 0.00 1.59 -0.90 -2.21 0.00 0.00 174.62 173.16 3it6 n ASP 208 N 2.91 1.98 -4.76 8.08 5.68 -1.26 -1.18 116.55 127.99 3it6 n ASP 208 Ca -0.14 -1.67 -0.41 0.00 -0.50 0.00 0.00 54.79 52.07 3it6 n ASP 208 Cb 0.56 -0.02 -0.02 0.00 -1.14 0.00 0.00 41.12 40.51 3it6 n ASP 208 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3it6 s ALA 209 N -1.97 3.60 -0.13 2.12 0.00 -1.26 -1.09 121.76 123.03 3it6 s ALA 209 Ca 0.35 1.41 -0.29 0.00 0.00 0.00 0.00 51.96 53.43 3it6 s ALA 209 Cb 0.20 -3.56 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 3it6 s ALA 209 CO 0.32 -0.84 1.22 0.00 0.00 0.00 0.00 175.76 176.47 3it6 s ALA 210 N -0.59 3.60 -0.28 0.00 0.00 -0.55 -3.71 121.76 120.23 3it6 s ALA 210 Ca 0.55 0.50 -0.18 0.00 0.00 0.00 0.00 51.96 52.83 3it6 s ALA 210 Cb -0.43 -3.58 0.11 0.00 0.00 0.00 0.00 23.12 19.22 3it6 s ALA 210 CO 0.52 -1.01 0.84 0.00 0.00 0.00 0.00 175.76 176.10 3it6 s ALA 211 N 3.00 -2.02 0.85 0.00 0.00 -1.26 -4.19 121.76 118.14 3it6 s ALA 211 Ca 0.54 2.25 -0.11 0.00 0.00 0.00 0.00 51.96 54.64 3it6 s ALA 211 Cb -0.22 -1.51 0.10 0.00 0.00 0.00 0.00 23.12 21.49 3it6 s ALA 211 CO 0.17 -0.35 1.09 -1.21 0.00 0.00 0.00 175.76 175.46 3it6 s GLU 212 N 1.24 1.60 0.25 0.00 2.02 -1.26 -4.79 118.70 117.77 3it6 s GLU 212 Ca -0.07 0.90 -0.04 0.00 0.02 0.00 0.00 54.97 55.78 3it6 s GLU 212 Cb -0.04 -1.84 0.48 0.00 0.10 0.00 0.00 34.13 32.83 3it6 s GLU 212 CO -0.14 -2.02 1.69 -1.35 0.02 0.00 0.00 175.26 173.45 3it6 h PRO 213 N -1.39 0.27 -0.31 0.39 0.11 -2.00 -1.43 132.00 127.65 3it6 h PRO 213 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3it6 h PRO 213 Cb 1.27 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3it6 h PRO 213 CO 0.54 0.18 0.14 0.00 -0.21 0.00 0.00 178.00 178.65 3it6 h ALA 214 N 1.62 1.68 -0.30 -0.75 0.00 -1.99 0.18 119.26 119.70 3it6 h ALA 214 Ca 0.43 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.16 3it6 h ALA 214 Cb 0.74 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3it6 h ALA 214 CO -0.51 0.26 -0.22 0.00 0.00 0.00 0.00 179.25 178.78 3it6 h ALA 215 N 1.74 0.43 -0.58 0.00 0.00 -1.64 -2.53 119.26 116.68 3it6 h ALA 215 Ca 0.11 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 3it6 h ALA 215 Cb 0.05 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3it6 h ALA 215 CO -0.01 0.39 0.13 -0.07 0.00 0.00 0.00 179.25 179.69 3it6 h LEU 216 N 0.43 0.86 -0.25 0.00 3.38 -0.70 -2.80 115.31 116.23 3it6 h LEU 216 Ca 0.06 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3it6 h LEU 216 Cb 0.77 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3it6 h LEU 216 CO 0.06 0.85 0.05 -0.08 0.09 0.00 0.00 178.44 179.40 3it6 h GLU 217 N 0.88 0.41 0.51 1.13 4.81 -0.56 0.70 114.58 122.46 3it6 h GLU 217 Ca 0.19 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 3it6 h GLU 217 Cb 0.34 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3it6 h GLU 217 CO 0.00 0.53 -0.40 -0.09 -0.73 0.00 0.00 179.01 178.33 3it6 h ARG 218 N 0.23 -0.86 -0.49 1.92 2.43 -1.47 -0.04 114.38 116.10 3it6 h ARG 218 Ca 0.08 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.40 3it6 h ARG 218 Cb 0.31 0.19 -0.10 0.00 -0.42 0.00 0.00 29.97 29.96 3it6 h ARG 218 CO 0.00 -0.57 -0.29 0.00 -1.51 0.00 0.00 179.97 177.60 3it6 h ALA 219 N -0.56 -0.02 -0.25 2.80 0.00 -1.40 -0.89 119.26 118.93 3it6 h ALA 219 Ca -0.05 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3it6 h ALA 219 Cb 0.76 0.67 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 3it6 h ALA 219 CO 0.00 -0.65 0.14 1.25 0.00 0.00 0.00 179.25 179.99 3it6 h LEU 220 N -0.18 0.31 -0.53 0.00 5.85 -0.76 -0.57 115.31 119.43 3it6 h LEU 220 Ca 0.21 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 3it6 h LEU 220 Cb 0.52 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3it6 h LEU 220 CO -0.59 0.30 0.16 0.03 -0.34 0.00 0.00 178.44 178.00 3it6 h ARG 221 N 0.29 0.83 -0.40 1.25 3.08 -0.71 0.33 114.38 119.05 3it6 h ARG 221 Ca 0.09 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 3it6 h ARG 221 Cb 0.06 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3it6 h ARG 221 CO -0.01 0.77 0.21 0.00 -1.07 0.00 0.00 179.97 179.86 3it6 h ARG 222 N 0.74 0.56 -0.51 0.04 3.08 -1.15 -2.40 114.38 114.74 3it6 h ARG 222 Ca 0.17 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.09 3it6 h ARG 222 Cb 0.29 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 3it6 h ARG 222 CO -0.00 0.47 0.07 0.00 -1.07 0.00 0.00 179.97 179.44 3it6 h ALA 223 N 1.06 0.68 -0.67 0.04 0.00 -0.69 -2.97 119.26 116.71 3it6 h ALA 223 Ca 0.14 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3it6 h ALA 223 Cb 0.08 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3it6 h ALA 223 CO -0.02 0.42 0.24 0.00 0.00 0.00 0.00 179.25 179.89 3it6 h ALA 224 N 0.97 0.88 -0.48 0.00 0.00 -0.33 -2.33 119.26 117.97 3it6 h ALA 224 Ca 0.15 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3it6 h ALA 224 Cb 0.41 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3it6 h ALA 224 CO 0.01 0.52 0.13 0.00 0.00 0.00 0.00 179.25 179.91 3it6 h ALA 225 N 1.11 1.32 0.00 0.00 0.00 -1.39 0.22 119.26 120.51 3it6 h ALA 225 Ca 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3it6 h ALA 225 Cb 0.25 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3it6 h ALA 225 CO -0.01 0.49 -0.82 0.00 0.00 0.00 0.00 179.25 178.90 3it6 n ALA 226 N -2.46 2.94 -0.61 0.00 0.00 -1.13 -4.46 120.51 114.79 3it6 n ALA 226 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3it6 n ALA 226 Cb 0.20 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.55 3it6 n ALA 226 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3it6 n THR 227 N -2.21 0.00 -0.21 0.00 -2.24 -0.89 -4.73 114.28 104.01 3it6 n THR 227 Ca 0.02 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.73 3it6 n THR 227 Cb 0.47 -0.61 0.03 0.00 -2.10 0.00 0.00 70.33 68.11 3it6 n THR 227 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3it6 h PHE 228 N 0.00 0.86 0.00 4.78 0.04 -1.67 -0.88 116.94 120.07 3it6 h PHE 228 Ca 0.00 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3it6 h PHE 228 Cb 0.00 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 37.89 3it6 h PHE 228 CO 0.00 0.66 0.00 -0.25 -0.60 0.00 0.00 178.31 178.12 3it6 n ASP 229 N -4.52 0.00 -0.07 2.17 8.00 0.04 -1.57 116.55 120.59 3it6 n ASP 229 Ca 0.04 0.44 0.06 0.00 0.71 0.00 0.00 54.79 56.03 3it6 n ASP 229 Cb 0.13 -0.44 0.08 0.00 -0.02 0.00 0.00 41.12 40.86 3it6 n ASP 229 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3it6 n ARG 230 N -1.44 1.76 -3.65 -1.24 1.74 -0.38 -4.94 116.66 108.51 3it6 n ARG 230 Ca 0.00 -2.04 -0.38 0.00 -0.77 0.00 0.00 57.85 54.66 3it6 n ARG 230 Cb 0.01 -1.24 -0.12 0.00 -1.02 0.00 0.00 32.46 30.09 3it6 n ARG 230 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3it6 s LEU 231 N -1.97 3.88 -0.34 0.55 2.96 -0.61 -1.57 118.68 121.58 3it6 s LEU 231 Ca 0.18 -0.18 -0.00 0.00 -0.22 0.00 0.00 54.13 53.90 3it6 s LEU 231 Cb 0.16 -2.04 0.14 0.00 0.50 0.00 0.00 46.19 44.95 3it6 s LEU 231 CO 0.02 -0.08 0.22 -0.62 -1.32 0.00 0.00 176.35 174.57 3it6 s ASP 232 N 1.69 2.81 -0.10 3.68 -1.08 -0.55 -4.99 116.67 118.13 3it6 s ASP 232 Ca 0.06 -1.98 -0.10 0.00 -0.52 0.00 0.00 52.55 50.01 3it6 s ASP 232 Cb -0.16 -0.26 -0.09 0.00 -1.46 0.00 0.00 42.92 40.95 3it6 s ASP 232 CO 0.08 -0.32 0.33 0.40 0.52 0.00 0.00 175.17 176.18 3it6 h ILE 233 N 5.21 0.51 0.00 4.11 1.08 -1.95 -3.38 117.51 123.10 3it6 h ILE 233 Ca 0.02 -1.29 0.00 0.00 -0.39 0.00 0.00 64.86 63.20 3it6 h ILE 233 Cb 0.99 0.95 0.00 0.00 -3.07 0.00 0.00 36.82 35.69 3it6 h ILE 233 CO 0.28 0.17 -0.15 -0.90 -0.69 0.00 0.00 178.15 176.85 3it6 n ASP 234 N -4.79 1.15 0.00 1.72 5.68 -1.26 -4.35 116.55 114.70 3it6 n ASP 234 Ca -0.04 -2.17 0.00 0.00 -0.50 0.00 0.00 54.79 52.08 3it6 n ASP 234 Cb 0.16 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 3it6 n ASP 234 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3it6 n GLY 235 N -0.56 0.46 3.30 6.12 0.00 -1.26 -4.95 105.19 108.29 3it6 n GLY 235 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3it6 n GLY 235 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3it6 s SER 236 N -2.37 5.63 0.00 1.61 0.01 -1.26 -5.07 113.70 112.25 3it6 s SER 236 Ca 0.00 -1.31 -0.25 0.00 1.31 0.00 0.00 55.95 55.70 3it6 s SER 236 Cb 0.00 -1.98 -0.05 0.00 0.21 0.00 0.00 66.02 64.20 3it6 s SER 236 CO 0.00 -0.47 0.75 0.00 0.41 0.00 0.00 173.24 173.93 3it6 s SER 238 N 0.30 4.34 0.00 0.00 0.15 -1.26 -5.00 113.70 112.22 3it6 s SER 238 Ca 0.39 0.56 0.26 0.00 0.70 0.00 0.00 55.95 57.86 3it6 s SER 238 Cb -0.20 -1.01 0.55 0.00 -1.71 0.00 0.00 66.02 63.65 3it6 s SER 238 CO 0.22 -1.97 1.46 0.35 1.20 0.00 0.00 173.24 174.49 3it6 n THR 239 N -3.27 0.00 -0.25 6.45 -2.24 -1.26 -4.47 114.28 109.23 3it6 n THR 239 Ca 0.10 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 3it6 n THR 239 Cb 0.61 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.85 3it6 n THR 239 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3it6 n ASN 240 N 0.65 0.78 -4.70 3.42 3.02 -1.26 -5.07 115.26 112.10 3it6 n ASN 240 Ca 0.15 -1.03 -0.42 0.00 -0.03 0.00 0.00 54.58 53.25 3it6 n ASN 240 Cb 0.48 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.62 3it6 n ASN 240 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3it6 s ASP 241 N -0.03 6.47 -0.11 6.41 1.11 -1.26 -4.86 116.67 124.40 3it6 s ASP 241 Ca 0.00 2.71 -0.07 0.00 0.18 0.00 0.00 52.55 55.36 3it6 s ASP 241 Cb 0.00 -2.57 0.04 0.00 1.07 0.00 0.00 42.92 41.46 3it6 s ASP 241 CO 0.00 -0.97 0.26 -0.89 1.18 0.00 0.00 175.17 174.76 3it6 s THR 242 N 2.47 -0.02 -0.09 -1.27 2.01 -1.13 -5.04 115.64 112.57 3it6 s THR 242 Ca 0.78 0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.89 3it6 s THR 242 Cb -0.45 -0.39 0.01 0.00 0.01 0.00 0.00 72.50 71.68 3it6 s THR 242 CO 0.35 0.03 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.46 3it6 s VAL 243 N 0.81 1.47 -0.03 3.82 1.01 -1.26 -1.58 120.40 124.64 3it6 s VAL 243 Ca -0.05 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.35 3it6 s VAL 243 Cb -0.07 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 3it6 s VAL 243 CO -0.05 0.43 -0.25 -0.76 0.00 0.00 0.00 175.10 174.47 3it6 s LEU 244 N 0.76 2.05 -0.19 3.92 1.43 -0.11 -5.01 118.68 121.52 3it6 s LEU 244 Ca -0.12 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.53 3it6 s LEU 244 Cb -0.16 -1.28 0.04 0.00 0.03 0.00 0.00 46.19 44.82 3it6 s LEU 244 CO 0.02 0.29 -0.09 -0.22 0.23 0.00 0.00 176.35 176.58 3it6 s LEU 245 N -0.48 2.14 0.03 1.79 2.96 -1.26 0.61 118.68 124.47 3it6 s LEU 245 Ca 0.07 -0.85 0.04 0.00 -0.22 0.00 0.00 54.13 53.17 3it6 s LEU 245 Cb -0.10 -1.16 -0.03 0.00 0.50 0.00 0.00 46.19 45.39 3it6 s LEU 245 CO 0.00 -0.16 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.04 3it6 s LEU 246 N 1.45 3.12 -0.11 -0.68 1.02 0.30 -5.01 118.68 118.78 3it6 s LEU 246 Ca -0.01 -0.20 0.00 0.00 0.02 0.00 0.00 54.13 53.94 3it6 s LEU 246 Cb -0.16 -1.82 0.02 0.00 0.02 0.00 0.00 46.19 44.25 3it6 s LEU 246 CO -0.08 0.26 -0.10 -0.55 0.02 0.00 0.00 176.35 175.89 3it6 s SER 247 N -1.59 2.24 0.14 2.29 0.15 -1.26 -0.91 113.70 114.76 3it6 s SER 247 Ca 0.18 -0.35 0.24 0.00 0.70 0.00 0.00 55.95 56.71 3it6 s SER 247 Cb -0.11 -0.93 0.22 0.00 -1.71 0.00 0.00 66.02 63.49 3it6 s SER 247 CO 0.09 -0.07 1.22 0.77 1.20 0.00 0.00 173.24 176.45 3it6 h SER 248 N 7.87 0.00 -0.10 5.45 4.64 -1.39 -3.48 113.55 126.53 3it6 h SER 248 Ca -0.32 -0.17 -0.04 0.00 -0.47 0.00 0.00 61.79 60.79 3it6 h SER 248 Cb 1.15 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.22 3it6 h SER 248 CO 0.45 0.09 -0.04 0.61 -0.87 0.00 0.00 176.83 177.07 3it6 n GLY 249 N 1.29 0.18 0.19 -0.77 0.00 -1.24 -4.85 105.19 100.00 3it6 n GLY 249 Ca 0.02 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.18 3it6 n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3it6 h ALA 250 N 0.01 1.00 0.00 4.61 0.00 -1.74 0.16 119.26 123.30 3it6 h ALA 250 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3it6 h ALA 250 Cb 0.97 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3it6 h ALA 250 CO 0.06 0.00 -0.50 0.66 0.00 0.00 0.00 179.25 179.47 3it6 h SER 251 N 0.00 0.00 -0.57 0.00 4.64 -1.44 -3.48 113.55 112.71 3it6 h SER 251 Ca 0.00 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.08 3it6 h SER 251 Cb 0.19 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.18 3it6 h SER 251 CO 0.00 0.44 -0.22 -0.62 -0.87 0.00 0.00 176.83 175.56 3it6 n GLU 252 N -3.19 -1.27 -3.69 4.77 1.02 0.54 -4.98 120.64 113.84 3it6 n GLU 252 Ca 0.02 0.89 -0.38 0.00 -0.02 0.00 0.00 57.16 57.67 3it6 n GLU 252 Cb 0.72 -5.08 -0.12 0.00 -0.02 0.00 0.00 31.44 26.93 3it6 n GLU 252 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3it6 s ILE 253 N -2.22 4.44 -0.54 -3.67 1.01 -1.26 -4.88 121.20 114.07 3it6 s ILE 253 Ca 0.00 -0.40 -0.23 0.00 0.00 0.00 0.00 60.65 60.02 3it6 s ILE 253 Cb 0.00 -3.22 0.05 0.00 0.01 0.00 0.00 42.46 39.29 3it6 s ILE 253 CO 0.00 0.13 0.86 -2.16 0.00 0.00 0.00 174.94 173.78 3it6 s PRO 254 N 1.60 3.27 0.73 2.79 0.04 -1.26 -1.48 135.00 140.68 3it6 s PRO 254 Ca 0.05 -0.45 -0.11 0.00 0.04 0.00 0.00 61.00 60.53 3it6 s PRO 254 Cb -0.17 -4.07 0.03 0.00 0.04 0.00 0.00 34.50 30.33 3it6 s PRO 254 CO 0.05 -1.44 1.08 -1.25 0.04 0.00 0.00 177.00 175.48 3it6 s PRO 255 N 3.62 2.66 0.44 0.56 0.05 -1.26 -4.99 135.00 136.09 3it6 s PRO 255 Ca 0.26 0.76 -0.25 0.00 0.05 0.00 0.00 61.00 61.82 3it6 s PRO 255 Cb -0.14 -1.97 -0.08 0.00 0.05 0.00 0.00 34.50 32.35 3it6 s PRO 255 CO 0.17 -1.24 1.31 0.00 0.05 0.00 0.00 177.00 177.29 3it6 s ALA 256 N -3.14 3.13 0.38 8.56 0.00 -1.26 -4.82 121.76 124.61 3it6 s ALA 256 Ca 0.59 1.23 0.05 0.00 0.00 