#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u41 s LYS 249 N 0.00 0.50 -0.33 3.23 2.20 -1.26 -4.27 119.74 119.81 1u41 s LYS 249 Ca 0.00 1.24 -0.23 0.00 -0.36 0.00 0.00 55.97 56.62 1u41 s LYS 249 Cb 0.00 0.54 0.00 0.00 -1.51 0.00 0.00 37.83 36.87 1u41 s LYS 249 CO 0.00 -0.21 0.78 0.42 -0.36 0.00 0.00 175.35 175.98 1u41 s ILE 250 N 2.53 4.78 -0.13 5.43 1.01 -1.26 -1.39 121.20 132.17 1u41 s ILE 250 Ca -0.05 1.05 -0.25 0.00 0.00 0.00 0.00 60.65 61.40 1u41 s ILE 250 Cb -0.11 -4.16 -0.26 0.00 0.01 0.00 0.00 42.46 37.94 1u41 s ILE 250 CO -0.17 -0.31 0.70 0.58 0.00 0.00 0.00 174.94 175.73 1u41 h VAL 251 N 5.66 1.54 -2.66 2.92 2.07 -1.16 -3.49 116.25 121.12 1u41 h VAL 251 Ca -0.25 -2.37 0.06 0.00 0.82 0.00 0.00 66.70 64.96 1u41 h VAL 251 Cb 1.10 3.12 -0.12 0.00 -1.52 0.00 0.00 31.29 33.87 1u41 h VAL 251 CO 0.89 0.60 0.35 0.00 0.02 0.00 0.00 177.57 179.43 1u41 s ARG 252 N -2.31 1.15 -0.03 1.57 1.70 -1.12 -5.02 118.95 114.89 1u41 s ARG 252 Ca -0.19 -0.48 0.01 0.00 -0.47 0.00 0.00 55.73 54.60 1u41 s ARG 252 Cb -0.00 0.49 0.01 0.00 -0.57 0.00 0.00 34.95 34.89 1u41 s ARG 252 CO 0.71 -0.51 -0.04 -1.64 -1.08 0.00 0.00 175.30 172.74 1u41 s MET 253 N -3.48 0.62 0.55 3.89 -1.94 -1.26 -0.77 119.30 116.91 1u41 s MET 253 Ca 0.05 -0.11 0.22 0.00 -1.71 0.00 0.00 55.69 54.14 1u41 s MET 253 Cb -0.02 -0.65 1.50 0.00 2.01 0.00 0.00 34.83 37.67 1u41 s MET 253 CO -0.08 -0.02 2.19 0.38 -0.01 0.00 0.00 175.02 177.48 1u41 h ASP 254 N 6.80 0.00 -3.79 3.03 2.03 -1.52 -3.41 116.42 119.56 1u41 h ASP 254 Ca -0.36 0.00 -0.30 0.00 -0.73 0.00 0.00 57.03 55.63 1u41 h ASP 254 Cb 1.16 0.00 -0.29 0.00 -0.83 0.00 0.00 39.33 39.37 1u41 h ASP 254 CO 0.48 0.00 -0.74 -0.13 -1.03 0.00 0.00 179.24 177.82 1u41 s ARG 255 N -4.89 0.30 -0.19 4.15 1.81 -1.26 -5.04 118.95 113.83 1u41 s ARG 255 Ca -0.05 -0.10 0.12 0.00 -1.72 0.00 0.00 55.73 53.98 1u41 s ARG 255 Cb 0.16 -0.32 0.42 0.00 -0.45 0.00 0.00 34.95 34.76 1u41 s ARG 255 CO 0.62 0.04 1.21 0.25 -0.68 0.00 0.00 175.30 176.75 1u41 n THR 256 N 3.17 2.00 -3.55 0.02 -2.24 -1.26 -4.96 114.28 107.46 1u41 n THR 256 Ca -0.15 -3.03 -0.12 0.00 -2.27 0.00 0.00 64.05 58.48 1u41 n THR 256 Cb 0.57 -0.12 -0.05 0.00 -2.10 0.00 0.00 70.33 68.64 1u41 n THR 256 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u41 s ALA 257 N -2.93 -1.86 0.20 6.98 0.00 -1.26 -1.81 121.76 121.08 1u41 s ALA 257 Ca 0.38 1.39 -0.11 0.00 0.00 0.00 0.00 51.96 53.62 1u41 s ALA 257 Cb 0.37 -0.30 0.04 0.00 0.00 0.00 0.00 23.12 23.23 1u41 s ALA 257 CO -0.08 -0.40 0.57 0.41 0.00 0.00 0.00 175.76 176.26 1u41 n GLY 258 N 0.59 1.15 3.76 0.00 0.00 -0.43 -4.96 105.19 105.30 