#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ir2 s SER 196 N 0.00 3.79 -0.00 0.26 0.01 -1.26 -4.81 113.70 111.68 3ir2 s SER 196 Ca 0.00 -0.88 -0.19 0.00 1.31 0.00 0.00 55.95 56.19 3ir2 s SER 196 Cb 0.00 -0.43 -0.06 0.00 0.21 0.00 0.00 66.02 65.75 3ir2 s SER 196 CO 0.00 0.06 0.55 -0.32 0.41 0.00 0.00 173.24 173.94 3ir2 s MET 197 N -3.28 4.25 0.22 12.44 0.00 0.02 -4.77 119.30 128.18 3ir2 s MET 197 Ca 0.28 0.66 -0.31 0.00 0.00 0.00 0.00 55.69 56.32 3ir2 s MET 197 Cb -0.06 -3.32 -0.11 0.00 0.00 0.00 0.00 34.83 31.34 3ir2 s MET 197 CO 0.15 0.44 1.57 0.34 0.00 0.00 0.00 175.02 177.52 3ir2 s ASP 198 N -0.41 6.51 0.18 1.11 3.68 -1.26 0.27 116.67 126.76 3ir2 s ASP 198 Ca 0.29 2.76 -0.12 0.00 2.13 0.00 0.00 52.55 57.60 3ir2 s ASP 198 Cb -0.18 -2.61 0.16 0.00 -1.45 0.00 0.00 42.92 38.84 3ir2 s ASP 198 CO 0.16 -0.85 1.78 -0.65 0.13 0.00 0.00 175.17 175.75 3ir2 h PRO 199 N 5.93 0.47 -0.31 4.34 0.11 -1.96 -1.75 132.00 138.83 3ir2 h PRO 199 Ca -0.44 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 3ir2 h PRO 199 Cb 1.21 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3ir2 h PRO 199 CO 0.86 0.31 0.05 -1.35 -0.21 0.00 0.00 178.00 177.67 3ir2 h PRO 200 N 0.49 0.46 -0.44 1.05 0.11 -1.99 -0.55 132.00 131.12 3ir2 h PRO 200 Ca 0.24 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 3ir2 h PRO 200 Cb 0.17 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.18 3ir2 h PRO 200 CO -0.18 0.44 0.25 1.15 -0.21 0.00 0.00 178.00 179.46 3ir2 h THR 201 N 0.45 1.15 -0.05 -1.15 2.02 -1.82 -0.55 112.91 112.96 3ir2 h THR 201 Ca 0.10 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 3ir2 h THR 201 Cb 0.21 0.60 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 3ir2 h THR 201 CO -0.00 0.16 0.03 0.15 0.37 0.00 0.00 175.52 176.23 3ir2 h PHE 202 N 0.58 0.07 -0.60 3.16 3.57 -0.47 -1.92 116.94 121.32 3ir2 h PHE 202 Ca 0.16 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.59 3ir2 h PHE 202 Cb 0.03 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 3ir2 h PHE 202 CO -0.02 0.13 0.12 1.15 -2.23 0.00 0.00 178.31 177.45 3ir2 h THR 203 N -0.01 1.25 -0.33 4.41 2.02 -1.00 -0.14 112.91 119.11 3ir2 h THR 203 Ca 0.02 -0.93 -0.06 0.00 0.77 0.00 0.00 66.41 66.21 3ir2 h THR 203 Cb 0.08 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 3ir2 h THR 203 CO -0.00 0.35 -0.03 0.15 0.37 0.00 0.00 175.52 176.35 3ir2 h PHE 204 N 0.91 0.66 0.00 3.16 3.57 -1.08 -3.12 116.94 121.05 3ir2 h PHE 204 Ca 0.19 -0.13 -0.20 0.00 3.53 0.00 0.00 57.97 61.36 3ir2 h PHE 204 Cb 0.37 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 3ir2 h PHE 204 CO 0.02 0.74 -1.28 -0.91 -2.23 0.00 0.00 178.31 174.66 3ir2 h ASN 205 N 0.39 0.00 0.15 0.41 2.35 -1.09 -3.35 115.58 114.44 3ir2 h ASN 205 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 3ir2 h ASN 205 Cb 0.50 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.87 3ir2 h ASN 205 CO 0.02 0.78 -1.04 0.49 -1.65 0.00 0.00 177.43 176.03 3ir2 n PHE 206 N -3.08 0.05 -1.66 1.19 3.01 -0.09 -4.76 117.46 112.12 3ir2 n PHE 206 Ca -0.08 0.01 -0.63 0.00 1.01 0.00 0.00 57.45 57.76 3ir2 n PHE 206 Cb 0.91 -0.17 -0.09 0.00 -0.01 0.00 0.00 39.48 40.12 3ir2 n PHE 206 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 3ir2 n ASN 207 N -1.67 1.01 -1.81 4.37 4.05 -1.18 -4.88 115.26 115.15 3ir2 n ASN 207 Ca 0.03 1.16 0.01 0.00 0.45 0.00 0.00 54.58 56.23 3ir2 n ASN 207 Cb 0.38 -0.94 0.32 0.00 1.23 0.00 0.00 39.78 40.76 3ir2 n ASN 207 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 3ir2 n ASN 208 N 3.30 4.92 -4.70 1.20 0.23 -1.26 -4.93 115.26 114.02 3ir2 n ASN 208 Ca 0.26 -2.94 -0.42 0.00 -0.53 0.00 0.00 54.58 50.95 3ir2 n ASN 208 Cb 0.02 -0.69 -0.03 0.00 -2.08 0.00 0.00 39.78 37.00 3ir2 n ASN 208 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 3ir2 s GLU 209 N -2.64 4.23 0.18 -3.83 2.56 -1.26 -4.86 118.70 113.07 3ir2 s GLU 209 Ca 0.49 2.26 -0.04 0.00 0.00 0.00 0.00 54.97 57.68 3ir2 s GLU 209 Cb 0.38 -3.41 0.06 0.00 2.00 0.00 0.00 34.13 33.16 3ir2 s GLU 209 CO 0.13 -0.63 1.46 -1.00 -0.56 0.00 0.00 175.26 174.66 3ir2 h PRO 210 N 7.58 0.56 -1.39 4.30 0.13 -1.99 -3.35 132.00 137.84 3ir2 h PRO 210 Ca -0.42 -0.39 -0.71 0.00 -0.87 0.00 0.00 66.00 63.62 3ir2 h PRO 210 Cb 1.20 0.06 -0.29 0.00 0.13 0.00 0.00 31.00 32.10 3ir2 h PRO 210 CO 0.91 1.00 0.86 0.91 -0.23 0.00 0.00 178.00 181.45 3ir2 n TRP 211 N -3.93 3.13 -4.35 1.56 7.02 -1.26 -4.87 117.44 114.74 3ir2 n TRP 211 Ca -0.04 -2.74 -0.18 0.00 -1.02 0.00 0.00 57.50 53.52 3ir2 n TRP 211 Cb 0.65 -1.29 -0.10 0.00 -2.42 0.00 0.00 31.31 28.15 3ir2 n TRP 211 CO 0.00 0.00 0.00 0.14 -2.02 0.00 0.00 177.69 175.81 3ir2 s VAL 212 N -4.93 1.39 0.39 -0.99 -7.23 -1.26 -5.17 120.40 102.59 3ir2 s VAL 212 Ca 0.59 -2.10 0.04 0.00 -1.81 0.00 0.00 61.98 58.70 3ir2 s VAL 212 Cb 0.48 -2.23 -0.03 0.00 0.56 0.00 0.00 36.38 35.16 3ir2 s VAL 212 CO -0.17 -0.44 0.15 -0.13 -0.31 0.00 0.00 175.10 174.20 3ir2 s ARG 213 N -3.76 1.88 0.00 4.82 1.81 -1.26 -4.90 118.95 117.54 3ir2 s ARG 213 Ca 0.26 -2.13 0.00 0.00 -1.72 0.00 0.00 55.73 52.14 3ir2 s ARG 213 Cb 0.03 -0.47 0.00 0.00 -0.45 0.00 0.00 34.95 34.06 3ir2 s ARG 213 CO 0.08 -0.49 0.00 0.41 -0.68 0.00 0.00 175.30 174.62 3ir2 n GLY 214 N -0.85 0.80 2.90 -3.53 0.00 -1.26 -4.99 105.19 98.27 3ir2 n GLY 214 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 3ir2 n GLY 214 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ir2 n ARG 215 N -2.19 3.69 0.13 1.61 1.74 -1.26 -4.73 116.66 115.65 3ir2 n ARG 215 Ca 0.00 -3.63 0.00 0.00 -0.77 0.00 0.00 57.85 53.46 3ir2 n ARG 215 Cb 0.00 -2.89 0.04 0.00 -1.02 0.00 0.00 32.46 28.59 3ir2 n ARG 215 CO 0.00 0.00 0.00 1.12 -1.52 0.00 0.00 177.63 177.23 3ir2 h HIS 216 N 5.77 0.00 -4.39 -1.55 2.07 -1.99 -3.46 115.15 111.60 3ir2 h HIS 216 Ca 0.38 0.00 -0.49 0.00 -2.85 0.00 0.00 60.37 57.40 3ir2 h HIS 216 Cb 0.64 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.71 3ir2 h HIS 216 CO 1.23 0.61 0.38 -1.21 -3.07 0.00 0.00 177.93 175.87 3ir2 s GLU 217 N -3.02 2.65 -0.11 5.12 2.02 -1.26 -5.07 118.70 119.03 3ir2 s GLU 217 Ca 0.02 0.59 0.03 0.00 0.02 0.00 0.00 54.97 55.63 3ir2 s GLU 217 Cb 0.09 -1.99 -0.00 0.00 0.10 0.00 0.00 34.13 32.33 3ir2 s GLU 217 CO 0.76 -1.21 -0.21 0.99 0.02 0.00 0.00 175.26 175.60 3ir2 s THR 218 N -3.24 2.34 -0.07 3.63 2.01 -1.26 -4.82 115.64 114.22 3ir2 s THR 218 Ca 0.59 -0.92 0.01 0.00 0.31 0.00 0.00 61.69 61.68 3ir2 s THR 218 Cb -0.12 -1.92 -0.03 0.00 0.01 0.00 0.00 72.50 70.43 3ir2 s THR 218 CO 0.53 0.55 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.63 3ir2 s TYR 219 N 0.37 2.95 -0.10 4.92 1.51 -1.26 -2.50 117.35 123.24 3ir2 s TYR 219 Ca -0.16 0.02 -0.01 0.00 -1.01 0.00 0.00 57.07 55.91 3ir2 s TYR 219 Cb -0.17 -1.72 0.03 0.00 -0.11 0.00 0.00 41.96 39.99 3ir2 s TYR 219 CO 0.07 0.33 -0.01 -1.17 -1.11 0.00 0.00 175.55 173.67 3ir2 s LEU 220 N -0.78 0.82 -0.14 -1.29 0.20 -0.10 -1.30 118.68 116.09 3ir2 s LEU 220 Ca 0.12 -0.27 -0.04 0.00 0.69 0.00 0.00 54.13 54.63 3ir2 s LEU 220 Cb -0.11 -0.54 -0.03 0.00 -0.43 0.00 0.00 46.19 45.08 3ir2 s LEU 220 CO 0.01 -0.20 -0.01 0.00 -0.29 0.00 0.00 176.35 175.86 3ir2 s TYR 222 N 0.01 1.94 0.03 0.00 -0.85 0.08 0.14 117.35 118.70 3ir2 s TYR 222 Ca 0.02 -0.43 -0.03 0.00 -0.52 0.00 0.00 57.07 56.10 3ir2 s TYR 222 Cb -0.13 -0.98 -0.02 0.00 0.38 0.00 0.00 41.96 41.21 3ir2 s TYR 222 CO 0.02 0.35 0.05 -1.21 -1.52 0.00 0.00 175.55 173.24 3ir2 s GLU 223 N -2.62 0.51 -0.05 -3.49 2.02 -0.37 -2.70 118.70 112.00 3ir2 s GLU 223 Ca 0.15 -0.77 0.02 0.00 0.02 0.00 0.00 54.97 54.40 3ir2 s GLU 223 Cb -0.07 0.19 0.01 0.00 0.10 0.00 0.00 34.13 34.37 3ir2 s GLU 223 CO 0.07 -0.11 -0.10 0.08 0.02 0.00 0.00 175.26 175.22 3ir2 s VAL 224 N -2.44 0.95 0.11 2.63 1.01 -1.21 -1.09 120.40 120.36 3ir2 s VAL 224 Ca -0.07 -0.38 0.10 0.00 0.00 0.00 0.00 61.98 61.63 3ir2 s VAL 224 Cb -0.02 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 3ir2 s VAL 224 CO -0.04 0.31 -0.25 -1.61 0.00 0.00 0.00 175.10 173.51 3ir2 s GLU 225 N 0.65 1.59 -0.03 2.72 2.02 0.02 -1.20 118.70 124.47 3ir2 s GLU 225 Ca -0.12 -1.25 0.07 0.00 0.02 0.00 0.00 54.97 53.68 3ir2 s GLU 225 Cb -0.15 -1.97 -0.01 0.00 0.10 0.00 0.00 34.13 32.10 3ir2 s GLU 225 CO 0.02 0.47 -0.23 -0.98 0.02 0.00 0.00 175.26 174.57 3ir2 s ARG 226 N -1.89 2.04 -0.23 1.61 1.04 0.15 -1.09 118.95 120.57 3ir2 s ARG 226 Ca 0.14 -0.83 -0.28 0.00 -1.04 0.00 0.00 55.73 53.72 3ir2 s ARG 226 Cb -0.10 -1.88 0.01 0.00 -2.04 0.00 0.00 34.95 30.93 3ir2 s ARG 226 CO 0.06 0.45 1.01 1.41 -0.04 0.00 0.00 175.30 178.19 3ir2 s MET 227 N -0.40 4.25 -0.08 3.89 1.75 -0.61 -0.04 119.30 128.06 3ir2 s MET 227 Ca 0.05 1.29 -0.01 0.00 -1.25 0.00 0.00 55.69 55.78 3ir2 s MET 227 Cb -0.10 -3.64 0.03 0.00 2.84 0.00 0.00 34.83 33.95 3ir2 s MET 227 CO 0.00 -0.60 -0.02 -1.01 -0.65 0.00 0.00 175.02 172.74 3ir2 s HIS 228 N 3.11 0.87 -1.31 4.11 3.76 0.12 -4.76 115.29 121.19 3ir2 s HIS 228 Ca 0.43 -0.31 -0.11 0.00 -0.15 0.00 0.00 55.06 54.92 3ir2 s HIS 228 Cb -0.15 -0.88 0.00 0.00 1.11 0.00 0.00 32.58 32.66 3ir2 s HIS 228 CO 0.07 -0.35 0.52 0.09 -0.85 0.00 0.00 174.74 174.22 3ir2 n ASN 229 N 4.93 -2.19 -0.51 1.40 3.02 -1.26 -1.24 115.26 119.41 3ir2 n ASN 229 Ca -0.11 -1.08 -0.07 0.00 -0.03 0.00 0.00 54.58 53.29 3ir2 n ASN 229 Cb 0.50 -2.81 -0.03 0.00 -0.61 0.00 0.00 39.78 36.83 3ir2 n ASN 229 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3ir2 n ASP 230 N -2.77 -4.94 -4.00 6.41 8.00 -1.26 -4.99 116.55 113.00 3ir2 n ASP 230 Ca -0.22 0.17 -0.19 0.00 0.71 0.00 0.00 54.79 55.26 3ir2 n ASP 230 Cb 0.64 -3.03 -0.15 0.00 -0.02 0.00 0.00 41.12 38.56 3ir2 n ASP 230 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3ir2 s THR 231 N -1.87 0.69 -0.14 -3.53 -4.23 -0.37 -5.11 115.64 101.07 3ir2 s THR 231 Ca 0.00 -0.35 -0.29 0.00 -1.18 0.00 0.00 61.69 59.87 3ir2 s THR 231 Cb 0.00 -0.59 -0.02 0.00 1.34 0.00 0.00 72.50 73.23 3ir2 s THR 231 CO 0.00 0.20 1.29 0.26 -0.54 0.00 0.00 174.62 175.83 3ir2 s TRP 232 N -0.04 2.82 -0.07 3.99 0.52 -1.26 -0.70 118.94 124.19 3ir2 s TRP 232 Ca 0.01 0.96 0.02 0.00 0.02 0.00 0.00 56.10 57.11 3ir2 s TRP 232 Cb -0.05 -3.53 -0.02 0.00 -1.15 0.00 0.00 33.47 28.71 3ir2 s TRP 232 CO -0.00 -1.84 -0.12 0.14 0.02 0.00 0.00 176.95 175.14 3ir2 s VAL 233 N 3.37 3.22 0.03 4.03 -7.23 0.94 -4.87 120.40 119.89 3ir2 s VAL 233 Ca 0.56 -0.65 -0.30 0.00 -1.81 0.00 0.00 61.98 59.78 3ir2 s VAL 233 Cb -0.23 -2.30 -0.05 0.00 0.56 0.00 0.00 36.38 34.37 3ir2 s VAL 233 CO 0.17 0.58 1.16 -0.54 -0.31 0.00 0.00 175.10 176.16 3ir2 s LYS 234 N -0.51 4.44 -0.96 4.82 -0.14 -1.26 0.31 119.74 126.44 3ir2 s LYS 234 Ca 0.07 1.69 -0.17 0.00 -1.36 0.00 0.00 55.97 56.20 3ir2 s LYS 234 Cb -0.12 -3.41 0.16 0.00 -1.68 0.00 0.00 37.83 32.78 3ir2 s LYS 234 CO 0.02 -0.26 1.10 -0.51 -0.76 0.00 0.00 175.35 174.94 3ir2 s LEU 235 N 1.28 5.43 0.59 3.17 2.01 -0.34 -4.89 118.68 125.94 3ir2 s LEU 235 Ca 0.57 -2.38 0.39 0.00 0.01 0.00 0.00 54.13 52.72 3ir2 s LEU 235 Cb -0.27 -2.36 1.98 0.00 0.01 0.00 0.00 46.19 45.55 3ir2 s LEU 235 CO 0.28 -0.89 2.18 0.78 1.01 0.00 0.00 176.35 179.71 3ir2 h ASN 236 N 8.29 0.00 1.10 2.29 4.21 -1.93 -0.63 115.58 128.91 3ir2 h ASN 236 Ca 0.17 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.65 3ir2 h ASN 236 Cb 1.00 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.19 3ir2 h ASN 236 CO 1.06 0.00 -0.14 1.56 -1.29 0.00 0.00 177.43 178.62 3ir2 h GLN 237 N 0.00 0.00 -2.46 0.81 1.08 -1.95 -3.36 115.11 109.23 3ir2 h GLN 237 Ca 0.00 0.00 -0.80 0.00 -1.45 0.00 0.00 58.65 56.40 3ir2 h GLN 237 Cb 0.16 0.00 -0.28 0.00 -0.05 0.00 0.00 27.48 27.31 3ir2 h GLN 237 CO 0.00 0.14 0.92 -2.13 -0.95 0.00 0.00 178.83 176.80 3ir2 n ARG 238 N -3.25 5.09 -4.20 1.46 3.00 -0.24 -4.93 116.66 113.59 3ir2 n ARG 238 Ca 0.01 -4.64 -0.17 0.00 -0.00 0.00 0.00 57.85 53.05 3ir2 n ARG 238 Cb 0.41 -2.48 -0.13 0.00 0.00 0.00 0.00 32.46 30.27 3ir2 n ARG 238 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3ir2 s ARG 239 N -3.82 0.72 -0.02 -0.14 3.00 -1.26 -3.35 118.95 114.08 3ir2 s ARG 239 Ca 0.37 -0.74 -0.29 0.00 0.00 0.00 0.00 55.73 55.07 3ir2 s ARG 239 Cb 0.15 -0.65 0.10 0.00 0.00 0.00 0.00 34.95 34.54 3ir2 s ARG 239 CO -0.05 0.15 1.29 0.20 0.00 0.00 0.00 175.30 176.89 3ir2 s GLY 240 N -1.30 -0.17 0.07 -3.53 0.00 -1.10 -5.02 107.32 96.28 3ir2 s GLY 240 Ca -0.03 0.13 -0.02 0.00 0.00 0.00 0.00 44.72 44.80 3ir2 s GLY 240 CO 0.01 4.94 0.01 -0.11 0.00 0.00 0.00 173.10 177.96 3ir2 s PHE 241 N -2.07 0.54 0.31 1.90 -0.12 -1.26 -0.74 117.98 116.54 3ir2 s PHE 241 Ca 0.28 -1.04 -0.14 0.00 -0.05 0.00 0.00 56.93 55.97 3ir2 s PHE 241 