0.00 0.00 51.96 53.83 3it6 s ALA 256 Cb -0.14 -3.50 0.75 0.00 0.00 0.00 0.00 23.12 20.24 3it6 s ALA 256 CO 0.54 -0.94 2.02 0.37 0.00 0.00 0.00 175.76 177.75 3it6 h GLN 257 N 2.32 0.65 -0.24 0.00 5.75 -1.99 -0.97 115.11 120.63 3it6 h GLN 257 Ca -0.50 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 57.91 3it6 h GLN 257 Cb 1.26 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.65 3it6 h GLN 257 CO 0.61 0.45 -0.06 0.00 -2.65 0.00 0.00 178.83 177.18 3it6 h ALA 258 N 1.67 1.46 0.03 3.38 0.00 -1.99 0.11 119.26 123.92 3it6 h ALA 258 Ca 0.18 -0.20 -0.22 0.00 0.00 0.00 0.00 54.91 54.67 3it6 h ALA 258 Cb -0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3it6 h ALA 258 CO -0.03 0.38 -1.02 -0.44 0.00 0.00 0.00 179.25 178.14 3it6 h ASP 259 N 0.35 0.16 0.10 0.00 3.32 -1.57 -1.48 116.42 117.30 3it6 h ASP 259 Ca 0.07 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 3it6 h ASP 259 Cb 0.34 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3it6 h ASP 259 CO 0.02 1.08 -0.05 0.25 -1.72 0.00 0.00 179.24 178.81 3it6 h LEU 260 N 0.04 -0.11 -0.48 1.55 5.85 -0.96 -1.78 115.31 119.42 3it6 h LEU 260 Ca -0.05 -0.25 0.10 0.00 0.84 0.00 0.00 57.88 58.51 3it6 h LEU 260 Cb 1.73 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 42.69 3it6 h LEU 260 CO 0.15 0.20 -0.23 0.44 -0.34 0.00 0.00 178.44 178.65 3it6 h ASP 261 N -0.43 -0.80 -0.13 1.25 3.32 -0.82 -2.07 116.42 116.74 3it6 h ASP 261 Ca -0.01 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3it6 h ASP 261 Cb 0.36 0.43 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 3it6 h ASP 261 CO 0.02 -0.26 0.09 -0.08 -1.72 0.00 0.00 179.24 177.29 3it6 h GLU 262 N -0.13 0.17 -0.61 3.56 4.57 -1.27 -0.65 114.58 120.22 3it6 h GLU 262 Ca 0.22 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.42 3it6 h GLU 262 Cb 0.48 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.99 3it6 h GLU 262 CO -0.56 0.12 0.36 0.00 -1.18 0.00 0.00 179.01 177.75 3it6 h ALA 263 N 1.04 0.79 -0.40 2.92 0.00 -1.10 -0.75 119.26 121.76 3it6 h ALA 263 Ca 0.05 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 3it6 h ALA 263 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3it6 h ALA 263 CO -0.01 0.08 -0.21 0.28 0.00 0.00 0.00 179.25 179.39 3it6 h VAL 264 N 0.70 1.27 -0.41 0.00 2.07 -1.14 -2.05 116.25 116.69 3it6 h VAL 264 Ca 0.25 -1.33 -0.05 0.00 0.82 0.00 0.00 66.70 66.40 3it6 h VAL 264 Cb 0.06 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3it6 h VAL 264 CO -0.12 0.45 0.07 0.25 0.02 0.00 0.00 177.57 178.24 3it6 h LEU 265 N 0.70 0.64 -0.77 2.57 5.85 -0.73 -0.97 115.31 122.60 3it6 h LEU 265 Ca 0.10 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.46 3it6 h LEU 265 Cb 0.73 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 3it6 h LEU 265 CO 0.06 0.73 -0.13 0.03 -0.34 0.00 0.00 178.44 178.79 3it6 h ARG 266 N 0.52 0.79 0.13 1.25 3.08 -1.03 0.80 114.38 119.93 3it6 h ARG 266 Ca 0.12 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 3it6 h ARG 266 Cb 0.36 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.35 3it6 h ARG 266 CO 0.01 0.88 -0.06 0.28 -1.07 0.00 0.00 179.97 180.01 3it6 h VAL 267 N 0.71 0.99 -0.94 2.04 2.07 -1.24 -2.05 116.25 117.84 3it6 h VAL 267 Ca 0.12 -0.50 0.02 0.00 0.82 0.00 0.00 66.70 67.16 3it6 h VAL 267 Cb 0.62 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 3it6 h VAL 267 CO 0.04 0.12 0.61 0.00 0.02 0.00 0.00 177.57 178.37 3it6 h ASP 269 N 1.22 0.54 -0.63 0.00 3.58 -0.85 0.44 116.42 120.72 3it6 h ASP 269 Ca 0.36 -0.24 -0.07 0.00 0.42 0.00 0.00 57.03 57.50 3it6 h ASP 269 Cb -0.06 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 40.82 3it6 h ASP 269 CO -0.10 0.63 0.12 -0.78 -2.88 0.00 0.00 179.24 176.23 3it6 h ASP 270 N 0.42 1.00 -0.70 2.28 1.82 -1.17 -2.07 116.42 117.99 3it6 h ASP 270 Ca 0.11 -0.22 0.01 0.00 -0.39 0.00 0.00 57.03 56.54 3it6 h ASP 270 Cb 0.31 -0.27 -0.04 0.00 0.68 0.00 0.00 39.33 40.02 3it6 h ASP 270 CO 0.00 0.99 0.46 -0.07 -1.61 0.00 0.00 179.24 179.01 3it6 h LEU 271 N 0.99 0.80 -0.40 2.28 3.38 -0.96 -1.78 115.31 119.62 3it6 h LEU 271 Ca 0.20 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.21 3it6 h LEU 271 Cb 0.40 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 3it6 h LEU 271 CO 0.01 0.57 0.12 0.00 0.09 0.00 0.00 178.44 179.23 3it6 h ALA 273 N 1.28 0.64 -0.34 0.00 0.00 -0.80 0.28 119.26 120.31 3it6 h ALA 273 Ca 0.19 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 3it6 h ALA 273 Cb 0.20 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3it6 h ALA 273 CO -0.22 -0.30 0.17 1.96 0.00 0.00 0.00 179.25 180.86 3it6 h GLN 274 N 0.25 0.49 -0.23 0.00 4.20 -0.84 -0.36 115.11 118.63 3it6 h GLN 274 Ca 0.28 -0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.96 3it6 h GLN 274 Cb 0.40 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 3it6 h GLN 274 CO -0.37 0.45 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.17 3it6 h LEU 275 N 0.42 -0.10 -1.14 1.46 3.38 -0.27 -2.02 115.31 117.04 3it6 h LEU 275 Ca 0.12 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.18 3it6 h LEU 275 Cb 0.11 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 3it6 h LEU 275 CO -0.02 -0.02 0.59 -0.61 0.09 0.00 0.00 178.44 178.47 3it6 h GLN 276 N 0.06 1.08 0.00 1.13 4.15 -0.75 -2.68 115.11 118.10 3it6 h GLN 276 Ca 0.11 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.45 3it6 h GLN 276 Cb 0.14 -0.24 -0.00 0.00 0.21 0.00 0.00 27.48 27.58 3it6 h GLN 276 CO -0.19 0.72 -0.05 0.00 -1.93 0.00 0.00 178.83 177.38 3it6 h ALA 277 N 1.48 1.01 -0.09 3.38 0.00 -0.35 -3.03 119.26 121.67 3it6 h ALA 277 Ca 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3it6 h ALA 277 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3it6 h ALA 277 CO -0.11 0.06 0.00 -3.47 0.00 0.00 0.00 179.25 175.74 3it6 n ASP 278 N -3.17 2.65 -4.75 0.00 2.03 -0.97 -4.97 116.55 107.37 3it6 n ASP 278 Ca 0.00 -2.72 -0.38 0.00 0.52 0.00 0.00 54.79 52.22 3it6 n ASP 278 Cb 0.33 -0.34 0.05 0.00 -0.72 0.00 0.00 41.12 40.44 3it6 n ASP 278 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3it6 s ALA 279 N -2.25 2.76 -0.31 -1.67 0.00 -1.04 -4.83 121.76 114.43 3it6 s ALA 279 Ca 0.26 1.33 -0.40 0.00 0.00 0.00 0.00 51.96 53.15 3it6 s ALA 279 Cb 0.21 -3.57 -0.15 0.00 0.00 0.00 0.00 23.12 19.61 3it6 s ALA 279 CO 0.05 -1.42 1.83 0.39 0.00 0.00 0.00 175.76 176.60 3it6 n GLU 280 N -1.15 1.06 -2.30 0.00 1.02 -1.26 -1.83 120.64 116.19 3it6 n GLU 280 Ca 0.11 0.38 -0.19 0.00 -0.02 0.00 0.00 57.16 57.44 3it6 n GLU 280 Cb 0.45 -2.11 -0.02 0.00 -0.02 0.00 0.00 31.44 29.75 3it6 n GLU 280 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3it6 n GLY 281 N 4.70 -0.23 3.71 0.62 0.00 -1.26 -4.49 105.19 108.23 3it6 n GLY 281 Ca 0.30 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3it6 n GLY 281 