1u41 n GLY 258 Ca -0.12 -1.13 -0.40 0.00 0.00 0.00 0.00 46.02 44.36 1u41 n GLY 258 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u41 h VAL 260 N 3.12 0.12 0.00 0.00 -1.51 -1.69 -1.88 116.25 114.41 1u41 h VAL 260 Ca -0.47 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 64.93 1u41 h VAL 260 Cb 1.22 0.54 -0.01 0.00 -2.13 0.00 0.00 31.29 30.91 1u41 h VAL 260 CO 0.67 0.00 -0.32 0.71 -1.23 0.00 0.00 177.57 177.40 1u41 h THR 261 N 0.00 1.05 -0.01 7.19 1.35 -1.90 0.14 112.91 120.74 1u41 h THR 261 Ca 0.09 -1.18 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 1u41 h THR 261 Cb 1.10 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 1u41 h THR 261 CO -0.00 0.32 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 1u41 n GLY 262 N -0.37 -2.06 2.61 5.82 0.00 -0.71 -4.17 105.19 106.31 1u41 n GLY 262 Ca -0.02 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1u41 n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u41 n GLY 263 N 0.00 0.65 3.74 -0.02 0.00 0.82 -4.90 105.19 105.49 1u41 n GLY 263 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1u41 n GLY 263 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u41 s GLU 264 N -0.19 4.28 0.15 1.61 2.02 -1.26 -4.68 118.70 120.63 1u41 s GLU 264 Ca 0.00 0.50 -0.30 0.00 0.02 0.00 0.00 54.97 55.18 1u41 s GLU 264 Cb 0.00 -3.39 -0.08 0.00 0.10 0.00 0.00 34.13 30.76 1u41 s GLU 264 CO 0.00 0.27 1.30 -2.00 0.02 0.00 0.00 175.26 174.85 1u41 s GLU 265 N 0.25 4.39 0.00 1.61 2.12 -1.26 -1.04 118.70 124.77 1u41 s GLU 265 Ca 0.27 1.99 0.04 0.00 0.36 0.00 0.00 54.97 57.63 1u41 s GLU 265 Cb -0.16 -3.24 -0.01 0.00 0.26 0.00 0.00 34.13 30.98 1u41 s GLU 265 CO 0.12 -0.29 -0.13 0.42 -0.54 0.00 0.00 175.26 174.84 1u41 s ILE 266 N 0.53 1.06 -0.25 -3.70 1.01 0.17 -4.98 121.20 115.04 1u41 s ILE 266 Ca 0.59 -0.67 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 1u41 s ILE 266 Cb -0.35 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 1u41 s ILE 266 CO 0.34 0.23 0.13 -0.31 0.00 0.00 0.00 174.94 175.33 1u41 s TYR 267 N -0.44 3.19 -0.13 3.97 1.51 -1.26 -1.19 117.35 123.01 1u41 s TYR 267 Ca 0.04 -0.05 0.02 0.00 -1.01 0.00 0.00 57.07 56.07 1u41 s TYR 267 Cb -0.06 -2.28 -0.00 0.00 -0.11 0.00 0.00 41.96 39.51 1u41 s TYR 267 CO -0.00 -0.16 -0.19 -1.17 -1.11 0.00 0.00 175.55 172.92 1u41 s LEU 268 N 1.45 2.36 -0.16 -1.29 0.20 0.15 -1.12 118.68 120.28 1u41 s LEU 268 Ca 0.06 -0.48 -0.06 0.00 0.69 0.00 0.00 54.13 54.35 1u41 s LEU 268 Cb -0.15 -1.51 -0.04 0.00 -0.43 0.00 0.00 46.19 44.07 1u41 s LEU 268 CO 0.06 0.13 0.03 -0.76 -0.29 0.00 0.00 176.35 175.53 1u41 s LEU 269 N 0.53 3.66 0.17 -0.68 1.43 0.05 -0.15 118.68 123.71 1u41 s LEU 269 Ca -0.12 0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.03 1u41 s LEU 269 Cb -0.16 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 1u41 s LEU 269 CO 0.04 0.22 0.09 0.00 0.23 0.00 0.00 176.35 176.92 1u41 s ASP 271 N -3.13 2.19 -0.25 0.00 -0.00 -0.49 -4.47 116.67 110.53 1u41 s ASP 271 Ca 0.32 0.41 -0.36 0.00 -0.00 0.00 0.00 52.55 52.91 1u41 s ASP 271 Cb 0.07 -0.53 -0.13 0.00 -0.00 0.00 0.00 42.92 42.33 1u41 s ASP 271 CO 0.07 -3.32 1.95 1.17 -0.00 0.00 0.00 175.17 175.05 1u41 n LYS 272 N -4.19 1.45 -4.29 8.23 3.00 -1.25 -4.66 118.16 116.45 1u41 n LYS 272 Ca 0.14 0.49 -0.18 0.00 -0.00 0.00 0.00 58.31 58.76 1u41 n LYS 272 Cb 0.59 -2.42 -0.11 0.00 0.00 0.00 0.00 35.03 33.10 1u41 n LYS 272 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1u41 s VAL 273 N 5.13 1.53 -0.19 3.15 -7.23 -0.30 -4.93 120.40 117.56 1u41 s VAL 273 Ca 1.01 -1.94 -0.09 0.00 -1.81 0.00 0.00 61.98 59.15 1u41 s VAL 273 Cb -0.87 -1.78 -0.05 0.00 0.56 0.00 0.00 36.38 34.25 1u41 s VAL 273 CO 0.55 -0.48 0.12 -1.58 -0.31 0.00 0.00 175.10 173.40 1u41 s GLN 274 N -3.10 4.06 0.35 4.82 2.00 -1.26 -4.50 119.66 122.03 1u41 s GLN 274 Ca 0.15 -0.23 0.05 0.00 -2.00 0.00 0.00 55.36 53.34 1u41 s GLN 274 Cb -0.03 -3.36 0.71 0.00 0.80 0.00 0.00 33.01 31.14 1u41 s GLN 274 CO 0.05 0.36 1.94 1.57 -0.50 0.00 0.00 175.29 178.70 1u41 h LYS 275 N 6.45 0.77 0.00 1.67 2.10 -1.95 -1.84 116.57 123.77 1u41 h LYS 275 Ca -0.42 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1u41 h LYS 275 Cb 1.16 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.32 1u41 h LYS 275 CO 0.73 0.51 -0.53 -0.25 -2.00 0.00 0.00 179.45 177.91 1u41 n ASP 276 N -4.49 0.55 -0.09 7.07 8.00 -1.26 -4.24 116.55 122.10 1u41 n ASP 276 Ca 0.12 -0.02 -0.13 0.00 0.71 0.00 0.00 54.79 55.47 1u41 n ASP 276 Cb 0.25 0.16 -0.15 0.00 -0.02 0.00 0.00 41.12 41.37 1u41 n ASP 276 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1u41 n ASP 277 N -1.78 0.78 -4.81 -2.24 2.03 -0.86 -4.94 116.55 104.72 1u41 n ASP 277 Ca 0.05 0.05 -0.34 0.00 0.52 0.00 0.00 54.79 55.07 1u41 n ASP 277 Cb 0.38 0.35 -0.06 0.00 -0.72 0.00 0.00 41.12 41.07 1u41 n ASP 277 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1u41 s ILE 278 N -2.52 4.24 0.12 5.18 1.10 -0.75 -1.51 121.20 127.06 1u41 s ILE 278 Ca -0.16 1.45 -0.10 0.00 -0.51 0.00 0.00 60.65 61.33 1u41 s ILE 278 Cb 0.07 -3.62 -0.00 0.00 0.15 0.00 0.00 42.46 39.06 1u41 s ILE 278 CO 0.77 -0.25 0.25 0.00 -2.11 0.00 0.00 174.94 173.61 1u41 s GLN 279 N -3.05 1.00 -0.23 3.50 -2.07 0.16 -4.93 119.66 114.05 1u41 s GLN 279 Ca 0.62 -1.02 0.02 0.00 -1.82 0.00 0.00 