Cb 0.00 -0.36 0.02 0.00 -0.63 0.00 0.00 43.02 42.05 3ir2 s PHE 241 CO -0.01 -0.43 0.62 -0.48 -0.05 0.00 0.00 175.22 174.87 3ir2 s LEU 242 N -2.94 0.20 0.29 -1.99 0.05 -0.09 -4.91 118.68 109.29 3ir2 s LEU 242 Ca 0.10 -0.99 0.02 0.00 0.05 0.00 0.00 54.13 53.32 3ir2 s LEU 242 Cb 0.07 2.24 -0.04 0.00 -2.05 0.00 0.00 46.19 46.41 3ir2 s LEU 242 CO -0.08 -1.36 0.14 0.00 -0.55 0.00 0.00 176.35 174.51 3ir2 s ALA 243 N -3.42 1.88 0.64 1.48 0.00 -1.26 -0.92 121.76 120.15 3ir2 s ALA 243 Ca 0.19 -1.78 -0.16 0.00 0.00 0.00 0.00 51.96 50.22 3ir2 s ALA 243 Cb -0.03 1.13 -0.01 0.00 0.00 0.00 0.00 23.12 24.20 3ir2 s ALA 243 CO 0.11 -0.49 1.11 0.54 0.00 0.00 0.00 175.76 177.03 3ir2 s ASN 244 N -3.35 5.25 0.05 0.00 4.22 -1.04 -4.37 114.94 115.69 3ir2 s ASN 244 Ca 0.36 2.02 -0.02 0.00 -2.14 0.00 0.00 52.86 53.09 3ir2 s ASN 244 Cb 0.06 -2.56 -0.04 0.00 1.28 0.00 0.00 41.25 39.99 3ir2 s ASN 244 CO 0.16 -1.54 0.23 -1.10 -2.04 0.00 0.00 177.10 172.81 3ir2 s GLN 245 N -3.95 3.47 0.52 3.55 -1.52 0.11 -4.89 119.66 116.95 3ir2 s GLN 245 Ca 0.68 -0.35 -0.21 0.00 -1.95 0.00 0.00 55.36 53.53 3ir2 s GLN 245 Cb -0.21 -3.04 -0.06 0.00 -0.22 0.00 0.00 33.01 29.49 3ir2 s GLN 245 CO 0.39 0.61 1.17 0.00 -0.25 0.00 0.00 175.29 177.21 3ir2 s ALA 246 N -1.47 2.78 0.56 6.09 0.00 -1.26 -3.55 121.76 124.91 3ir2 s ALA 246 Ca 0.33 0.94 -0.19 0.00 0.00 0.00 0.00 51.96 53.04 3ir2 s ALA 246 Cb -0.13 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.54 3ir2 s ALA 246 CO 0.25 -0.84 1.11 -1.25 0.00 0.00 0.00 175.76 175.03 3ir2 s PRO 247 N -3.04 3.30 0.58 0.00 0.04 -1.26 -4.58 135.00 130.03 3ir2 s PRO 247 Ca 0.70 1.52 -0.17 0.00 0.04 0.00 0.00 61.00 63.09 3ir2 s PRO 247 Cb -0.28 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 3ir2 s PRO 247 CO 0.32 -0.87 1.10 -1.01 0.04 0.00 0.00 177.00 176.58 3ir2 s HIS 248 N -1.94 2.74 0.51 0.56 3.76 -1.26 -4.92 115.29 114.75 3ir2 s HIS 248 Ca 0.71 1.54 0.35 0.00 -0.15 0.00 0.00 55.06 57.51 3ir2 s HIS 248 Cb -0.22 -3.18 1.89 0.00 1.11 0.00 0.00 32.58 32.18 3ir2 s HIS 248 CO 0.29 -1.46 2.22 1.57 -0.85 0.00 0.00 174.74 176.51 3ir2 h LYS 249 N 0.74 0.00 0.00 1.40 -0.00 -1.98 -1.21 116.57 115.52 3ir2 h LYS 249 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.17 3ir2 h LYS 249 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.48 3ir2 h LYS 249 CO 0.56 0.03 0.00 1.12 -0.00 0.00 0.00 179.45 181.17 3ir2 h HIS 250 N 0.00 0.00 -0.48 0.07 2.07 -1.99 -3.49 115.15 111.33 3ir2 h HIS 250 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3ir2 h HIS 250 Cb 0.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.13 3ir2 h HIS 250 CO 0.00 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.27 3ir2 n GLY 251 N -0.37 -1.66 4.70 6.13 0.00 -0.46 -4.92 105.19 108.61 3ir2 n GLY 251 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.73 3ir2 n GLY 251 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ir2 n PHE 252 N -0.44 0.00 -3.56 1.61 3.72 -1.26 -4.91 117.46 112.62 3ir2 n PHE 252 Ca 0.00 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.03 3ir2 n PHE 252 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 3ir2 n PHE 252 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ir2 s LEU 253 N 0.00 4.39 0.61 4.37 2.01 -1.26 -5.07 118.68 123.74 3ir2 s LEU 253 Ca 0.00 0.76 -0.17 0.00 0.01 0.00 0.00 54.13 54.73 3ir2 s LEU 253 Cb 0.00 -2.45 -0.02 0.00 0.01 0.00 0.00 46.19 43.72 3ir2 s LEU 253 CO 0.00 0.26 1.15 -1.83 1.01 0.00 0.00 176.35 176.94 3ir2 s GLU 254 N -0.58 2.96 0.42 1.70 -1.05 -1.26 -4.49 118.70 116.39 3ir2 s GLU 254 Ca 0.21 1.59 -0.26 0.00 -0.15 0.00 0.00 54.97 56.36 3ir2 s GLU 254 Cb -0.15 -1.95 -0.09 0.00 -0.44 0.00 0.00 34.13 31.50 3ir2 s GLU 254 CO 0.09 -1.16 1.40 0.20 0.95 0.00 0.00 175.26 176.74 3ir2 s GLY 255 N -2.04 2.93 0.09 -3.83 0.00 -1.26 -4.80 107.32 98.41 3ir2 s GLY 255 Ca 0.72 1.41 -0.31 0.00 0.00 0.00 0.00 44.72 46.54 3ir2 s GLY 255 CO 0.35 2.03 1.60 -1.60 0.00 0.00 0.00 173.10 175.49 3ir2 s ARG 256 N -2.29 4.21 0.54 2.90 3.52 -1.23 -4.70 118.95 121.89 3ir2 s ARG 256 Ca 0.58 2.30 -0.20 0.00 -0.13 0.00 0.00 55.73 58.27 3ir2 s ARG 256 Cb -0.42 -3.48 -0.06 0.00 -1.56 0.00 0.00 34.95 29.43 3ir2 s ARG 256 CO 0.55 -0.68 1.15 -1.01 -0.81 0.00 0.00 175.30 174.50 3ir2 s HIS 257 N 2.21 2.66 0.26 5.12 3.76 -1.26 0.05 115.29 128.10 3ir2 s HIS 257 Ca 0.72 1.54 -0.02 0.00 -0.15 0.00 0.00 55.06 57.15 3ir2 s HIS 257 Cb -0.40 -3.34 0.54 0.00 1.11 0.00 0.00 32.58 30.49 3ir2 s HIS 257 CO 0.31 -1.67 1.73 0.00 -0.85 0.00 0.00 174.74 174.26 3ir2 h ALA 258 N 1.31 1.19 -0.71 -1.40 0.00 -1.87 -1.83 119.26 115.96 3ir2 h ALA 258 Ca -0.50 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3ir2 h ALA 258 Cb 1.26 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 3ir2 h ALA 258 CO 0.57 -0.22 0.45 0.93 0.00 0.00 0.00 179.25 180.99 3ir2 h GLU 259 N 0.47 0.94 -0.23 0.00 3.07 -1.92 -0.03 114.58 116.88 3ir2 h GLU 259 Ca 0.46 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 59.11 3ir2 h GLU 259 Cb 0.74 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 3ir2 h GLU 259 CO -0.43 0.64 -0.41 -0.07 -1.40 0.00 0.00 179.01 177.33 3ir2 h LEU 260 N 0.96 0.75 -1.04 1.33 3.38 -1.72 -1.73 115.31 117.25 3ir2 h LEU 260 Ca 0.26 -0.54 0.03 0.00 0.09 0.00 0.00 57.88 57.72 3ir2 h LEU 260 Cb -0.08 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.39 3ir2 h LEU 260 CO -0.05 1.15 0.64 0.00 0.09 0.00 0.00 178.44 180.27 3ir2 h PHE 262 N 1.25 0.59 -0.51 0.00 3.57 -0.88 -2.41 116.94 118.55 3ir2 h PHE 262 Ca 0.39 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.81 3ir2 h PHE 262 Cb -0.01 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 3ir2 h PHE 262 CO -0.00 0.48 0.11 -0.07 -2.23 0.00 0.00 178.31 176.60 3ir2 h LEU 263 N 0.52 0.73 -1.06 0.59 3.38 -0.87 -2.73 115.31 115.88 3ir2 h LEU 263 Ca 0.14 -0.13 0.08 0.00 0.09 0.00 0.00 57.88 58.06 3ir2 h LEU 263 Cb 0.11 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.60 3ir2 h LEU 263 CO -0.02 0.73 0.63 0.44 0.09 0.00 0.00 178.44 180.31 3ir2 h ASP 264 N 0.76 0.97 1.67 -0.43 3.32 -0.54 -2.97 116.42 119.20 3ir2 h ASP 264 Ca 0.17 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.19 3ir2 h ASP 264 Cb 0.30 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3ir2 h ASP 264 CO 0.00 0.60 -0.34 -0.37 -1.72 0.00 0.00 179.24 177.42 3ir2 h VAL 265 N 1.09 0.26 -0.90 -1.35 -1.51 -1.13 -3.37 116.25 109.34 3ir2 h VAL 265 Ca 0.43 -1.39 0.07 0.00 -1.23 0.00 0.00 66.70 64.59 3ir2 h VAL 265 Cb 0.24 2.06 -0.07 0.00 -2.13 0.00 0.00 31.29 31.39 3ir2 h VAL 265 CO -0.18 0.15 0.56 0.40 -1.23 0.00 0.00 177.57 177.27 3ir2 h ILE 266 N 0.00 1.02 -0.45 7.19 2.04 -1.39 -1.23 117.51 124.69 3ir2 h ILE 266 Ca -0.01 -0.34 0.09 0.00 1.00 0.00 0.00 64.86 65.60 3ir2 h ILE 266 Cb 1.14 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 3ir2 h ILE 266 CO 0.02 0.18 0.31 -0.65 0.00 0.00 0.00 178.15 178.01 3ir2 h PRO 267 N 0.99 0.22 0.00 2.37 0.11 -1.75 -2.20 132.00 131.75 3ir2 h PRO 267 Ca 0.40 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.50 3ir2 h PRO 267 Cb 0.