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3it6 s VAL 282 N -2.94 4.25 -0.02 1.61 0.11 -0.76 -4.20 120.40 118.45 3it6 s VAL 282 Ca 0.00 1.61 0.03 0.00 -2.93 0.00 0.00 61.98 60.69 3it6 s VAL 282 Cb 0.00 -4.03 -0.05 0.00 -1.53 0.00 0.00 36.38 30.77 3it6 s VAL 282 CO 0.00 0.10 0.04 0.35 -3.33 0.00 0.00 175.10 172.26 3it6 n THR 283 N 4.04 0.11 -4.93 5.04 -2.24 -1.26 -4.99 114.28 110.05 3it6 n THR 283 Ca 0.09 -0.11 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 3it6 n THR 283 Cb 0.47 -0.28 -0.17 0.00 -2.10 0.00 0.00 70.33 68.26 3it6 n THR 283 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3it6 s LYS 284 N -2.15 2.69 -0.54 -0.78 -0.14 -1.26 -4.65 119.74 112.90 3it6 s LYS 284 Ca -0.01 -0.75 -0.22 0.00 -1.36 0.00 0.00 55.97 53.62 3it6 s LYS 284 Cb 0.02 -2.10 0.05 0.00 -1.68 0.00 0.00 37.83 34.11 3it6 s LYS 284 CO 0.14 0.09 0.83 1.03 -0.76 0.00 0.00 175.35 176.68 3it6 s ARG 285 N 0.55 3.24 -0.20 1.68 0.52 0.38 -3.34 118.95 121.79 3it6 s ARG 285 Ca -0.15 -0.52 -0.06 0.00 -0.52 0.00 0.00 55.73 54.48 3it6 s ARG 285 Cb -0.17 -4.08 -0.03 0.00 0.52 0.00 0.00 34.95 31.19 3it6 s ARG 285 CO 0.05 -1.41 0.02 0.08 0.02 0.00 0.00 175.30 174.06 3it6 s VAL 286 N 3.48 4.20 -0.17 3.52 1.01 -0.27 -1.87 120.40 130.29 3it6 s VAL 286 Ca 0.24 -0.23 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 3it6 s VAL 286 Cb -0.15 -2.90 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 3it6 s VAL 286 CO 0.16 0.43 -0.05 -0.89 0.00 0.00 0.00 175.10 174.75 3it6 s THR 287 N 0.84 3.67 -0.28 3.92 2.01 -0.42 -0.17 115.64 125.22 3it6 s THR 287 Ca 0.01 -0.43 -0.03 0.00 0.31 0.00 0.00 61.69 61.55 3it6 s THR 287 Cb -0.14 -2.62 0.03 0.00 0.01 0.00 0.00 72.50 69.78 3it6 s THR 287 CO 0.02 0.48 0.00 -0.69 -0.69 0.00 0.00 174.62 173.74 3it6 s VAL 288 N 0.65 3.25 -0.22 3.82 1.01 -0.20 -0.91 120.40 127.80 3it6 s VAL 288 Ca -0.03 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 60.89 3it6 s VAL 288 Cb -0.15 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 3it6 s VAL 288 CO 0.02 0.08 -0.03 -0.89 0.00 0.00 0.00 175.10 174.28 3it6 s THR 289 N 1.36 3.54 -0.20 3.92 2.01 0.11 -1.17 115.64 125.21 3it6 s THR 289 Ca -0.00 -0.44 -0.07 0.00 0.31 0.00 0.00 61.69 61.48 3it6 s THR 289 Cb -0.18 -2.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.69 3it6 s THR 289 CO -0.01 0.42 0.06 -0.69 -0.69 0.00 0.00 174.62 173.71 3it6 s VAL 290 N 1.38 4.63 0.38 3.82 1.01 -0.49 0.75 120.40 131.87 3it6 s VAL 290 Ca 0.05 -0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.02 3it6 s VAL 290 Cb -0.14 -3.11 -0.07 0.00 0.00 0.00 0.00 36.38 33.05 3it6 s VAL 290 CO -0.01 0.42 -0.03 0.42 0.00 0.00 0.00 175.10 175.89 3it6 s THR 291 N 0.78 2.07 -0.89 3.92 -4.23 0.46 -1.11 115.64 116.64 3it6 s THR 291 Ca 0.03 -2.08 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 3it6 s THR 291 Cb -0.13 -2.85 0.00 0.00 1.34 0.00 0.00 72.50 70.85 3it6 s THR 291 CO 0.02 -0.08 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 3it6 n GLY 292 N -0.89 0.21 3.92 3.99 0.00 -0.72 -0.46 105.19 111.25 3it6 n GLY 292 Ca -0.05 -0.49 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 3it6 n GLY 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3it6 s ALA 293 N -2.47 3.34 0.09 4.61 0.00 -0.29 -0.57 121.76 126.46 3it6 s ALA 293 Ca 0.00 -0.79 -0.18 0.00 0.00 0.00 0.00 51.96 50.99 3it6 s ALA 293 Cb 0.00 -2.54 -0.08 0.00 0.00 0.00 0.00 23.12 20.50 3it6 s ALA 293 CO 0.00 -0.85 1.53 0.00 0.00 0.00 0.00 175.76 176.44 3it6 h ALA 294 N -0.19 0.35 -2.32 0.00 0.00 -1.85 -0.49 119.26 114.75 3it6 h ALA 294 Ca -0.45 -0.22 -0.35 0.00 0.00 0.00 0.00 54.91 53.89 3it6 h ALA 294 Cb 1.27 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.82 3it6 h ALA 294 CO 0.60 0.07 -0.61 0.95 0.00 0.00 0.00 179.25 180.26 3it6 s THR 295 N -5.02 0.58 0.32 0.00 -4.23 -1.26 -4.54 115.64 101.49 3it6 s THR 295 Ca -0.14 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.40 3it6 s THR 295 Cb 0.08 -2.64 0.16 0.00 1.34 0.00 0.00 72.50 71.43 3it6 s THR 295 CO 0.75 0.00 1.87 -0.08 -0.54 0.00 0.00 174.62 176.61 3it6 h GLU 296 N 2.37 0.63 -0.58 3.99 4.81 -1.88 -2.90 114.58 121.02 3it6 h GLU 296 Ca -0.38 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 58.63 3it6 h GLU 296 Cb 1.25 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 3it6 h GLU 296 CO 0.61 0.61 0.02 0.22 -0.73 0.00 0.00 179.01 179.75 3it6 h ASP 297 N 0.61 0.99 -0.99 1.04 3.58 -1.97 -2.14 116.42 117.54 3it6 h ASP 297 Ca 0.13 -0.30 0.07 0.00 0.42 0.00 0.00 57.03 57.36 3it6 h ASP 297 Cb 0.30 -0.26 -0.07 0.00 1.72 0.00 0.00 39.33 41.01 3it6 h ASP 297 CO 0.00 1.04 0.64 0.44 -2.88 0.00 0.00 179.24 178.49 3it6 h ASP 298 N 0.90 1.02 -0.42 2.28 5.19 -1.94 0.51 116.42 123.97 3it6 h ASP 298 Ca 0.17 0.01 -0.08 0.00 -0.62 0.00 0.00 57.03 56.51 3it6 h ASP 298 Cb 0.52 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 3it6 h ASP 298 CO 0.03 0.64 -0.05 0.00 -3.12 0.00 0.00 179.24 176.73 3it6 h ALA 299 N 1.47 0.57 -0.30 3.45 0.00 -1.27 0.10 119.26 123.29 3it6 h ALA 299 Ca 0.43 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3it6 h ALA 299 Cb 0.19 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3it6 h ALA 299 CO -0.18 0.41 0.11 1.25 0.00 0.00 0.00 179.25 180.85 3it6 h LEU 300 N 0.61 0.43 -0.76 0.00 5.85 -1.03 0.07 115.31 120.47 3it6 h LEU 300 Ca 0.11 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 3it6 h LEU 300 Cb 0.57 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 3it6 h LEU 300 CO 0.03 0.49 0.44 0.58 -0.34 0.00 0.00 178.44 179.64 3it6 h VAL 301 N 0.33 1.22 -0.28 1.05 2.07 -0.79 0.18 116.25 120.04 3it6 h VAL 301 Ca 0.10 -0.53 -0.05 0.00 0.82 0.00 0.00 66.70 67.04 3it6 h VAL 301 Cb 0.21 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 3it6 h VAL 301 CO -0.01 0.24 -0.03 0.00 0.02 0.00 0.00 177.57 177.80 3it6 h ALA 302 N 1.23 0.38 -0.39 1.67 0.00 -0.58 -1.85 119.26 119.72 3it6 h ALA 302 Ca 0.27 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3it6 h ALA 302 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3it6 h ALA 302 CO -0.05 0.15 -0.08 0.00 0.00 0.00 0.00 179.25 179.27 3it6 h ALA 303 N 0.81 1.12 -0.31 0.00 0.00 -0.83 -1.78 119.26 118.27 3it6 h ALA 303 Ca 0.08 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3it6 h ALA 303 Cb 0.47 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3it6 h ALA 303 CO 0.02 0.55 0.02 -0.09 0.00 0.00 0.00 179.25 179.75 3it6 h ARG 304 N 0.62 0.53 -0.55 0.00 2.43 -0.88 -0.94 114.38 115.58 3it6 h ARG 304 Ca 0.11 -0.16 0.10 0.00 -0.81 0.00 0.00 59.98 59.23 3it6 h ARG 304 Cb 0.51 -0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.93 3it6 h ARG 304 CO 0.03 0.65 0.11 0.37 -1.51 0.00 0.00 179.97 179.61 3it6 h GLN 305 N 0.33 0.23 0.02 0.20 5.75 -1.01 -0.22 115.11 120.42 3it6 h GLN 305 Ca 0.09 