55.36 53.16 1u41 s GLN 279 Cb -0.12 0.37 0.04 0.00 -1.09 0.00 0.00 33.01 32.22 1u41 s GLN 279 CO 0.16 -0.35 -0.15 0.42 -1.32 0.00 0.00 175.29 174.05 1u41 s ILE 280 N -3.90 2.15 -0.22 3.63 1.01 -1.26 -0.84 121.20 121.76 1u41 s ILE 280 Ca 0.10 -1.33 -0.06 0.00 0.00 0.00 0.00 60.65 59.35 1u41 s ILE 280 Cb 0.04 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.37 1u41 s ILE 280 CO -0.06 0.21 0.04 -0.60 0.00 0.00 0.00 174.94 174.52 1u41 s ARG 281 N 1.19 3.65 -0.09 2.79 3.52 0.38 -0.89 118.95 129.49 1u41 s ARG 281 Ca -0.03 -0.49 -0.12 0.00 -0.13 0.00 0.00 55.73 54.95 1u41 s ARG 281 Cb -0.17 -3.20 -0.05 0.00 -1.56 0.00 0.00 34.95 29.97 1u41 s ARG 281 CO -0.08 -0.08 0.30 -0.06 -0.81 0.00 0.00 175.30 174.57 1u41 s PHE 282 N 1.28 3.60 0.18 5.12 0.40 0.87 -1.00 117.98 128.43 1u41 s PHE 282 Ca 0.04 0.73 -0.23 0.00 -0.60 0.00 0.00 56.93 56.87 1u41 s PHE 282 Cb -0.15 -2.22 0.07 0.00 0.51 0.00 0.00 43.02 41.23 1u41 s PHE 282 CO 0.02 0.52 0.98 1.52 0.70 0.00 0.00 175.22 178.96 1u41 s TYR 283 N -0.49 -0.04 0.13 0.36 1.13 -0.30 -0.79 117.35 117.35 1u41 s TYR 283 Ca 0.19 -0.34 0.00 0.00 -1.41 0.00 0.00 57.07 55.51 1u41 s TYR 283 Cb -0.14 0.68 0.00 0.00 -1.10 0.00 0.00 41.96 41.40 1u41 s TYR 283 CO 0.08 -0.92 0.00 -0.85 -2.51 0.00 0.00 175.55 171.34 1u41 n GLU 284 N -0.56 0.00 0.00 -3.49 0.28 -1.26 -1.01 120.64 114.60 1u41 n GLU 284 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.95 1u41 n GLU 284 Cb 0.60 -0.14 0.00 0.00 1.43 0.00 0.00 31.44 33.33 1u41 n GLU 284 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1u41 n VAL 291 N -3.10 0.00 -1.59 3.84 0.31 -1.26 -4.92 118.33 111.61 1u41 n VAL 291 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 1u41 n VAL 291 Cb 0.00 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.01 1u41 n VAL 291 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1u41 s TRP 292 N 0.00 2.00 -0.20 3.52 -0.00 -1.26 -5.06 118.94 117.95 1u41 s TRP 292 Ca 0.00 1.53 -0.23 0.00 -0.00 0.00 0.00 56.10 57.40 1u41 s TRP 292 Cb 0.00 -3.65 0.06 0.00 -0.00 0.00 0.00 33.47 29.88 1u41 s TRP 292 CO 0.00 -2.93 0.62 -2.00 -0.00 0.00 0.00 176.95 172.64 1u41 s GLU 293 N -3.55 0.78 0.03 5.86 2.12 -1.26 -4.52 118.70 118.15 1u41 s GLU 293 Ca 0.81 0.73 -0.01 0.00 0.36 0.00 0.00 54.97 56.85 1u41 s GLU 293 Cb -0.36 0.38 -0.03 0.00 0.26 0.00 0.00 34.13 34.38 1u41 s GLU 293 CO 0.42 -0.13 -0.01 0.20 -0.54 0.00 0.00 175.26 175.21 1u41 s GLY 294 N 0.03 0.30 -0.06 -1.50 0.00 0.03 -4.99 107.32 101.13 1u41 s GLY 294 Ca -0.02 -0.79 0.04 0.00 0.00 0.00 0.00 44.72 43.95 1u41 s GLY 294 CO 0.02 -0.88 -0.15 -1.36 0.00 0.00 0.00 173.10 170.73 1u41 s PHE 