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.29 3ir2 h PRO 267 CO -0.19 0.15 0.00 1.19 -0.21 0.00 0.00 178.00 178.93 3ir2 n PHE 268 N -4.46 0.00 0.30 0.65 3.72 -0.47 -2.43 117.46 114.78 3ir2 n PHE 268 Ca 0.07 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.61 3ir2 n PHE 268 Cb 0.36 -0.46 0.40 0.00 -0.94 0.00 0.00 39.48 38.83 3ir2 n PHE 268 CO 0.00 0.00 0.00 -1.49 -0.05 0.00 0.00 176.76 175.22 3ir2 h TRP 269 N 0.00 0.00 -6.00 1.38 6.55 -1.45 -3.47 115.95 112.96 3ir2 h TRP 269 Ca 0.00 0.00 -0.41 0.00 0.95 0.00 0.00 58.89 59.43 3ir2 h TRP 269 Cb 0.31 0.00 0.07 0.00 -0.86 0.00 0.00 29.16 28.69 3ir2 h TRP 269 CO 0.00 0.00 -0.75 0.36 -1.05 0.00 0.00 178.44 177.00 3ir2 n LYS 270 N -2.93 -6.32 -1.65 0.49 2.85 -1.02 -4.93 118.16 104.66 3ir2 n LYS 270 Ca 0.03 0.72 -0.41 0.00 -1.05 0.00 0.00 58.31 57.60 3ir2 n LYS 270 Cb 0.42 -5.61 0.02 0.00 -0.65 0.00 0.00 35.03 29.21 3ir2 n LYS 270 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3ir2 n LEU 271 N -4.59 3.33 -4.60 -5.58 4.32 -1.26 -4.93 117.00 103.69 3ir2 n LEU 271 Ca -0.11 1.04 -0.43 0.00 -0.02 0.00 0.00 56.01 56.50 3ir2 n LEU 271 Cb 0.60 -1.42 -0.04 0.00 -1.62 0.00 0.00 43.42 40.94 3ir2 n LEU 271 CO 0.68 -1.17 0.76 -0.62 -1.22 0.00 0.00 177.39 175.83 3ir2 s ASP 272 N -0.71 6.65 0.66 -1.43 -1.08 -1.26 -4.91 116.67 114.59 3ir2 s ASP 272 Ca 0.64 0.50 0.37 0.00 -0.52 0.00 0.00 52.55 53.53 3ir2 s ASP 272 Cb -0.52 -2.46 2.00 0.00 -1.46 0.00 0.00 42.92 40.48 3ir2 s ASP 272 CO 0.56 -0.90 2.13 -0.07 0.52 0.00 0.00 175.17 177.41 3ir2 h LEU 273 N 10.18 0.00 0.00 -1.34 3.38 -1.98 -0.75 115.31 124.79 3ir2 h LEU 273 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3ir2 h LEU 273 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3ir2 h LEU 273 CO 0.99 0.00 -0.40 0.44 0.09 0.00 0.00 178.44 179.57 3ir2 h ASP 274 N 0.00 0.00 -2.31 -0.43 3.32 -1.99 -3.44 116.42 111.56 3ir2 h ASP 274 Ca 0.00 -0.08 -0.45 0.00 0.02 0.00 0.00 57.03 56.52 3ir2 h ASP 274 Cb 0.35 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.92 3ir2 h ASP 274 CO 0.00 0.04 -0.19 -1.10 -1.72 0.00 0.00 179.24 176.27 3ir2 s GLN 275 N -3.19 3.03 -0.13 3.56 -1.52 -0.29 -5.11 119.66 116.01 3ir2 s GLN 275 Ca 0.06 -0.74 -0.03 0.00 -1.95 0.00 0.00 55.36 52.71 3ir2 s GLN 275 Cb 0.11 -2.66 -0.03 0.00 -0.22 0.00 0.00 33.01 30.21 3ir2 s GLN 275 CO 0.69 -0.18 -0.04 -0.51 -0.25 0.00 0.00 175.29 175.00 3ir2 s ASP 276 N -4.22 4.81 0.10 5.90 1.01 -1.26 -4.70 116.67 118.30 3ir2 s ASP 276 Ca 0.48 -0.08 0.07 0.00 0.71 0.00 0.00 52.55 53.73 3ir2 s ASP 276 Cb -0.10 -1.65 -0.03 0.00 1.01 0.00 0.00 42.92 42.15 3ir2 s ASP 276 CO 0.35 0.22 -0.19 -0.31 0.21 0.00 0.00 175.17 175.46 3ir2 s TYR 277 N 0.04 1.65 -0.19 4.23 1.51 0.31 -1.58 117.35 123.32 3ir2 s TYR 277 Ca 0.00 -0.44 0.00 0.00 -1.01 0.00 0.00 57.07 55.62 3ir2 s TYR 277 Cb -0.13 -0.90 0.02 0.00 -0.11 0.00 0.00 41.96 40.84 3ir2 s TYR 277 CO 0.03 0.18 -0.17 0.50 -1.11 0.00 0.00 175.55 174.98 3ir2 s ARG 278 N -2.01 3.02 -0.28 -0.62 3.52 -0.25 -0.16 118.95 122.16 3ir2 s ARG 278 Ca 0.06 -0.82 -0.05 0.00 -0.13 0.00 0.00 55.73 54.78 3ir2 s ARG 278 Cb -0.09 -2.66 0.02 0.00 -1.56 0.00 0.00 34.95 30.65 3ir2 s ARG 278 CO 0.04 -0.23 0.04 0.08 -0.81 0.00 0.00 175.30 174.42 3ir2 s VAL 279 N 1.31 3.64 -0.19 7.11 1.01 0.08 -0.80 120.40 132.56 3ir2 s VAL 279 Ca 0.04 -0.82 -0.08 0.00 0.00 0.00 0.00 61.98 61.13 3ir2 s VAL 279 Cb -0.14 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 3ir2 s VAL 279 CO -0.11 0.10 0.07 -0.89 0.00 0.00 0.00 175.10 174.26 3ir2 s THR 280 N 1.44 4.81 -0.15 3.92 2.01 -0.25 -0.84 115.64 126.58 3ir2 s THR 280 Ca 0.02 -0.03 -0.03 0.00 0.31 0.00 0.00 61.69 61.96 3ir2 s THR 280 Cb -0.17 -3.17 -0.02 0.00 0.01 0.00 0.00 72.50 69.14 3ir2 s THR 280 CO 0.01 0.45 -0.06 0.00 -0.69 0.00 0.00 174.62 174.32 3ir2 s PHE 282 N 0.40 3.27 0.02 0.00 0.40 0.12 0.08 117.98 122.27 3ir2 s PHE 282 Ca -0.06 -1.12 0.04 0.00 -0.60 0.00 0.00 56.93 55.19 3ir2 s PHE 282 Cb -0.15 -2.62 -0.04 0.00 0.51 0.00 0.00 43.02 40.72 3ir2 s PHE 282 CO 0.04 -0.72 -0.06 0.95 0.70 0.00 0.00 175.22 176.13 3ir2 s THR 283 N 1.52 3.66 0.10 0.64 -4.23 -0.12 -1.04 115.64 116.17 3ir2 s THR 283 Ca 0.02 -0.85 -0.06 0.00 -1.18 0.00 0.00 61.69 59.62 3ir2 s THR 283 Cb -0.21 -2.62 -0.23 0.00 1.34 0.00 0.00 72.50 70.78 3ir2 s THR 283 CO 0.05 0.34 1.22 0.77 -0.54 0.00 0.00 174.62 176.46 3ir2 h SER 284 N 4.31 0.57 -3.01 3.99 4.64 -1.49 0.33 113.55 122.90 3ir2 h SER 284 Ca -0.48 -0.51 -0.58 0.00 -0.47 0.00 0.00 61.79 59.74 3ir2 h SER 284 Cb 1.17 -0.18 -0.17 0.00 -0.31 0.00 0.00 62.40 62.91 3ir2 h SER 284 CO 0.54 1.34 -0.78 0.26 -0.87 0.00 0.00 176.83 177.32 3ir2 s TRP 285 N -3.04 2.09 0.56 4.77 0.52 -1.26 -2.20 118.94 120.38 3ir2 s TRP 285 Ca -0.06 -0.41 -0.15 0.00 0.02 0.00 0.00 56.10 55.51 3ir2 s TRP 285 Cb 0.08 -0.99 -0.06 0.00 -1.15 0.00 0.00 33.47 31.35 3ir2 s TRP 285 CO 0.89 0.50 1.01 -1.54 0.02 0.00 0.00 176.95 177.82 3ir2 s SER 286 N -3.00 6.36 0.43 2.95 1.04 -0.79 -4.89 113.70 115.81 3ir2 s SER 286 Ca 0.22 1.56 -0.26 0.00 0.48 0.00 0.00 55.95 57.96 3ir2 s SER 286 Cb -0.06 -2.50 -0.08 0.00 0.10 0.00 0.00 66.02 63.48 3ir2 s SER 286 CO 0.10 -0.77 1.36 -2.84 0.98 0.00 0.00 173.24 172.07 3ir2 s PRO 287 N -4.43 3.82 1.11 4.02 0.02 -1.26 -4.45 135.00 133.84 3ir2 s PRO 287 Ca 0.58 2.28 -0.15 0.00 0.02 0.00 0.00 61.00 63.73 3ir2 s PRO 287 Cb -0.11 -2.70 0.25 0.00 0.02 0.00 0.00 34.50 31.96 3ir2 s PRO 287 CO 0.39 -0.66 1.07 0.00 -0.33 0.00 0.00 177.00 177.48 3ir2 h PHE 289 N -2.32 