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.57 3it6 h GLN 305 Cb 0.40 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.89 3it6 h GLN 305 CO 0.01 0.15 -0.01 0.82 -2.65 0.00 0.00 178.83 177.16 3it6 h ILE 306 N 0.24 1.07 -0.04 2.39 2.04 -1.22 -3.04 117.51 118.94 3it6 h ILE 306 Ca 0.28 -0.26 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 3it6 h ILE 306 Cb 0.41 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 3it6 h ILE 306 CO -0.37 0.07 -0.23 0.00 0.00 0.00 0.00 178.15 177.61 3it6 h ALA 307 N 0.84 1.54 0.00 1.87 0.00 -0.61 -2.77 119.26 120.13 3it6 h ALA 307 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3it6 h ALA 307 Cb 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3it6 h ALA 307 CO 0.00 0.34 -0.41 0.54 0.00 0.00 0.00 179.25 179.72 3it6 n ARG 308 N -4.23 0.18 -2.31 0.00 1.74 -0.14 -4.85 116.66 107.04 3it6 n ARG 308 Ca -0.02 0.07 -0.42 0.00 -0.77 0.00 0.00 57.85 56.71 3it6 n ARG 308 Cb 0.31 -1.63 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 3it6 n ARG 308 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3it6 s ASP 309 N -3.80 6.94 0.35 0.55 2.15 -1.05 -4.93 116.67 116.88 3it6 s ASP 309 Ca 0.09 2.06 0.04 0.00 0.43 0.00 0.00 52.55 55.17 3it6 s ASP 309 Cb 0.15 -2.57 0.66 0.00 -0.30 0.00 0.00 42.92 40.86 3it6 s ASP 309 CO 0.67 -0.63 1.96 0.28 -0.17 0.00 0.00 175.17 177.28 3it6 h SER 310 N 7.38 0.58 0.60 -0.34 0.02 -1.91 -1.45 113.55 118.43 3it6 h SER 310 Ca -0.39 -0.06 -0.22 0.00 -0.84 0.00 0.00 61.79 60.28 3it6 h SER 310 Cb 1.19 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 3it6 h SER 310 CO 0.87 0.51 -1.00 -0.07 -1.14 0.00 0.00 176.83 176.01 3it6 h LEU 311 N 0.65 0.32 -0.36 5.07 3.38 -1.96 -1.84 115.31 120.56 3it6 h LEU 311 Ca 0.16 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 3it6 h LEU 311 Cb 0.10 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3it6 h LEU 311 CO -0.02 1.14 0.08 0.58 0.09 0.00 0.00 178.44 180.31 3it6 h VAL 312 N 0.11 1.23 -0.50 1.22 2.07 -1.78 -1.48 116.25 117.11 3it6 h VAL 312 Ca -0.07 -0.78 -0.05 0.00 0.82 0.00 0.00 66.70 66.62 3it6 h VAL 312 Cb 1.67 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 3it6 h VAL 312 CO 0.16 0.27 0.12 0.11 0.02 0.00 0.00 177.57 178.24 3it6 h LYS 313 N 0.44 0.80 -0.35 1.57 1.57 -1.29 -1.31 116.57 118.00 3it6 h LYS 313 Ca 0.11 -0.20 -0.15 0.00 -1.87 0.00 0.00 60.65 58.55 3it6 h LYS 313 Cb 0.32 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3it6 h LYS 313 CO 0.00 0.78 -0.36 1.79 -0.57 0.00 0.00 179.45 181.08 3it6 h THR 314 N 0.69 1.28 -0.51 -0.16 1.35 -1.35 -0.41 112.91 113.80 3it6 h THR 314 Ca 0.16 -1.53 0.04 0.00 -0.55 0.00 0.00 66.41 64.52 3it6 h THR 314 Cb 0.34 1.40 -0.04 0.00 -1.73 0.00 0.00 68.15 68.11 3it6 h THR 314 CO 0.00 0.51 0.27 0.00 -0.25 0.00 0.00 175.52 176.05 3it6 h ALA 315 N 0.90 0.65 -0.75 6.62 0.00 -1.12 -1.36 119.26 124.21 3it6 h ALA 315 Ca 0.06 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3it6 h ALA 315 Cb 0.93 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 3it6 h ALA 315 CO 0.09 -0.06 0.24 -0.07 0.00 0.00 0.00 179.25 179.44 3it6 h LEU 316 N 0.53 1.08 -1.08 0.00 3.38 -1.02 0.17 115.31 118.38 3it6 h LEU 316 Ca 0.22 -0.21 0.11 0.00 0.09 0.00 0.00 57.88 58.09 3it6 h LEU 316 Cb 0.10 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 40.49 3it6 h LEU 316 CO -0.14 1.00 0.62 0.15 0.09 0.00 0.00 178.44 180.16 3it6 h PHE 317 N 1.11 1.07 -0.06 1.13 3.57 -0.71 -0.74 116.94 122.32 3it6 h PHE 317 Ca 0.24 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.77 3it6 h PHE 317 Cb 0.30 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.70 3it6 h PHE 317 CO 0.03 0.45 0.00 0.41 -2.23 0.00 0.00 178.31 176.97 3it6 n GLY 318 N -1.37 -0.51 3.02 2.40 0.00 -0.55 -4.91 105.19 103.28 3it6 n GLY 318 Ca 0.18 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 3it6 n GLY 318 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3it6 n SER 319 N -0.36 -6.01 -4.42 1.61 7.64 -0.28 -4.99 113.62 106.82 3it6 n SER 319 Ca 0.15 -0.30 -0.40 0.00 1.01 0.00 0.00 58.87 59.33 3it6 n SER 319 Cb 0.17 -4.80 -0.11 0.00 -1.01 0.00 0.00 64.21 58.45 3it6 n SER 319 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3it6 s ASP 320 N -2.79 5.66 -1.18 6.43 2.15 0.53 -4.36 116.67 123.12 3it6 s ASP 320 Ca 0.32 -0.73 -0.13 0.00 0.43 0.00 0.00 52.55 52.44 3it6 s ASP 320 Cb -0.14 -2.02 -0.06 0.00 -0.30 0.00 0.00 42.92 40.39 3it6 s ASP 320 CO 0.40 -0.28 2.29 -0.81 -0.17 0.00 0.00 175.17 176.59 3it6 n PRO 321 N 5.00 2.50 -2.84 4.34 -0.04 -1.26 -4.32 135.00 138.37 3it6 n PRO 321 Ca -0.13 -2.01 -0.43 0.00 -0.04 0.00 0.00 63.50 60.89 3it6 n PRO 321 Cb 0.48 -2.86 -0.02 0.00 -0.04 0.00 0.00 33.50 31.06 3it6 n PRO 321 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3it6 s ASN 322 N 3.48 6.67 0.41 3.54 3.84 -1.26 -4.84 114.94 126.78 3it6 s ASN 322 Ca 0.53 -2.07 0.20 0.00 0.21 0.00 0.00 52.86 51.72 3it6 s ASN 322 Cb 0.14 -2.44 0.89 0.00 -0.55 0.00 0.00 41.25 39.28 3it6 s ASN 322 CO -0.02 -1.12 1.84 4.11 -2.79 0.00 0.00 177.10 179.13 3it6 h TRP 323 N 8.75 0.00 -0.55 0.43 5.08 -1.96 -2.73 115.95 124.97 3it6 h TRP 323 Ca 0.20 0.00 0.08 0.00 1.08 0.00 0.00 58.89 60.25 3it6 h TRP 323 Cb 0.99 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 27.09 3it6 h TRP 323 CO 1.19 0.31 0.20 0.78 -1.28 0.00 0.00 178.44 179.64 3it6 h GLY 324 N 1.54 0.75 1.29 11.11 0.00 -1.99 -0.73 103.07 115.03 3it6 h GLY 324 Ca -0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 3it6 h GLY 324 CO 0.04 0.00 0.37 3.21 0.00 0.00 0.00 176.54 180.16 3it6 h ARG 325 N 0.39 0.94 -0.47 4.80 3.08 -1.89 0.10 114.38 121.33 3it6 h ARG 325 Ca 0.27 -0.10 -0.09 0.00 0.07 0.00 0.00 59.98 60.13 3it6 h ARG 325 Cb 0.30 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3it6 h ARG 325 CO -0.27 0.69 -0.06 0.28 -1.07 0.00 0.00 179.97 179.54 3it6 h VAL 326 N 0.95 1.27 -0.36 2.04 2.07 -1.41 -1.98 116.25 118.82 3it6 h VAL 326 Ca 0.24 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.54 3it6 h VAL 326 Cb 0.03 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3it6 h VAL 326 CO -0.04 0.40 -0.00 -0.07 0.02 0.00 0.00 177.57 177.88 3it6 h LEU 327 N 0.71 0.63 -0.18 2.57 4.07 -0.55 -0.94 115.31 121.62 3it6 h LEU 327 Ca 0.12 -0.31 0.05 0.00 0.08 0.00 0.00 57.88 57.83 3it6 h LEU 327 Cb 0.59 -0.17 -0.06 0.00 1.08 0.00 0.00 40.66 42.10 3it6 h LEU 327 CO 0.04 0.79 -0.20 0.00 -1.08 0.00 0.00 178.44 177.98 3it6 h ALA 328 N 0.87 -0.11 0.50 1.53 0.00 -0.78 -1.91 119.26 119.35 3it6 h ALA 328 Ca 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3it6 h ALA 328 Cb 0.46 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3it6 h ALA 328 CO 0.02 -0.64 -0.24 0.00 0.00 0.00 0.00 179.25 178.39 3it6 h ALA 329 N 0.82 -0.67 -0.41 0.00 0.00 -1.24 -2.95 119.26 114.81 3it6 h ALA 329 Ca 0.12 