295 N -2.45 2.68 0.43 1.90 0.40 -1.26 -0.09 117.98 119.58 1u41 s PHE 295 Ca -0.07 -0.25 -0.26 0.00 -0.60 0.00 0.00 56.93 55.76 1u41 s PHE 295 Cb -0.03 -1.64 -0.09 0.00 0.51 0.00 0.00 43.02 41.78 1u41 s PHE 295 CO -0.04 0.12 1.38 0.20 0.70 0.00 0.00 175.22 177.57 1u41 s GLY 296 N -0.59 2.92 -0.27 4.36 0.00 -0.07 -3.97 107.32 109.69 1u41 s GLY 296 Ca 0.09 1.37 -0.12 0.00 0.00 0.00 0.00 44.72 46.06 1u41 s GLY 296 CO 0.01 1.97 0.22 -0.35 0.00 0.00 0.00 173.10 174.96 1u41 s ASP 297 N -0.59 6.08 -0.11 1.64 2.15 0.19 -4.68 116.67 121.35 1u41 s ASP 297 Ca 0.59 0.06 -0.30 0.00 0.43 0.00 0.00 52.55 53.33 1u41 s ASP 297 Cb -0.41 -2.14 0.12 0.00 -0.30 0.00 0.00 42.92 40.19 1u41 s ASP 297 CO 0.53 -0.07 0.98 0.72 -0.17 0.00 0.00 175.17 177.17 1u41 s PHE 298 N 1.76 -0.33 0.30 -5.34 -0.71 -1.26 -0.84 117.98 111.55 1u41 s PHE 298 Ca 0.09 0.41 0.07 0.00 -1.04 0.00 0.00 56.93 56.45 1u41 s PHE 298 Cb -0.16 0.49 -0.02 0.00 -1.21 0.00 0.00 43.02 42.12 1u41 s PHE 298 CO 0.10 -0.40 0.34 -1.54 -1.34 0.00 0.00 175.22 172.38 1u41 s SER 299 N -1.75 5.76 0.44 1.98 1.04 -1.26 -5.00 113.70 114.91 1u41 s SER 299 Ca 0.02 -0.23 0.19 0.00 0.48 0.00 0.00 55.95 56.41 1u41 s SER 299 Cb -0.01 -1.32 1.14 0.00 0.10 0.00 0.00 66.02 65.93 1u41 s SER 299 CO -0.03 -0.26 1.88 -0.65 0.98 0.00 0.00 173.24 175.16 1u41 h PRO 300 N 1.17 0.33 0.00 4.02 0.11 -1.97 0.23 132.00 135.89 1u41 h PRO 300 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1u41 h PRO 300 Cb 1.25 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1u41 h PRO 300 CO 0.58 0.22 0.00 0.25 -0.21 0.00 0.00 178.00 178.84 1u41 n THR 301 N -4.47 0.82 1.23 -1.15 -2.24 -1.26 -2.22 114.28 104.99 1u41 n THR 301 Ca 0.18 0.20 0.14 0.00 -2.27 0.00 0.00 64.05 62.30 1u41 n THR 301 Cb 0.70 -1.11 0.60 0.00 -2.10 0.00 0.00 70.33 68.42 1u41 n THR 301 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1u41 n ASP 302 N -2.19 0.21 -4.62 3.42 8.00 0.80 -4.67 116.55 117.50 1u41 n ASP 302 Ca 0.02 -0.09 -0.43 0.00 0.71 0.00 0.00 54.79 55.01 1u41 n ASP 302 Cb 0.24 -0.22 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 1u41 n ASP 302 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1u41 s VAL 303 N -2.73 4.51 -0.56 2.53 1.01 -0.94 -2.03 120.40 122.18 1u41 s VAL 303 Ca 0.22 1.50 -0.20 0.00 0.00 0.00 0.00 61.98 63.50 1u41 s VAL 303 Cb 0.19 -4.40 0.08 0.00 0.00 0.00 0.00 36.38 32.25 1u41 s VAL 303 CO 0.52 -0.54 0.72 -2.28 0.00 0.00 0.00 175.10 173.52 1u41 s HIS 304 N 3.65 2.97 -1.41 5.22 2.46 0.15 -4.47 115.29 123.87 1u41 s HIS 304 Ca 0.43 -0.69 0.00 0.00 0.47 0.00 0.00 55.06 55.27 1u41 s HIS 304 Cb -0.12 -3.86 0.00 0.00 -0.13 