0.23 -0.37 0.00 3.57 -1.86 -1.43 116.94 114.76 3ir2 h PHE 289 Ca -0.54 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 60.84 3ir2 h PHE 289 Cb 1.33 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 3ir2 h PHE 289 CO -0.42 0.17 -0.26 0.66 -2.23 0.00 0.00 178.31 176.23 3ir2 h SER 290 N 0.22 0.79 -0.80 0.41 4.64 -1.94 -1.57 113.55 115.30 3ir2 h SER 290 Ca 0.06 -0.30 -0.02 0.00 -0.47 0.00 0.00 61.79 61.07 3ir2 h SER 290 Cb 0.01 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 61.84 3ir2 h SER 290 CO -0.01 1.01 0.42 0.00 -0.87 0.00 0.00 176.83 177.38 3ir2 h ALA 292 N 1.33 0.95 -0.10 0.00 0.00 -0.66 -0.14 119.26 120.64 3ir2 h ALA 292 Ca 0.28 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ir2 h ALA 292 Cb 0.05 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3ir2 h ALA 292 CO -0.04 0.64 0.06 1.96 0.00 0.00 0.00 179.25 181.87 3ir2 h GLN 293 N 0.94 0.14 -0.65 0.00 4.20 -1.06 -0.32 115.11 118.35 3ir2 h GLN 293 Ca 0.18 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 3ir2 h GLN 293 Cb 0.48 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 3ir2 h GLN 293 CO 0.02 0.15 0.34 1.49 -0.67 0.00 0.00 178.83 180.17 3ir2 h GLU 294 N 0.08 0.90 -0.16 1.46 4.57 -0.98 -1.01 114.58 119.44 3ir2 h GLU 294 Ca 0.04 -0.10 -0.16 0.00 -1.18 0.00 0.00 59.36 57.96 3ir2 h GLU 294 Cb 0.06 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 3ir2 h GLU 294 CO -0.01 0.67 -0.56 0.52 -1.18 0.00 0.00 179.01 178.45 3ir2 h MET 295 N 0.91 0.50 -0.53 1.92 2.86 -0.81 -1.71 114.93 118.07 3ir2 h MET 295 Ca 0.23 -0.32 -0.07 0.00 -2.06 0.00 0.00 59.70 57.48 3ir2 h MET 295 Cb 0.04 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 3ir2 h MET 295 CO -0.04 0.93 0.07 0.00 1.06 0.00 0.00 176.91 178.93 3ir2 h ALA 296 N 1.01 0.71 -0.62 6.32 0.00 -0.60 -2.12 119.26 123.96 3ir2 h ALA 296 Ca 0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 3ir2 h ALA 296 Cb 1.10 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3ir2 h ALA 296 CO 0.10 0.46 0.18 1.57 0.00 0.00 0.00 179.25 181.57 3ir2 h LYS 297 N 0.78 0.97 0.29 0.00 2.10 -1.07 -0.99 116.57 118.66 3ir2 h LYS 297 Ca 0.16 -0.22 -0.01 0.00 -2.00 0.00 0.00 60.65 58.58 3ir2 h LYS 297 Cb 0.43 -0.14 0.00 0.00 -0.90 0.00 0.00 32.23 31.62 3ir2 h LYS 297 CO 0.01 0.87 -0.14 0.35 -2.00 0.00 0.00 179.45 178.54 3ir2 h PHE 298 N 0.90 -0.37 0.00 0.07 3.57 -1.11 -2.29 116.94 117.71 3ir2 h PHE 298 Ca 0.20 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 3ir2 h PHE 298 Cb 0.31 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 3ir2 h PHE 298 CO 0.02 -0.21 -0.32 -0.84 -2.23 0.00 0.00 178.31 174.74 3ir2 h ILE 299 N -0.42 0.97 -0.29 1.41 3.07 -1.34 -0.49 117.51 120.42 3ir2 h ILE 299 Ca -0.04 -1.20 -0.05 0.00 1.55 0.00 0.00 64.86 65.12 3ir2 h ILE 299 Cb 0.32 1.70 -0.02 0.00 -0.27 0.00 0.00 36.82 38.55 3ir2 h ILE 299 CO 0.07 0.31 -0.04 0.28 -1.05 0.00 0.00 178.15 177.71 3ir2 h SER 300 N 0.00 0.43 0.44 2.16 0.02 -0.97 -2.83 113.55 112.79 3ir2 h SER 300 Ca -0.00 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3ir2 h SER 300 Cb 0.67 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.10 3ir2 h SER 300 CO 0.04 0.53 -0.78 0.29 -1.14 0.00 0.00 176.83 175.77 3ir2 n LYS 301 N -4.27 0.14 -3.54 3.45 4.01 -0.79 -4.58 118.16 112.58 3ir2 n LYS 301 Ca 0.01 0.01 -0.27 0.00 -0.51 0.00 0.00 58.31 57.55 3ir2 n LYS 301 Cb 0.26 -1.55 -0.09 0.00 -0.51 0.00 0.00 35.03 33.13 3ir2 n LYS 301 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 3ir2 n ASN 302 N -1.73 2.86 0.12 4.39 3.02 -0.26 -4.93 115.26 118.73 3ir2 n ASN 302 Ca 0.04 -3.22 0.11 0.00 -0.03 0.00 0.00 54.58 51.48 3ir2 n ASN 302 Cb 0.38 -0.69 0.48 0.00 -0.61 0.00 0.00 39.78 39.35 3ir2 n ASN 302 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3ir2 n LYS 303 N 1.37 0.17 0.00 3.52 4.01 -1.25 -1.58 118.16 124.41 3ir2 n LYS 303 Ca 0.26 0.42 0.10 0.00 -0.51 0.00 0.00 58.31 58.59 3ir2 n LYS 303 Cb 0.41 -1.84 0.54 0.00 -0.51 0.00 0.00 35.03 33.63 3ir2 n LYS 303 CO 0.00 0.00 0.00 -2.39 -1.11 0.00 0.00 177.40 173.90 3ir2 n HIS 304 N -2.17 0.00 -4.57 2.13 1.44 -1.26 -4.71 115.22 106.07 3ir2 n HIS 304 Ca 0.02 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.40 3ir2 n HIS 304 Cb 0.21 -0.26 -0.13 0.00 0.12 0.00 0.00 29.99 29.93 3ir2 n HIS 304 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 3ir2 s VAL 305 N -2.51 3.55 -0.29 0.61 1.01 -0.61 -0.53 120.40 121.62 3ir2 s VAL 305 Ca 0.21 -0.49 -0.06 0.00 0.00 0.00 0.00 61.98 61.65 3ir2 s VAL 305 Cb 0.14 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 34.02 3ir2 s VAL 305 CO 0.31 0.52 0.06 -0.44 0.00 0.00 0.00 175.10 175.55 3ir2 s SER 306 N 0.20 4.99 -0.15 3.32 0.01 0.77 -4.95 113.70 117.89 3ir2 s SER 306 Ca -0.05 -0.77 -0.18 0.00 1.31 0.00 0.00 55.95 56.26 3ir2 s SER 306 Cb -0.14 -1.84 -0.04 0.00 0.21 0.00 0.00 66.02 64.21 3ir2 s SER 306 CO 0.04 -0.19 0.48 -0.22 0.41 0.00 0.00 173.24 173.76 3ir2 s LEU 307 N 1.46 4.23 -0.18 2.44 2.96 -1.26 -0.74 118.68 127.59 3ir2 s LEU 307 Ca 0.02 0.75 -0.00 0.00 -0.22 0.00 0.00 54.13 54.68 3ir2 s LEU 307 Cb -0.17 -2.68 0.00 0.00 0.50 0.00 0.00 46.19 43.84 3ir2 s LEU 307 CO 0.01 -0.05 -0.14 0.00 -1.32 0.00 0.00 176.35 174.85 3ir2 s ILE 309 N 1.13 3.08 -0.28 0.00 1.01 0.17 0.11 121.20 126.41 3ir2 s ILE 309 Ca 0.01 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.06 3ir2 s ILE 309 Cb -0.14 -2.41 0.07 0.00 0.01 0.00 0.00 42.46 39.99 3ir2 s ILE 309 CO -0.05 0.42 -0.05 -0.54 0.00 0.00 0.00 174.94 174.71 3ir2 s LYS 310 N 1.43 1.96 -0.11 2.79 1.02 0.11 -1.04 119.74 125.90 3ir2 s LYS 310 Ca 0.05 -1.50 -0.02 0.00 0.02 0.00 0.00 55.97 54.52 3ir2 s LYS 310 Cb -0.14 -2.97 -0.03 0.00 -0.52 0.00 0.00 37.83 34.17 3ir2 s LYS 310 CO -0.05 -0.69 -0.01 -0.08 -0.92 0.00 0.00 175.35 173.59 3ir2 s THR 311 N 1.06 4.18 0.20 2.17 -1.32 -0.56 -0.95 115.64 120.43 3ir2 s THR 311 Ca -0.02 -0.28 -0.09 0.00 -1.21 0.00 0.00 61.69 60.08 3ir2 s THR 311 Cb -0.20 -2.78 0.13 0.00 -1.51 0.00 0.00 72.50 68.15 3ir2 s THR 311 CO -0.06 0.57 1.76 0.00 -2.21 0.00 0.00 174.62 174.67 3ir2 h ALA 312 N 5.62 0.96 -2.72 11.08 0.00 -0.45 -0.54 119.26 133.21 3ir2 h ALA 312 Ca -0.45 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.10 3ir2 h ALA 312 Cb 1.19 -0.29 -0.19 0.00 0.00 0.00 0.00 17.79 18.50 3ir2 h ALA 