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.92 3it6 h ALA 329 Cb 0.40 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3it6 h ALA 329 CO -0.32 -0.85 0.28 -0.24 0.00 0.00 0.00 179.25 178.12 3it6 h VAL 330 N -0.72 0.96 -0.00 0.00 3.04 -1.14 -1.30 116.25 117.09 3it6 h VAL 330 Ca -0.07 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.51 3it6 h VAL 330 Cb 0.54 0.62 -0.00 0.00 -2.01 0.00 0.00 31.29 30.43 3it6 h VAL 330 CO 0.11 0.06 0.01 1.23 -1.01 0.00 0.00 177.57 177.97 3it6 h GLY 331 N 0.31 0.00 0.42 3.17 0.00 -1.16 -1.48 103.07 104.34 3it6 h GLY 331 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 3it6 h GLY 331 CO -0.04 0.00 -0.46 1.03 0.00 0.00 0.00 176.54 177.07 3it6 n MET 332 N -3.12 0.43 -2.24 4.80 2.81 -0.49 -4.92 117.12 114.39 3it6 n MET 332 Ca -0.03 -0.28 -0.41 0.00 -1.81 0.00 0.00 57.70 55.17 3it6 n MET 332 Cb 0.08 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.06 3it6 n MET 332 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3it6 s ALA 333 N -2.76 3.50 -1.30 3.04 0.00 -0.56 -4.91 121.76 118.77 3it6 s ALA 333 Ca 0.17 1.10 -0.16 0.00 0.00 0.00 0.00 51.96 53.07 3it6 s ALA 333 Cb 0.18 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.84 3it6 s ALA 333 CO 0.64 -0.50 2.15 -0.35 0.00 0.00 0.00 175.76 177.70 3it6 n PRO 334 N 2.13 2.54 -4.00 0.00 -0.04 -1.26 -4.88 135.00 129.49 3it6 n PRO 334 Ca 0.04 -2.43 -0.09 0.00 -0.04 0.00 0.00 63.50 60.97 3it6 n PRO 334 Cb 0.43 -3.21 -0.08 0.00 -0.04 0.00 0.00 33.50 30.60 3it6 n PRO 334 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3it6 s ILE 335 N 3.66 0.11 0.11 0.52 -4.36 -1.26 -5.05 121.20 114.93 3it6 s ILE 335 Ca 0.50 -1.51 -0.31 0.00 -0.26 0.00 0.00 60.65 59.07 3it6 s ILE 335 Cb 0.14 -1.75 -0.10 0.00 1.25 0.00 0.00 42.46 42.00 3it6 s ILE 335 CO -0.04 -0.49 1.87 -0.89 0.24 0.00 0.00 174.94 175.63 3it6 s THR 336 N -3.96 2.58 -0.12 8.37 2.01 -1.26 -4.99 115.64 118.27 3it6 s THR 336 Ca 0.15 0.01 -0.08 0.00 0.31 0.00 0.00 61.69 62.08 3it6 s THR 336 Cb 0.05 -3.00 0.04 0.00 0.01 0.00 0.00 72.50 69.60 3it6 s THR 336 CO -0.03 -0.00 0.30 -0.22 -0.69 0.00 0.00 174.62 173.98 3it6 s LEU 337 N 3.05 0.43 -0.30 4.42 2.96 -1.26 -4.73 118.68 123.25 3it6 s LEU 337 Ca 0.83 0.62 -0.03 0.00 -0.22 0.00 0.00 54.13 55.34 3it6 s LEU 337 Cb -0.46 0.95 0.04 0.00 0.50 0.00 0.00 46.19 47.22 3it6 s LEU 337 CO 0.38 -0.15 0.01 -0.62 -1.32 0.00 0.00 176.35 174.65 3it6 s ASP 338 N 0.98 4.91 0.66 3.68 2.15 -1.26 -5.00 116.67 122.79 3it6 s ASP 338 Ca -0.07 -1.19 0.43 0.00 0.43 0.00 0.00 52.55 52.15 3it6 s ASP 338 Cb -0.08 -1.74 2.35 0.00 -0.30 0.00 0.00 42.92 43.15 3it6 s ASP 338 CO -0.07 -0.25 2.35 1.55 -0.17 0.00 0.00 175.17 178.58 3it6 h PRO 339 N 8.04 0.00 0.00 4.34 0.13 -1.99 -1.22 132.00 141.31 3it6 h PRO 339 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 3it6 h PRO 339 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3it6 h PRO 339 CO 0.55 0.00 -0.23 -0.25 -0.23 0.00 0.00 178.00 177.84 3it6 n ASP 340 N -3.16 0.28 -0.16 1.44 8.00 -1.26 -3.85 116.55 117.83 3it6 n ASP 340 Ca -0.03 0.18 0.05 0.00 0.71 0.00 0.00 54.79 55.71 3it6 n ASP 340 Cb 0.08 -0.18 -0.02 0.00 -0.02 0.00 0.00 41.12 40.97 3it6 n ASP 340 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3it6 n ARG 341 N -1.57 2.59 -2.36 -1.24 1.74 -0.46 -3.60 116.66 111.75 3it6 n ARG 341 Ca 0.06 -0.39 -0.41 0.00 -0.77 0.00 0.00 57.85 56.34 3it6 n ARG 341 Cb 0.35 -1.07 -0.03 0.00 -1.02 0.00 0.00 32.46 30.68 3it6 n ARG 341 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3it6 s ILE 342 N -1.67 3.56 0.21 0.55 1.01 -1.21 -4.35 121.20 119.31 3it6 s ILE 342 Ca 0.07 1.30 0.11 0.00 0.00 0.00 0.00 60.65 62.13 3it6 s ILE 342 Cb 0.09 -3.83 -0.05 0.00 0.01 0.00 0.00 42.46 38.68 3it6 s ILE 342 CO 0.34 0.20 -0.23 -0.94 0.00 0.00 0.00 174.94 174.31 3it6 s SER 343 N 0.21 3.44 -0.02 3.58 1.04 -0.57 -0.18 113.70 121.21 3it6 s SER 343 Ca 0.54 -0.91 0.01 0.00 0.48 0.00 0.00 55.95 56.06 3it6 s SER 343 Cb -0.33 -0.26 0.01 0.00 0.10 0.00 0.00 66.02 65.54 3it6 s SER 343 CO 0.36 0.09 -0.01 -0.69 0.98 0.00 0.00 173.24 173.97 3it6 s VAL 344 N -1.90 0.18 -0.02 5.02 1.01 0.75 -1.61 120.40 123.83 3it6 s VAL 344 Ca 0.23 -0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.24 3it6 s VAL 344 Cb -0.07 -0.22 -0.00 0.00 0.00 0.00 0.00 36.38 36.09 3it6 s VAL 344 CO 0.11 0.10 -0.12 -0.44 0.00 0.00 0.00 175.10 174.75 3it6 s SER 345 N 0.50 1.48 -0.19 3.32 0.01 0.76 -1.37 113.70 118.21 3it6 s SER 345 Ca -0.05 -0.23 -0.06 0.00 1.31 0.00 0.00 55.95 56.92 3it6 s SER 345 Cb -0.08 -0.33 -0.03 0.00 0.21 0.00 0.00 66.02 65.80 3it6 s SER 345 CO -0.01 0.11 0.01 -0.36 0.41 0.00 0.00 173.24 173.41 3it6 s PHE 346 N 0.01 3.09 -1.70 2.43 0.08 -0.77 -0.33 117.98 120.78 3it6 s PHE 346 Ca -0.01 -0.30 -0.18 0.00 0.12 0.00 0.00 56.93 56.56 3it6 s PHE 346 Cb -0.08 -2.08 0.16 0.00 -0.57 0.00 0.00 43.02 40.45 3it6 s PHE 346 CO 0.00 -0.13 0.75 0.09 -0.10 0.00 0.00 175.22 175.84 3it6 n ASN 347 N 4.03 -3.06 0.00 1.36 4.13 0.20 -0.72 115.26 121.21 3it6 n ASN 347 Ca -0.17 -1.03 0.00 0.00 1.68 0.00 0.00 54.58 55.06 3it6 n ASN 347 Cb 0.52 -2.69 0.00 0.00 -1.54 0.00 0.00 39.78 36.07 3it6 n ASN 347 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3it6 n GLY 348 N -1.41 0.80 3.35 7.41 0.00 -1.26 -5.02 105.19 109.05 3it6 n GLY 348 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 3it6 n GLY 348 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3it6 s ALA 349 N -3.09 3.12 -0.45 4.61 0.00 0.10 -5.05 121.76 120.99 3it6 s ALA 349 Ca 0.00 -1.53 -0.28 0.00 0.00 0.00 0.00 51.96 50.15 3it6 s ALA 349 Cb 0.00 -2.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.84 3it6 s ALA 349 CO 0.00 -1.06 1.81 0.00 0.00 0.00 0.00 175.76 176.51 3it6 s ALA 350 N 1.50 2.57 -0.68 0.00 0.00 -1.26 -1.85 121.76 122.04 3it6 s ALA 350 Ca 0.02 -0.14 0.22 0.00 0.00 0.00 0.00 51.96 52.05 3it6 s ALA 350 Cb -0.18 -4.13 -0.19 0.00 0.00 0.00 0.00 23.12 18.62 3it6 s ALA 350 CO 0.04 -3.17 0.83 1.33 0.00 0.00 0.00 175.76 174.78 3it6 n VAL 351 N 7.32 0.03 -3.68 0.00 0.24 -0.47 -4.72 118.33 117.05 3it6 n VAL 351 Ca 0.22 -0.17 -0.14 0.00 -2.04 0.00 0.00 64.34 62.21 3it6 n VAL 351 Cb 0.49 0.59 -0.13 0.00 -1.47 0.00 0.00 33.84 33.31 3it6 n VAL 351 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3it6 s VAL 353 N 2.14 0.78 -1.49 0.00 0.11 -0.39 -0.18 120.40 121.37 3it6 s VAL 353 Ca -0.01 -0.62 -0.05 0.00 -2.93 0.00 0.00 61.98 58.37 3it6 s VAL 353 Cb -0.12 -0.69 0.02 0.00 -1.53 0.00 0.00 36.38 34.06 3it6 s VAL 353 CO -0.08 0.07 0.49 1.41 -3.33 0.00 0.00 175.10 173.66 3it6 n HIS 354 N 2.44 -1.81 -0.94 1.54 8.25 -1.07 -2.26 115.22 121.36 3it6 n HIS 354 Ca -0.16 0.43 0.00 0.00 -0.26 0.00 0.00 57.72 57.73 3it6 n HIS 354 Cb 0.56 -4.02 0.00 0.00 1.12 0.00 0.00 29.99 27.65 3it6 n HIS 354 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3it6 