0.00 0.00 32.58 28.47 1u41 s HIS 304 CO 0.18 -1.24 0.00 0.54 -2.47 0.00 0.00 174.74 171.75 1u41 n ARG 305 N 6.50 -1.90 -0.95 2.88 5.12 -1.26 -1.35 116.66 125.70 1u41 n ARG 305 Ca -0.07 0.80 0.00 0.00 -1.93 0.00 0.00 57.85 56.64 1u41 n ARG 305 Cb 0.44 -5.37 0.00 0.00 -1.16 0.00 0.00 32.46 26.37 1u41 n ARG 305 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1u41 n GLN 306 N -2.76 -0.72 0.00 5.56 6.02 -1.26 -4.80 117.38 119.42 1u41 n GLN 306 Ca -0.18 0.18 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1u41 n GLN 306 Cb 0.62 -3.80 0.00 0.00 1.02 0.00 0.00 30.24 28.09 1u41 n GLN 306 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1u41 n PHE 307 N -2.44 0.00 -3.51 1.08 3.72 -0.45 -1.14 117.46 114.72 1u41 n PHE 307 Ca 0.00 -0.31 -0.11 0.00 -0.05 0.00 0.00 57.45 56.98 1u41 n PHE 307 Cb 0.18 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.66 1u41 n PHE 307 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1u41 s GLY 308 N -0.62 -0.47 -0.02 1.37 0.00 -1.10 -1.37 107.32 105.12 1u41 s GLY 308 Ca 0.00 1.19 0.00 0.00 0.00 0.00 0.00 44.72 45.92 1u41 s GLY 308 CO 0.00 0.55 -0.00 -0.42 0.00 0.00 0.00 173.10 173.23 1u41 s ILE 309 N -2.50 0.13 -0.25 0.90 1.01 0.79 0.33 121.20 121.60 1u41 s ILE 309 Ca 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 60.65 60.64 1u41 s ILE 309 Cb -0.01 -0.20 -0.02 0.00 0.01 0.00 0.00 42.46 42.23 1u41 s ILE 309 CO -0.05 0.11 0.06 -0.69 0.00 0.00 0.00 174.94 174.37 1u41 s VAL 310 N 0.71 4.22 0.19 2.92 1.01 -0.86 -0.68 120.40 127.91 1u41 s VAL 310 Ca -0.07 -0.23 -0.08 0.00 0.00 0.00 0.00 61.98 61.60 1u41 s VAL 310 Cb -0.10 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.28 1u41 s VAL 310 CO -0.01 0.33 0.30 0.72 0.00 0.00 0.00 175.10 176.43 1u41 s PHE 311 N 1.60 0.52 -0.07 5.22 -0.71 -0.33 -4.75 117.98 119.46 1u41 s PHE 311 Ca 0.06 -0.86 0.01 0.00 -1.04 0.00 0.00 56.93 55.10 1u41 s PHE 311 Cb -0.15 -0.09 -0.03 0.00 -1.21 0.00 0.00 43.02 41.54 1u41 s PHE 311 CO 0.03 -0.76 -0.06 0.15 -1.34 0.00 0.00 175.22 173.23 1u41 s LYS 312 N -4.01 2.76 0.49 1.99 1.02 -0.02 0.44 119.74 122.41 1u41 s LYS 312 Ca 0.22 -0.54 -0.21 0.00 0.02 0.00 0.00 55.97 55.45 1u41 s LYS 312 Cb 0.03 -2.60 -0.07 0.00 -0.52 0.00 0.00 37.83 34.67 1u41 s LYS 312 CO 0.04 0.67 1.15 0.95 -0.92 0.00 0.00 175.35 177.23 1u41 s THR 313 N -0.83 3.14 0.61 2.17 -4.23 -0.21 -0.63 115.64 115.67 1u41 s THR 313 Ca 0.13 0.80 -0.14 0.00 -1.18 0.00 0.00 61.69 61.29 1u41 s THR 313 Cb -0.11 -3.37 -0.03 0.00 1.34 0.00 0.00 72.50 70.33 1u41 s THR 313 CO 0.02 -0.07 1.04 -2.16 -0.54 0.00 0.00 174.62 172.91 1u41 s PRO 314 N -2.94 3.34 0.24 3.99 0.04 -1.25 -0.13 135.00 138.30 1u41 s PRO 314 Ca 0.67 1.07 -0.31 0.00 0.04 0.00 0.00 61.00 62.47 1u41 s PRO 314 Cb -0.26 -2.04 -0.11 0.00 0.04 0.00 0.00 34.50 32.12 1u41 s PRO 314 CO 0.31 -0.78 1.57 0.21 0.04 0.00 0.00 177.00 178.36 1u41 s LYS 315 N -4.40 4.17 0.86 4.56 2.20 -1.26 -4.20 119.74 121.68 1u41 s LYS 315 Ca 0.61 2.48 -0.11 0.00 -0.36 0.00 0.00 55.97 58.59 1u41 s LYS 315 Cb -0.14 -3.08 0.11 0.00 -1.51 0.00 0.00 37.83 33.22 1u41 s LYS 315 CO 0.42 -0.60 1.15 -0.47 -0.36 0.00 0.00 175.35 175.49 1u41 s TYR 316 N 0.41 1.86 0.54 4.03 5.04 0.50 -4.92 117.35 124.81 1u41 s TYR 316 Ca 0.66 1.72 0.23 0.00 -2.44 0.00 0.00 57.07 57.24 1u41 s TYR 316 Cb -0.46 -3.31 1.41 0.00 0.35 0.00 0.00 41.96 39.95 1u41 s TYR 316 CO 0.41 -2.59 2.05 1.57 -1.34 0.00 0.00 175.55 175.65 1u41 h LYS 317 N -1.51 0.00 -3.26 4.97 2.10 -1.95 -3.39 116.57 113.53 1u41 h LYS 317 Ca -0.44 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 57.69 1u41 h LYS 317 Cb 1.27 0.00 -0.40 0.00 -0.90 0.00 0.00 32.23 32.19 1u41 h LYS 317 CO 0.44 0.00 -0.76 0.34 -2.00 0.00 0.00 179.45 177.47 1u41 s ASP 318 N -6.35 3.16 0.00 7.07 2.15 -1.26 -5.02 116.67 116.42 1u41 s ASP 318 Ca -0.05 -1.05 0.02 0.00 0.43 0.00 0.00 52.55 51.91 1u41 s ASP 318 Cb 0.18 -0.51 0.14 0.00 -0.30 0.00 0.00 42.92 42.42 1u41 s ASP 318 CO 0.68 -0.37 0.89 1.33 -0.17 0.00 0.00 175.17 177.53 1u41 n VAL 319 N 5.11 0.00 -0.15 1.11 0.24 -1.26 -3.48 118.33 119.90 1u41 n VAL 319 Ca -0.07 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.26 1u41 n VAL 319 Cb 0.45 -0.15 0.06 0.00 -1.47 0.00 0.00 33.84 32.73 1u41 n VAL 319 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1u41 n ASN 320 N -0.54 2.33 -4.72 -1.34 3.02 -1.26 -4.54 115.26 108.20 1u41 n ASN 320 Ca 0.02 -2.10 -0.34 0.00 -0.03 0.00 0.00 54.58 52.12 1u41 n ASN 320 Cb 0.01 -0.11 0.09 0.00 -0.61 0.00 0.00 39.78 39.16 1u41 n ASN 320 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1u41 s ILE 321 N -1.18 2.29 -0.35 2.41 -4.36 -1.23 -4.94 121.20 113.85 1u41 s ILE 321 Ca 0.10 0.14 0.04 0.00 -0.26 0.00 0.00 60.65 60.67 1u41 s ILE 321 Cb 0.06 -2.74 -0.00 0.00 1.25 0.00 0.00 42.46 41.02 1u41 s ILE 321 CO 0.05 -0.07 0.39 0.35 0.24 0.00 0.00 174.94 175.90 1u41 n THR 322 N -2.65 0.00 -4.11 8.37 -2.24 -1.26 -4.57 114.28 107.81 1u41 n THR 322 Ca 0.14 -0.46 -0.09 0.00 -2.27 0.00 0.00 64.05 61.37 1u41 n THR 322 Cb 0.50 1.04 -0.10 0.00 -2.10 0.00 0.00 70.33 69.67 1u41 n THR 322 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1u41 s LYS 323 N -0.86 0.68 0.49 -0.78 -2.85 -1.26 -4.91 119.74 110.25 1u41 s LYS 323 Ca 0.03 -1.22 -0.24 0.00 -1.00 0.00 0.00 55.97 53.54 1u41 