312 CO 0.57 0.60 -0.69 1.03 0.00 0.00 0.00 179.25 180.76 3ir2 s ARG 313 N -5.52 0.44 -0.12 0.00 0.52 -0.94 -4.73 118.95 108.60 3ir2 s ARG 313 Ca -0.12 -0.84 -0.21 0.00 -0.52 0.00 0.00 55.73 54.04 3ir2 s ARG 313 Cb 0.15 0.12 -0.04 0.00 0.52 0.00 0.00 34.95 35.70 3ir2 s ARG 313 CO 0.83 -0.06 0.59 0.42 0.02 0.00 0.00 175.30 177.10 3ir2 s ILE 314 N -2.34 5.10 -0.55 1.52 1.01 -1.26 -1.88 121.20 122.80 3ir2 s ILE 314 Ca -0.07 1.17 -0.20 0.00 0.00 0.00 0.00 60.65 61.55 3ir2 s ILE 314 Cb -0.04 -3.92 0.07 0.00 0.01 0.00 0.00 42.46 38.58 3ir2 s ILE 314 CO -0.04 0.24 0.70 -0.47 0.00 0.00 0.00 174.94 175.38 3ir2 s TYR 315 N 1.04 2.98 -0.30 3.97 6.14 -1.26 -4.85 117.35 125.06 3ir2 s TYR 315 Ca 0.30 -0.62 -0.01 0.00 0.64 0.00 0.00 57.07 57.38 3ir2 s TYR 315 Cb -0.16 -3.78 0.06 0.00 0.42 0.00 0.00 41.96 38.49 3ir2 s TYR 315 CO 0.13 -1.19 0.00 0.34 0.64 0.00 0.00 175.55 175.47 3ir2 s ASP 316 N 3.06 4.87 0.00 4.32 2.15 -1.26 -4.85 116.67 124.96 3ir2 s ASP 316 Ca 0.16 -1.36 0.15 0.00 0.43 0.00 0.00 52.55 51.93 3ir2 s ASP 316 Cb -0.20 -1.70 0.56 0.00 -0.30 0.00 0.00 42.92 41.27 3ir2 s ASP 316 CO 0.11 -0.28 1.41 -0.90 -0.17 0.00 0.00 175.17 175.34 3ir2 n ASP 317 N 4.59 1.45 -2.03 -0.34 3.85 -1.26 -4.86 116.55 117.95 3ir2 n ASP 317 Ca -0.12 -1.82 -0.18 0.00 -0.71 0.00 0.00 54.79 51.96 3ir2 n ASP 317 Cb 0.43 -0.14 -0.04 0.00 -1.35 0.00 0.00 41.12 40.03 3ir2 n ASP 317 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3ir2 n GLN 318 N 0.22 -1.66 0.00 0.11 6.02 -1.26 -4.84 117.38 115.98 3ir2 n GLN 318 Ca 0.13 0.97 0.00 0.00 -0.01 0.00 0.00 57.00 58.09 3ir2 n GLN 318 Cb 0.26 -5.48 0.00 0.00 1.02 0.00 0.00 30.24 26.04 3ir2 n GLN 318 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ir2 n GLY 319 N -0.69 1.64 0.94 1.08 0.00 -1.26 -4.99 105.19 101.91 3ir2 n GLY 319 Ca -0.20 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 45.85 3ir2 n GLY 319 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ir2 n ARG 320 N 0.00 2.18 -0.17 1.61 1.74 -1.26 -4.59 116.66 116.17 3ir2 n ARG 320 Ca 0.00 -2.01 -0.07 0.00 -0.77 0.00 0.00 57.85 55.00 3ir2 n ARG 320 Cb 0.00 -1.43 0.02 0.00 -1.02 0.00 0.00 32.46 30.04 3ir2 n ARG 320 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ir2 h ALA 321 N 3.84 0.63 -0.36 7.54 0.00 -1.93 -1.41 119.26 127.58 3ir2 h ALA 321 Ca 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.90 3ir2 h ALA 321 Cb 0.87 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3ir2 h ALA 321 CO 0.00 0.06 0.19 1.96 0.00 0.00 0.00 179.25 181.46 3ir2 h GLN 322 N 0.66 0.38 -0.81 0.00 4.20 -1.89 -2.04 115.11 115.61 3ir2 h GLN 322 Ca 0.18 -0.02 0.12 0.00 0.06 0.00 0.00 58.65 58.99 3ir2 h GLN 322 Cb -0.06 -0.09 -0.08 0.00 0.30 0.00 0.00 27.48 27.55 3ir2 h GLN 322 CO -0.05 0.25 0.43 1.49 -0.67 0.00 0.00 178.83 180.29 3ir2 h GLU 323 N 0.39 0.67 -0.46 1.46 4.81 -1.73 -0.86 114.58 118.86 3ir2 h GLU 323 Ca 0.15 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 3ir2 h GLU 323 Cb 0.04 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 3ir2 h GLU 323 CO -0.09 0.44 0.19 0.78 -0.73 0.00 0.00 179.01 179.60 3ir2 h GLY 324 N 0.69 0.73 0.99 1.92 0.00 -0.66 0.59 103.07 107.33 3ir2 h GLY 324 Ca 0.42 -0.39 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 3ir2 h GLY 324 CO -0.30 0.37 0.11 1.41 0.00 0.00 0.00 176.54 178.13 3ir2 h LEU 325 N 0.60 0.82 -0.87 3.11 3.38 -0.86 -0.46 115.31 121.02 3ir2 h LEU 325 Ca 0.15 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3ir2 h LEU 325 Cb 0.18 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3ir2 h LEU 325 CO -0.01 0.86 0.10 0.03 0.09 0.00 0.00 178.44 179.50 3ir2 h ARG 326 N 0.75 0.93 -0.36 1.13 3.08 -0.90 -0.63 114.38 118.38 3ir2 h ARG 326 Ca 0.16 -0.23 -0.12 0.00 0.07 0.00 0.00 59.98 59.87 3ir2 h ARG 326 Cb 0.37 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3ir2 h ARG 326 CO 0.01 0.86 -0.25 1.15 -1.07 0.00 0.00 179.97 180.67 3ir2 h THR 327 N 0.88 1.27 -0.36 2.04 2.02 -0.73 -1.09 112.91 116.94 3ir2 h THR 327 Ca 0.18 -1.36 -0.10 0.00 0.77 0.00 0.00 66.41 65.91 3ir2 h THR 327 Cb 0.38 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 3ir2 h THR 327 CO 0.01 0.45 -0.15 0.25 0.37 0.00 0.00 175.52 176.45 3ir2 h LEU 328 N 0.63 0.76 -0.53 2.58 5.85 -0.85 -2.19 115.31 121.56 3ir2 h LEU 328 Ca 0.08 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 3ir2 h LEU 328 Cb 0.75 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 3ir2 h LEU 328 CO 0.06 0.98 0.20 0.00 -0.34 0.00 0.00 178.44 179.34 3ir2 h ALA 329 N 0.80 0.68 -0.25 1.25 0.00 -1.06 -2.14 119.26 118.55 3ir2 h ALA 329 Ca 0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3ir2 h ALA 329 Cb 0.68 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3ir2 h ALA 329 CO 0.05 0.30 0.02 1.05 0.00 0.00 0.00 179.25 180.67 3ir2 h GLU 330 N 0.71 0.36 0.00 0.00 -0.00 -1.12 0.95 114.58 115.47 3ir2 h GLU 330 Ca 0.17 -0.06 0.00 0.00 -0.00 0.00 0.00 59.36 59.48 3ir2 h GLU 330 Cb 0.21 -0.06 0.00 0.00 -0.00 0.00 0.00 28.75 28.90 3ir2 h GLU 330 CO -0.01 0.38 0.00 0.00 -0.00 0.00 0.00 179.01 179.37 3ir2 n ALA 331 N -2.49 2.48 0.00 1.06 0.00 -0.83 -4.88 120.51 115.85 3ir2 n ALA 331 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3ir2 n ALA 331 Cb 0.19 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.24 3ir2 n ALA 331 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ir2 n GLY 332 N 0.63 0.65 3.77 0.00 0.00 0.33 -4.67 105.19 105.90 3ir2 n GLY 332 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 3ir2 n GLY 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ir2 s ALA 333 N -2.00 3.08 -0.39 4.61 0.00 -0.83 -4.70 121.76 121.54 3ir2 s ALA 333 Ca 0.00 1.07 -0.13 0.00 0.00 0.00 0.00 51.96 52.89 3ir2 s ALA 333 Cb 0.00 -3.43 0.02 0.00 0.00 0.00 0.00 23.12 19.71 3ir2 s ALA 333 CO 0.00 -0.74 0.26 0.15 0.00 0.00 0.00 175.76 175.43 3ir2 s LYS 334 N -2.48 3.00 -0.17 0.00 1.02 -0.18 -4.40 119.74 116.54 3ir2 s LYS 334 Ca 0.61 -0.98 -0.08 0.00 0.02 0.00 0.00 55.97 55.54 3ir2 s LYS 334 Cb -0.33 -3.88 -0.04 0.00 -0.52 0.00 0.00 37.83 33.06 3ir2 s LYS 334 CO 0.41 -0.69 0.09 0.42 -0.92 0.00 0.00 175.35 174.66 3ir2 s ILE 335 N 1.65 5.06 0.19 2.17 1.01 -1.26 -0.65 121.20 129.37 3ir2 s ILE 335 Ca 0.04 0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.65 3ir2 