n GLY 355 N -1.36 0.77 3.50 -1.41 0.00 0.75 -4.47 105.19 102.97 3it6 n GLY 355 Ca -0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 3it6 n GLY 355 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3it6 s VAL 356 N -3.23 1.55 0.37 1.61 -7.23 -0.96 -4.97 120.40 107.54 3it6 s VAL 356 Ca 0.00 -2.03 -0.27 0.00 -1.81 0.00 0.00 61.98 57.87 3it6 s VAL 356 Cb 0.00 -2.79 -0.09 0.00 0.56 0.00 0.00 36.38 34.06 3it6 s VAL 356 CO 0.00 -0.06 1.29 -0.83 -0.31 0.00 0.00 175.10 175.19 3it6 s GLY 357 N -3.55 2.96 -0.05 2.32 0.00 -1.26 -1.26 107.32 106.47 3it6 s GLY 357 Ca 0.35 1.22 -0.06 0.00 0.00 0.00 0.00 44.72 46.23 3it6 s GLY 357 CO 0.16 1.83 0.19 0.00 0.00 0.00 0.00 173.10 175.28 3it6 s ALA 358 N -1.22 3.89 -0.22 3.20 0.00 -0.24 -4.69 121.76 122.48 3it6 s ALA 358 Ca 0.53 -0.64 -0.38 0.00 0.00 0.00 0.00 51.96 51.47 3it6 s ALA 358 Cb -0.38 -1.99 -0.14 0.00 0.00 0.00 0.00 23.12 20.61 3it6 s ALA 358 CO 0.50 0.66 1.81 -2.30 0.00 0.00 0.00 175.76 176.42 3it6 n PRO 359 N 1.48 1.49 0.00 0.00 -0.02 -1.26 -2.24 135.00 134.45 3it6 n PRO 359 Ca -0.15 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3it6 n PRO 359 Cb 0.54 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 3it6 n PRO 359 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3it6 n GLY 360 N 4.34 0.71 0.00 -1.23 0.00 -1.26 -5.03 105.19 102.72 3it6 n GLY 360 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 3it6 n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3it6 n ALA 361 N -1.11 -0.14 -0.48 4.61 0.00 -0.95 -3.04 120.51 119.39 3it6 n ALA 361 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 3it6 n ALA 361 Cb 0.00 0.18 -0.05 0.00 0.00 0.00 0.00 19.45 19.58 3it6 n ALA 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3it6 n ARG 362 N -1.67 0.97 0.00 0.00 1.74 -1.26 -2.38 116.66 114.05 3it6 n ARG 362 Ca 0.00 -0.27 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 3it6 n ARG 362 Cb 0.00 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.01 3it6 n ARG 362 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3it6 n GLU 363 N 2.05 1.94 -1.76 5.56 4.71 -1.17 -5.09 120.64 126.88 3it6 n GLU 363 Ca 0.12 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.85 3it6 n GLU 363 Cb 0.46 -0.17 -0.01 0.00 -1.01 0.00 0.00 31.44 30.71 3it6 n GLU 363 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3it6 n VAL 364 N -0.24 1.37 -3.27 2.62 0.31 -1.00 -4.98 118.33 113.13 3it6 n VAL 364 Ca 0.00 -0.34 -0.43 0.00 -0.01 0.00 0.00 64.34 63.56 3it6 n VAL 364 Cb 0.00 -1.99 -0.08 0.00 -0.91 0.00 0.00 33.84 30.86 3it6 n VAL 364 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3it6 s ASP 365 N 0.29 6.24 -0.28 4.52 2.15 -1.26 -4.77 116.67 123.56 3it6 s ASP 365 Ca 0.60 -0.48 0.11 0.00 0.43 0.00 0.00 52.55 53.21 3it6 s ASP 365 Cb -0.48 -2.25 0.56 0.00 -0.30 0.00 0.00 42.92 40.45 3it6 s ASP 365 CO 0.54 -0.59 1.54 0.18 -0.17 0.00 0.00 175.17 176.67 3it6 n LEU 366 N 5.75 4.58 0.14 -1.34 4.77 -1.26 -4.71 117.00 124.92 3it6 n LEU 366 Ca -0.06 -3.45 0.01 0.00 -0.03 0.00 0.00 56.01 52.49 3it6 n LEU 366 Cb 0.48 -0.64 0.34 0.00 -2.33 0.00 0.00 43.42 41.26 3it6 n LEU 366 CO 0.47 0.99 0.76 0.77 -1.33 0.00 0.00 177.39 179.06 3it6 h SER 367 N 1.47 0.14 -4.09 -1.43 4.64 -1.92 -3.44 113.55 108.91 3it6 h SER 367 Ca 0.20 -0.04 -0.55 0.00 -0.47 0.00 0.00 61.79 60.93 3it6 h SER 367 Cb 1.81 -0.04 0.14 0.00 -0.31 0.00 0.00 62.40 64.00 3it6 h SER 367 CO 0.46 0.44 0.53 -1.81 -0.87 0.00 0.00 176.83 175.57 3it6 s ASP 368 N -6.91 4.91 0.37 4.97 1.11 -1.26 -4.94 116.67 114.93 3it6 s ASP 368 Ca -0.04 2.61 0.15 0.00 0.18 0.00 0.00 52.55 55.44 3it6 s ASP 368 Cb 0.14 -2.62 0.73 0.00 1.07 0.00 0.00 42.92 42.24 3it6 s ASP 368 CO 0.74 -1.80 1.80 0.00 1.18 0.00 0.00 175.17 177.09 3it6 h ALA 369 N 0.87 1.25 -2.88 5.23 0.00 -1.86 -3.42 119.26 118.46 3it6 h ALA 369 Ca -0.51 -0.35 -0.57 0.00 0.00 0.00 0.00 54.91 53.48 3it6 h ALA 369 Cb 1.32 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 3it6 h ALA 369 CO 0.55 0.48 -0.11 -0.51 0.00 0.00 0.00 179.25 179.66 3it6 s ASP 370 N -6.77 6.73 -0.04 0.00 1.01 -1.26 -0.47 116.67 115.87 3it6 s ASP 370 Ca -0.02 0.87 -0.01 0.00 0.71 0.00 0.00 52.55 54.10 3it6 s ASP 370 Cb 0.13 -2.30 0.03 0.00 1.01 0.00 0.00 42.92 41.79 3it6 s ASP 370 CO 0.71 -0.00 0.04 -0.63 0.21 0.00 0.00 175.17 175.50 3it6 s ILE 371 N 0.59 -0.03 -0.19 0.77 1.01 -0.78 -4.97 121.20 117.60 3it6 s ILE 371 Ca 0.27 0.32 -0.05 0.00 0.00 0.00 0.00 60.65 61.20 3it6 s ILE 371 Cb -0.16 -0.18 -0.03 0.00 0.01 0.00 0.00 42.46 42.11 3it6 s ILE 371 CO 0.11 0.16 0.00 -0.62 0.00 0.00 0.00 174.94 174.60 3it6 s ASP 372 N 1.80 4.93 -0.23 3.58 2.15 -1.26 -1.30 116.67 126.34 3it6 s ASP 372 Ca 0.01 -0.15 -0.09 0.00 0.43 0.00 0.00 52.55 52.75 3it6 s ASP 372 Cb -0.12 -1.84 -0.04 0.00 -0.30 0.00 0.00 42.92 40.62 3it6 s ASP 372 CO -0.03 0.10 0.10 -0.63 -0.17 0.00 0.00 175.17 174.54 3it6 s ILE 373 N 0.81 4.84 -0.14 4.11 1.01 -0.09 -0.62 121.20 131.13 3it6 s ILE 373 Ca 0.01 -0.00 0.02 0.00 0.00 0.00 0.00 60.65 60.68 3it6 s ILE 373 Cb -0.14 -3.24 0.01 0.00 0.01 0.00 0.00 42.46 39.10 3it6 s ILE 373 CO 0.02 0.37 -0.21 -0.89 0.00 0.00 0.00 174.94 174.23 3it6 s THR 374 N 1.06 2.00 -0.17 2.92 2.01 0.55 0.06 115.64 124.07 3it6 s THR 374 Ca 0.05 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.12 3it6 s THR 374 Cb -0.14 -1.77 0.02 0.00 0.01 0.00 0.00 72.50 70.62 3it6 s THR 374 CO 0.04 0.54 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.65 3it6 s VAL 375 N 0.88 1.82 -0.20 3.82 1.01 0.23 -0.17 120.40 127.80 3it6 s VAL 375 Ca -0.06 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 60.98 3it6 s VAL 375 Cb -0.15 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 3it6 s VAL 375 CO -0.03 0.44 0.09 -0.62 0.00 0.00 0.00 175.10 174.98 3it6 s ASP 376 N 1.37 5.81 0.19 3.32 2.15 -0.63 -0.41 116.67 128.48 3it6 s ASP 376 Ca 0.04 0.11 0.23 0.00 0.43 0.00 0.00 52.55 53.36 3it6 s ASP 376 Cb -0.14 -2.01 0.04 0.00 -0.30 0.00 0.00 42.92 40.51 3it6 s ASP 376 CO -0.11 0.16 1.07 -0.07 -0.17 0.00 0.00 175.17 176.05 3it6 h LEU 377 N 6.83 0.00 1.44 -1.34 3.38 -0.86 -1.51 115.31 123.25 3it6 h LEU 377 Ca -0.38 -0.03 -0.34 0.00 0.09 0.00 0.00 57.88 57.21 3it6 h LEU 377 Cb 1.16 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.82 3it6 h LEU 377 CO 0.71 0.02 -0.36 0.61 0.09 0.00 0.00 178.44 179.50 3it6 n GLY 378 N 1.20 0.90 0.15 0.83 0.00 -0.85 -4.34 105.19 103.08 3it6 n GLY 378 Ca 0.00 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 45.87 3it6 n GLY 378 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3it6 n VAL 379 N -3.09 0.92 -2.51 1.61 0.24 0.26 -5.04 118.33 110.71 3it6 n VAL 379 Ca -0.18 -1.06 0.00 0.00 -2.04 0.00 0.00 64.34 61.06 3it6 n VAL 379 Cb 0.59 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.27 3it6 n VAL 379 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3it6 n GLY 380 N -0.64 -0.57 0.11 7.63 0.00 -0.87 -4.09 105.19 106.77 3it6 n GLY 380 Ca 0.06 -0.75 0.05 0.00 0.00 0.00 0.00 46.02 45.39 3it6 n GLY 380 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3it6 n ASP 381 N 0.00 1.75 -4.76 1.61 5.68 -0.69 -4.00 116.55 116.13 3it6 n ASP 381 Ca 0.00 -2.51 -0.40 0.00 -0.50 0.00 0.00 54.79 51.38 3it6 n ASP 381 Cb 0.00 -0.26 -0.04 0.00 -1.14 0.00 0.00 41.12 39.68 3it6 n ASP 381 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3it6 s GLY 382 N -1.93 3.06 0.07 6.12 0.00 -0.28 -4.71 107.32 109.65 3it6 s GLY 382 Ca 0.17 0.94 -0.12 0.00 0.00 0.00 0.00 44.72 45.70 3it6 s GLY 382 CO 0.02 1.54 0.28 -0.86 0.00 0.00 0.00 173.10 174.07 3it6 s GLN 383 N -1.50 0.86 0.07 2.90 -2.07 -1.26 -1.14 119.66 117.51 3it6 s GLN 383 Ca 0.45 -0.69 -0.26 0.00 -1.82 0.00 0.00 55.36 53.03 3it6 s GLN 383 Cb -0.33 0.36 0.09 0.00 -1.09 0.00 0.00 33.01 32.04 3it6 s GLN 383 CO 0.42 -0.29 0.81 0.00 -1.32 0.00 0.00 175.29 174.92 3it6 s ALA 384 N -3.19 -1.72 -0.06 2.60 0.00 -0.27 -4.78 121.76 114.34 3it6 s ALA 384 Ca -0.00 0.72 -0.02 0.00 0.00 0.00 0.00 51.96 52.65 3it6 s ALA 384 Cb 0.01 0.59 0.04 0.00 0.00 0.00 0.00 23.12 23.76 3it6 s ALA 384 CO -0.07 -0.76 0.12 0.50 0.00 0.00 0.00 175.76 175.54 3it6 s ARG 385 N -3.34 0.02 -0.08 0.00 3.52 -1.26 -1.40 118.95 116.41 3it6 s ARG 385 Ca 0.05 0.43 -0.02 0.00 -0.13 0.00 0.00 55.73 56.06 3it6 s ARG 385 Cb -0.01 -0.29 -0.03 0.00 -1.56 0.00 0.00 34.95 33.05 3it6 s ARG 385 CO -0.08 -0.26 0.02 0.42 -0.81 0.00 0.00 175.30 174.59 3it6 s ILE 386 N 1.81 4.42 -0.25 4.11 -1.09 -0.32 -4.90 121.20 124.98 3it6 s ILE 386 Ca -0.01 -0.23 -0.16 0.00 -2.23 0.00 0.00 60.65 58.02 3it6 s ILE 386 Cb -0.12 -2.87 -0.03 0.00 -1.58 0.00 0.00 42.46 37.85 3it6 s ILE 386 CO -0.05 0.59 0.43 -0.13 -1.23 0.00 0.00 174.94 174.55 3it6 s ARG 387 N -0.95 4.08 0.16 2.79 0.52 -0.61 -1.03 118.95 123.90 3it6 s ARG 387 Ca 0.14 0.18 0.03 0.00 -0.52 0.00 0.00 55.73 55.56 3it6 s ARG 387 Cb -0.11 -3.62 -0.01 0.00 0.52 0.00 0.00 34.95 31.73 3it6 s ARG 387 CO 0.03 -0.23 0.10 -2.37 0.02 0.00 0.00 175.30 172.85 3it6 n THR 388 N 4.90 0.00 -4.15 0.02 5.66 0.77 -1.47 114.28 120.00 3it6 n THR 388 Ca -0.07 -1.05 -0.11 0.00 -3.05 0.00 0.00 64.05 59.77 3it6 n THR 388 Cb 0.50 0.48 -0.09 0.00 -1.55 0.00 0.00 70.33 69.67 3it6 n THR 388 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3it6 s THR 389 N -2.46 0.02 0.73 1.09 -4.23 -1.26 -1.12 115.64 108.41 3it6 s THR 389 Ca 0.15 -1.85 -0.11 0.00 -1.18 0.00 0.00 61.69 58.69 3it6 s THR 389 Cb 0.01 -2.35 0.04 0.00 1.34 0.00 0.00 72.50 71.53 3it6 s THR 389 CO 0.10 -0.08 1.11 1.51 -0.54 0.00 0.00 174.62 176.73 3it6 s ASP 390 N -3.11 5.13 -0.47 3.99 -4.77 -1.21 -4.92 116.67 111.32 3it6 s ASP 390 Ca 0.33 0.98 -0.12 0.00 -3.30 0.00 0.00 52.55 50.43 3it6 s ASP 390 Cb 0.06 -1.68 0.09 0.00 -1.09 0.00 0.00 42.92 40.30 3it6 s ASP 390 CO 0.09 -1.52 0.36 -0.22 0.70 0.00 0.00 175.17 174.59 3it6 s LEU 391 N -5.41 5.58 0.49 2.11 2.96 -1.06 -4.82 118.68 118.52 3it6 s LEU 391 Ca 0.59 -1.57 0.05 0.00 -0.22 0.00 0.00 54.13 52.99 3it6 s LEU 391 Cb -0.11 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.48 3it6 s LEU 391 CO 0.50 -0.65 0.26 -0.94 -1.32 0.00 0.00 176.35 174.20 3it6 s SER 392 N 2.62 4.50 0.18 3.68 1.04 -1.26 -4.35 113.70 120.11 3it6 s SER 392 Ca 0.04 -1.23 -0.13 0.00 0.48 0.00 0.00 55.95 55.11 3it6 s SER 392 Cb -0.25 0.07 0.08 0.00 0.10 0.00 0.00 66.02 66.01 3it6 s SER 392 CO 0.03 -0.84 1.82 0.45 0.98 0.00 0.00 173.24 175.67 3it6 h HIS 393 N 1.10 0.74 -0.88 5.02 3.86 -1.97 -2.89 115.15 120.12 3it6 h HIS 393 Ca -0.40 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 58.83 3it6 h HIS 393 Cb 1.29 -0.24 -0.05 0.00 1.06 0.00 0.00 27.41 29.46 3it6 h HIS 393 CO 0.93 0.50 0.58 0.00 0.86 0.00 0.00 177.93 180.80 3it6 h ALA 394 N 1.17 1.41 -0.33 2.45 0.00 -1.97 0.13 119.26 122.14 3it6 h ALA 394 Ca 0.20 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3it6 h ALA 394 Cb -0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3it6 h ALA 394 CO -0.04 0.53 0.17 -0.92 0.00 0.00 0.00 179.25 178.98 3it6 h TYR 395 N 1.15 0.46 -0.19 0.00 5.03 -1.69 0.77 116.97 122.50 3it6 h TYR 395 Ca 0.34 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.62 3it6 h TYR 395 Cb -0.06 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.07 3it6 h TYR 395 CO -0.00 0.39 0.09 0.28 -1.32 0.00 0.00 178.16 177.60 3it6 h VAL 396 N 0.40 1.14 -0.03 1.81 2.07 -1.22 -2.55 116.25 117.87 3it6 h VAL 396 Ca 0.11 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.27 3it6 h VAL 396 Cb 0.09 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 3it6 h VAL 396 CO -0.02 0.13 -0.20 -0.08 0.02 0.00 0.00 177.57 177.42 3it6 h GLU 397 N 0.18 -0.30 -0.47 1.57 4.57 -0.55 -1.36 114.58 118.22 3it6 h GLU 397 Ca 0.07 0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.31 3it6 h GLU 397 Cb 0.13 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 3it6 h GLU 397 CO -0.01 -0.20 0.32 0.93 -1.18 0.00 0.00 179.01 178.87 3it6 h GLU 398 N -0.31 0.46 -0.35 1.92 5.08 -0.84 -0.97 114.58 119.57 3it6 h GLU 398 Ca 0.07 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3it6 h GLU 398 Cb 0.40 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3it6 h GLU 398 CO -0.21 0.30 0.00 0.09 -1.00 0.00 0.00 179.01 178.19 3it6 n ASN 399 N -4.48 3.06 0.00 1.42 3.02 -0.96 -4.47 115.26 112.85 3it6 n ASN 399 Ca 0.06 -1.94 0.00 0.00 -0.03 0.00 0.00 54.58 52.67 3it6 n ASN 399 Cb 0.19 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 3it6 n ASN 399 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3it6 n SER 400 N 1.23 3.06 0.05 6.41 3.41 -0.55 -4.85 113.62 122.40 3it6 n SER 400 Ca 0.19 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.70 3it6 n SER 400 Cb 0.54 0.38 0.03 0.00 -0.26 0.00 0.00 64.21 64.91 3it6 n SER 400 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3it6 h ALA 401 N 0.00 0.61 -2.40 7.33 0.00 -1.41 -3.47 119.26 119.93 3it6 h ALA 401 Ca 0.00 -0.61 -0.42 0.00 0.00 0.00 0.00 54.91 53.89 3it6 h ALA 401 Cb 0.46 -0.06 -0.14 0.00 0.00 0.00 0.00 17.79 18.05 3it6 h ALA 401 CO 0.00 0.77 -0.55 1.52 0.00 0.00 0.00 179.25 180.98 3it6 s TYR 402 N -3.61 1.60 0.02 0.00 1.13 -1.26 -5.14 117.35 110.09 3it6 s TYR 402 Ca -0.05 -1.40 -0.23 0.00 -1.41 0.00 0.00 57.07 53.98 3it6 s TYR 402 Cb 0.11 -0.84 -0.05 0.00 -1.10 0.00 0.00 41.96 40.07 3it6 s TYR 402 CO 0.84 -0.55 0.68 -1.12 -2.51 0.00 0.00 175.55 172.88 3it6 s SER 403 N -3.37 7.09 0.00 -0.18 0.01 -1.26 -4.80 113.70 111.19 3it6 s SER 403 Ca 0.36 1.30 0.00 0.00 1.31 0.00 0.00 55.95 58.92 3it6 s SER 403 Cb 0.05 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.86 3it6 s SER 403 CO 0.18 0.06 0.00 -1.54 0.41 0.00 0.00 173.24 172.36