s ILE 335 Cb -0.19 -3.26 -0.01 0.00 0.01 0.00 0.00 42.46 39.01 3ir2 s ILE 335 CO 0.09 0.50 0.34 -0.94 0.00 0.00 0.00 174.94 174.93 3ir2 s SER 336 N -0.03 -0.01 -0.12 3.58 1.04 -0.20 -4.98 113.70 112.98 3ir2 s SER 336 Ca 0.08 -0.90 -0.12 0.00 0.48 0.00 0.00 55.95 55.49 3ir2 s SER 336 Cb -0.12 0.48 -0.05 0.00 0.10 0.00 0.00 66.02 66.43 3ir2 s SER 336 CO 0.00 -0.96 0.27 -0.63 0.98 0.00 0.00 173.24 172.90 3ir2 s ILE 337 N -3.99 5.30 0.23 -1.02 -1.09 -1.26 -1.49 121.20 117.88 3ir2 s ILE 337 Ca 0.20 0.51 -0.31 0.00 -2.23 0.00 0.00 60.65 58.81 3ir2 s ILE 337 Cb 0.02 -3.58 -0.12 0.00 -1.58 0.00 0.00 42.46 37.20 3ir2 s ILE 337 CO 0.03 0.49 1.67 -0.04 -1.23 0.00 0.00 174.94 175.87 3ir2 s MET 338 N -0.25 4.13 0.56 2.79 -1.94 -0.21 -4.80 119.30 119.58 3ir2 s MET 338 Ca 0.17 2.58 0.05 0.00 -1.71 0.00 0.00 55.69 56.79 3ir2 s MET 338 Cb -0.13 -3.07 0.05 0.00 2.01 0.00 0.00 34.83 33.69 3ir2 s MET 338 CO 0.06 -0.71 0.44 0.95 -0.01 0.00 0.00 175.02 175.75 3ir2 s THR 339 N 0.84 1.58 0.26 2.05 -4.23 -1.26 -4.79 115.64 110.08 3ir2 s THR 339 Ca 0.71 -1.46 -0.06 0.00 -1.18 0.00 0.00 61.69 59.70 3ir2 s THR 339 Cb -0.49 -2.04 0.30 0.00 1.34 0.00 0.00 72.50 71.62 3ir2 s THR 339 CO 0.36 0.00 1.62 0.22 -0.54 0.00 0.00 174.62 176.29 3ir2 h TYR 340 N 0.66 -0.07 -0.16 3.99 3.20 -1.95 -0.30 116.97 122.34 3ir2 h TYR 340 Ca -0.36 0.06 -0.08 0.00 3.14 0.00 0.00 58.73 61.50 3ir2 h TYR 340 Cb 1.31 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.72 3ir2 h TYR 340 CO 0.99 -0.27 -0.23 0.77 -1.64 0.00 0.00 178.16 177.78 3ir2 h SER 341 N 0.09 0.29 -0.23 -2.11 0.02 -1.98 0.41 113.55 110.04 3ir2 h SER 341 Ca 0.44 -0.08 -0.19 0.00 -0.84 0.00 0.00 61.79 61.12 3ir2 h SER 341 Cb 0.79 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.26 3ir2 h SER 341 CO -0.72 0.53 -0.59 -0.33 -1.14 0.00 0.00 176.83 174.59 3ir2 h GLU 342 N 0.26 0.80 -0.43 3.45 3.07 -1.47 0.18 114.58 120.43 3ir2 h GLU 342 Ca 0.04 -0.55 -0.03 0.00 -0.50 0.00 0.00 59.36 58.32 3ir2 h GLU 342 Cb 0.56 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.54 3ir2 h GLU 342 CO 0.04 1.18 0.17 0.74 -1.40 0.00 0.00 179.01 179.74 3ir2 h PHE 343 N 0.54 0.67 -0.34 4.33 -1.00 -0.93 -0.38 116.94 119.83 3ir2 h PHE 343 Ca -0.01 -0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.72 3ir2 h PHE 343 Cb 1.20 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 40.55 3ir2 h PHE 343 CO 0.08 0.58 0.21 -0.22 -1.61 0.00 0.00 178.31 177.35 3ir2 h LYS 344 N 0.56 0.46 -0.53 1.51 3.11 -0.85 -0.96 116.57 119.88 3ir2 h LYS 344 Ca 0.14 -0.04 -0.01 0.00 -2.81 0.00 0.00 60.65 57.93 3ir2 h LYS 344 Cb 0.20 -0.10 -0.02 0.00 -1.00 0.00 0.00 32.23 31.31 3ir2 h LYS 344 CO -0.01 0.35 0.28 1.25 -2.81 0.00 0.00 179.45 178.51 3ir2 h HIS 345 N 0.44 0.73 -0.66 1.91 2.76 -0.43 -1.34 115.15 118.57 3ir2 h HIS 345 Ca 0.12 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 3ir2 h HIS 345 Cb 0.01 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 28.70 3ir2 h HIS 345 CO -0.04 0.55 0.36 0.00 -1.30 0.00 0.00 177.93 177.49 3ir2 h TRP 347 N 0.90 -0.41 -0.75 0.00 2.91 -0.85 0.16 115.95 117.92 3ir2 h TRP 347 Ca 0.23 -0.00 0.07 0.00 1.13 0.00 0.00 58.89 60.32 3ir2 h TRP 347 Cb 0.05 0.15 -0.05 0.00 -0.51 0.00 0.00 29.16 28.80 3ir2 h TRP 347 CO -0.01 -0.24 0.49 -0.44 -1.03 0.00 0.00 178.44 177.21 3ir2 h ASP 348 N -0.38 0.69 0.09 2.65 3.32 -1.10 -2.65 116.42 119.03 3ir2 h ASP 348 Ca -0.02 0.01 -0.37 0.00 0.02 0.00 0.00 57.03 56.67 3ir2 h ASP 348 Cb 0.33 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 3ir2 h ASP 348 CO 0.00 0.44 -2.24 0.41 -1.72 0.00 0.00 179.24 176.14 3ir2 n THR 349 N -4.48 1.59 0.27 0.35 -1.04 -0.31 -4.63 114.28 106.04 3ir2 n THR 349 Ca 0.11 -0.65 0.04 0.00 -2.04 0.00 0.00 64.05 61.51 3ir2 n THR 349 Cb 0.24 -1.39 -0.05 0.00 -1.82 0.00 0.00 70.33 67.31 3ir2 n THR 349 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3ir2 n PHE 350 N -3.26 0.00 -3.82 -1.42 3.01 0.55 -5.02 117.46 107.50 3ir2 n PHE 350 Ca -0.37 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 57.75 3ir2 n PHE 350 Cb 1.03 -0.04 -0.05 0.00 -0.01 0.00 0.00 39.48 40.41 3ir2 n PHE 350 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3ir2 s VAL 351 N -1.91 5.35 -1.38 -4.37 1.01 -1.00 -0.80 120.40 117.30 3ir2 s VAL 351 Ca 0.02 -0.00 -0.12 0.00 0.00 0.00 0.00 61.98 61.87 3ir2 s VAL 351 Cb 0.06 -3.56 0.10 0.00 0.00 0.00 0.00 36.38 32.97 3ir2 s VAL 351 CO 0.32 0.31 2.08 -0.67 0.00 0.00 0.00 175.10 177.14 3ir2 n ASP 352 N 0.92 4.45 0.08 3.32 4.64 0.14 -4.73 116.55 125.37 3ir2 n ASP 352 Ca -0.10 -2.96 0.13 0.00 -1.38 0.00 0.00 54.79 50.48 3ir2 n ASP 352 Cb 0.53 -1.58 0.35 0.00 -1.04 0.00 0.00 41.12 39.38 3ir2 n ASP 352 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3ir2 n HIS 353 N 5.08 0.72 -4.08 -0.67 1.44 -1.26 -4.65 115.22 111.80 3ir2 n HIS 353 Ca 0.47 0.21 -0.32 0.00 -2.01 0.00 0.00 57.72 56.06 3ir2 n HIS 353 Cb 0.38 -0.80 -0.01 0.00 0.12 0.00 0.00 29.99 29.68 3ir2 n HIS 353 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 3ir2 n GLN 354 N -2.13 -3.86 0.00 -1.40 1.13 -1.26 -1.11 117.38 108.75 3ir2 n GLN 354 Ca 0.05 0.44 0.00 0.00 -1.94 0.00 0.00 57.00 55.55 3ir2 n GLN 354 Cb 0.42 -5.09 0.00 0.00 0.11 0.00 0.00 30.24 25.68 3ir2 n GLN 354 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ir2 n GLY 355 N -1.59 2.45 3.76 1.08 0.00 -1.26 -5.04 105.19 104.59 3ir2 n GLY 355 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3ir2 n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ir2 s ALA 356 N -2.23 3.51 0.53 4.61 0.00 -0.27 -5.00 121.76 122.92 3ir2 s ALA 356 Ca 0.00 1.24 -0.07 0.00 0.00 0.00 0.00 51.96 53.13 3ir2 s ALA 356 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 3ir2 s ALA 356 CO 0.00 -0.63 0.87 -1.25 0.00 0.00 0.00 175.76 174.76 3ir2 s PRO 357 N -1.42 3.52 0.32 0.00 0.04 -1.26 -4.84 135.00 131.34 3ir2 s PRO 357 Ca 0.51 0.36 -0.29 0.00 0.04 0.00 0.00 61.00 61.62 3ir2 s PRO 357 Cb -0.39 -2.27 -0.11 0.00 0.04 0.00 0.00 34.50 31.76 3ir2 s PRO 357 CO 0.50 -0.36 1.51 0.12 0.04 0.00 0.00 177.00 178.81 3ir2 s PHE 358 N -2.90 2.77 -0.30 0.56 5.36 -1.26 -4.99 117.98 117.22 3ir2 s PHE 358 Ca 0.50 1.00 0.03 0.00 -0.96 0.00 0.00 56.93 57.51 3ir2 s PHE 358 Cb -0.11 -3.98 0.08 0.00 -0.34 0.00 0.00 43.02 38.67 3ir2 s PHE 358 CO 0.48 -3.10 -0.03 -0.65 -1.46 0.00 0.00 175.22 170.45 3ir2 s GLN 359 N -1.09 1.87 0.42 10.12 -1.52 -1.26 -5.10 119.66 123.09 3ir2 s GLN 359 Ca 0.58 -1.61 -0.25 0.00 -1.95 0.00 0.00 55.36 52.14 3ir2 s GLN 359 Cb -0.46 -3.05 -0.08 0.00 -0.22 0.00 0.00 33.01 29.21 3ir2 s GLN 359 CO 0.52 -0.75 1.20 -1.25 -0.25 0.00 0.00 175.29 174.77 3ir2 s PRO 360 N 1.00 3.94 0.46 2.91 0.04 -1.26 -5.03 135.00 137.06 3ir2 s PRO 360 Ca 0.01 1.90 -0.03 0.00 0.04 0.00 0.00 61.00 62.91 3ir2 s PRO 360 Cb -0.20 -2.62 -0.03 0.00 0.04 0.00 0.00 34.50 31.70 3ir2 s PRO 360 CO -0.06 -0.44 0.73 1.67 0.04 0.00 0.00 177.00 178.94 3ir2 s TRP 361 N -1.41 3.47 0.34 0.56 -2.14 -1.26 -5.04 118.94 113.47 3ir2 s TRP 361 Ca 0.59 0.62 -0.29 0.00 2.66 0.00 0.00 56.10 59.69 3ir2 s TRP 361 Cb -0.32 -2.26 -0.11 0.00 -3.10 0.00 0.00 33.47 27.67 3ir2 s TRP 361 CO 0.40 -0.26 1.52 -0.25 -2.66 0.00 0.00 176.95 175.69 3ir2 n ASP 362 N -2.18 3.75 0.00 -2.66 8.00 -1.26 -2.52 116.55 119.68 3ir2 n ASP 362 Ca -0.00 1.19 0.00 0.00 0.71 0.00 0.00 54.79 56.69 3ir2 n ASP 362 Cb 0.56 -1.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.06 3ir2 n ASP 362 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ir2 n GLY 363 N 1.16 0.49 0.24 0.44 0.00 -1.26 -4.93 105.19 101.33 3ir2 n GLY 363 Ca 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 3ir2 n GLY 363 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ir2 h LEU 364 N 0.00 -0.65 -0.72 0.99 6.46 -1.90 -1.28 115.31 118.21 3ir2 h LEU 364 Ca 0.00 0.14 -0.10 0.00 -0.12 0.00 0.00 57.88 57.80 3ir2 h LEU 364 Cb 0.17 0.34 -0.02 0.00 -0.73 0.00 0.00 40.66 40.42 3ir2 h LEU 364 CO 0.00 -0.23 -0.09 0.44 -0.62 0.00 0.00 178.44 177.94 3ir2 h ASP 365 N -0.15 0.88 -0.44 1.25 3.32 -1.92 -2.13 116.42 117.23 3ir2 h ASP 365 Ca 0.17 -0.27 -0.15 0.00 0.02 0.00 0.00 57.03 56.81 3ir2 h ASP 365 Cb 0.41 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3ir2 h ASP 365 CO -0.42 0.99 -0.29 -0.33 -1.72 0.00 0.00 179.24 177.46 3ir2 h GLU 366 N 0.80 0.98 -0.50 3.56 3.07 -1.83 -1.33 114.58 119.33 3ir2 h GLU 366 Ca 0.13 -0.46 -0.12 0.00 -0.50 0.00 0.00 59.36 58.41 3ir2 h GLU 366 Cb 0.60 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.49 3ir2 h GLU 366 CO 0.04 1.13 -0.16 0.45 -1.40 0.00 0.00 179.01 179.07 3ir2 h HIS 367 N 0.82 1.12 -0.50 4.33 3.86 -1.22 -1.13 115.15 122.43 3ir2 h HIS 367 Ca 0.09 -0.25 0.01 0.00 -1.16 0.00 0.00 60.37 59.06 3ir2 h HIS 367 Cb 0.88 -0.27 -0.03 0.00 1.06 0.00 0.00 27.41 29.05 3ir2 h HIS 367 CO 0.06 1.06 0.32 1.03 0.86 0.00 0.00 177.93 181.26 3ir2 h SER 368 N 0.87 0.54 -0.66 2.45 0.87 -1.26 -0.88 113.55 115.48 3ir2 h SER 368 Ca 0.12 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.61 3ir2 h SER 368 Cb 0.73 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.54 3ir2 h SER 368 CO 0.06 0.39 0.14 1.56 -0.53 0.00 0.00 176.83 178.45 3ir2 h GLN 369 N 0.65 1.07 0.21 2.24 4.20 -1.03 -0.76 115.11 121.69 3ir2 h GLN 369 Ca 0.19 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 3ir2 h GLN 369 Cb -0.04 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.60 3ir2 h GLN 369 CO -0.06 0.97 -0.10 0.22 -0.67 0.00 0.00 178.83 179.19 3ir2 h ASP 370 N 0.99 -0.24 -0.51 1.46 1.82 -0.94 -2.27 116.42 116.73 3ir2 h ASP 370 Ca 0.20 -0.05 0.02 0.00 -0.39 0.00 0.00 57.03 56.81 3ir2 h ASP 370 Cb 0.39 0.06 -0.03 0.00 0.68 0.00 0.00 39.33 40.44 3ir2 h ASP 370 CO 0.01 -0.10 0.34 -0.07 -1.61 0.00 0.00 179.24 177.80 3ir2 h LEU 371 N -0.35 0.55 -0.37 2.28 3.38 -1.06 -0.90 115.31 118.84 3ir2 h LEU 371 Ca -0.03 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3ir2 h LEU 371 Cb 0.27 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3ir2 h LEU 371 CO 0.05 0.39 0.09 -1.28 0.09 0.00 0.00 178.44 177.77 3ir2 h SER 372 N 0.64 0.56 -0.79 -0.43 0.87 -0.89 0.12 113.55 113.62 3ir2 h SER 372 Ca 0.19 -0.24 -0.04 0.00 -1.23 0.00 0.00 61.79 60.48 3ir2 h SER 372 Cb -0.00 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 61.77 3ir2 h SER 372 CO -0.05 0.65 0.36 1.23 -0.53 0.00 0.00 176.83 178.49 3ir2 h GLY 373 N 0.44 1.25 1.00 5.77 0.00 -0.97 -2.03 103.07 108.53 3ir2 h GLY 373 Ca 0.11 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 3ir2 h GLY 373 CO 0.00 0.61 0.33 3.21 0.00 0.00 0.00 176.54 180.69 3ir2 h ARG 374 N 1.15 0.96 -0.70 4.80 3.08 -0.75 -2.03 114.38 120.88 3ir2 h ARG 374 Ca 0.27 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 3ir2 h ARG 374 Cb 0.16 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 3ir2 h ARG 374 CO -0.03 0.76 0.23 1.25 -1.07 0.00 0.00 179.97 181.11 3ir2 h LEU 375 N 0.93 1.01 -0.39 3.04 5.85 -0.68 -1.57 115.31 123.51 3ir2 h LEU 375 Ca 0.23 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.79 3ir2 h LEU 375 Cb 0.11 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 3ir2 h LEU 375 CO -0.03 0.95 0.16 0.03 -0.34 0.00 0.00 178.44 179.21 3ir2 h ARG 376 N 1.03 0.33 -0.74 1.25 3.08 -1.15 -1.00 114.38 117.18 3ir2 h ARG 376 Ca 0.23 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.26 3ir2 h ARG 376 Cb 0.29 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 3ir2 h ARG 376 CO -0.01 0.22 0.45 0.00 -1.07 0.00 0.00 179.97 179.56 3ir2 h ALA 377 N 1.23 0.94 -0.15 0.04 0.00 -1.06 -0.18 119.26 120.09 3ir2 h ALA 377 Ca 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3ir2 h ALA 377 Cb 0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3ir2 h ALA 377 CO -0.15 0.41 0.08 0.82 0.00 0.00 0.00 179.25 180.41 3ir2 h ILE 378 N 1.01 1.08 0.00 0.00 2.04 -0.88 -2.16 117.51 118.60 3ir2 h ILE 378 Ca 0.27 -0.22 -0.08 0.00 1.00 0.00 0.00 64.86 65.83 3ir2 h ILE 378 Cb -0.05 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 3ir2 h ILE 378 CO -0.05 0.08 -0.36 -0.07 0.00 0.00 0.00 178.15 177.75 3ir2 h LEU 379 N 0.15 0.00 0.11 1.44 4.07 -0.93 -2.89 115.31 117.26 3ir2 h LEU 379 Ca 0.05 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.76 3ir2 h LEU 379 Cb 0.05 0.00 0.03 0.00 1.08 0.00 0.00 40.66 41.82 3ir2 h LEU 379 CO -0.01 0.36 -1.06 1.56 -1.08 0.00 0.00 178.44 178.21 3ir2 h GLN 380 N 0.00 0.52 0.00 1.13 7.50 -1.05 -3.49 115.11 119.71 3ir2 h GLN 380 Ca -0.00 -0.71 0.00 0.00 0.50 0.00 0.00 58.65 58.43 3ir2 h GLN 380 Cb 1.02 0.24 0.00 0.00 0.05 0.00 0.00 27.48 28.79 3ir2 h GLN 380 CO 0.05 1.31 0.00 0.27 -1.50 0.00 0.00 178.83 178.96