s LYS 323 Cb 0.03 0.04 -0.07 0.00 -2.06 0.00 0.00 37.83 35.78 1u41 s LYS 323 CO 0.10 -0.07 1.38 -2.14 0.10 0.00 0.00 175.35 174.72 1u41 s PRO 324 N -3.72 3.49 -0.14 1.78 0.02 -1.26 -4.63 135.00 130.54 1u41 s PRO 324 Ca 0.07 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.38 1u41 s PRO 324 Cb 0.06 -2.49 -0.01 0.00 0.02 0.00 0.00 34.50 32.08 1u41 s PRO 324 CO -0.07 -0.93 -0.14 0.00 -0.33 0.00 0.00 177.00 175.53 1u41 s ALA 325 N -1.26 2.56 -0.22 -1.55 0.00 -0.38 -4.99 121.76 115.92 1u41 s ALA 325 Ca 0.65 -0.97 -0.13 0.00 0.00 0.00 0.00 51.96 51.51 1u41 s ALA 325 Cb -0.41 -1.22 -0.04 0.00 0.00 0.00 0.00 23.12 21.44 1u41 s ALA 325 CO 0.51 0.11 0.29 0.45 0.00 0.00 0.00 175.76 177.12 1u41 s SER 326 N 0.59 6.29 0.23 0.00 0.15 -1.26 -1.60 113.70 118.11 1u41 s SER 326 Ca -0.08 0.34 0.01 0.00 0.70 0.00 0.00 55.95 56.91 1u41 s SER 326 Cb -0.16 -2.18 -0.00 0.00 -1.71 0.00 0.00 66.02 61.97 1u41 s SER 326 CO 0.03 -0.01 0.04 1.33 1.20 0.00 0.00 173.24 175.83 1u41 n VAL 327 N 4.31 0.00 -4.40 4.45 0.24 0.93 -4.99 118.33 118.87 1u41 n VAL 327 Ca -0.11 -1.23 -0.26 0.00 -2.04 0.00 0.00 64.34 60.69 1u41 n VAL 327 Cb 0.51 0.36 -0.11 0.00 -1.47 0.00 0.00 33.84 33.14 1u41 n VAL 327 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1u41 s PHE 328 N -2.17 2.37 -0.06 6.34 0.08 -0.18 -0.78 117.98 123.58 1u41 s PHE 328 Ca 0.06 -0.33 0.03 0.00 0.12 0.00 0.00 56.93 56.82 1u41 s PHE 328 Cb 0.00 -1.15 0.01 0.00 -0.57 0.00 0.00 43.02 41.31 1u41 s PHE 328 CO 0.04 0.53 -0.15 0.08 -0.10 0.00 0.00 175.22 175.62 1u41 s VAL 329 N -1.80 1.35 0.03 -0.44 1.01 0.08 -1.15 120.40 119.48 1u41 s VAL 329 Ca 0.23 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1u41 s VAL 329 Cb -0.08 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 1u41 s VAL 329 CO 0.12 0.40 -0.04 0.00 0.00 0.00 0.00 175.10 175.58 1u41 s GLN 330 N 0.38 0.43 0.58 2.72 -2.07 -0.17 -0.18 119.66 121.35 1u41 s GLN 330 Ca -0.11 -0.80 -0.13 0.00 -1.82 0.00 0.00 55.36 52.49 1u41 s GLN 330 Cb -0.14 0.07 -0.05 0.00 -1.09 0.00 0.00 33.01 31.80 1u41 s GLN 330 CO 0.04 -0.05 1.02 -0.51 -1.32 0.00 0.00 175.29 174.46 1u41 s LEU 331 N -1.89 3.39 -0.27 2.60 1.43 -1.26 -0.47 118.68 122.21 1u41 s LEU 331 Ca -0.09 1.50 -0.24 0.00 -1.03 0.00 0.00 54.13 54.28 1u41 s LEU 331 Cb -0.05 -4.49 0.07 0.00 0.03 0.00 0.00 46.19 41.75 1u41 s LEU 331 CO -0.03 -0.80 0.72 -0.60 0.23 0.00 0.00 176.35 175.86 1u41 s ARG 332 N -4.70 0.82 -0.11 1.70 3.52 -0.02 -2.15 118.95 118.01 1u41 s ARG 332 Ca 0.57 1.03 -0.05 0.00 -0.13 0.00 0.00 55.73 57.14 1u41 s ARG 332 Cb -0.11 0.38 -0.04 0.00 -1.56 0.00 0.00 34.95 33.62 1u41 s ARG 332 CO 0.45 -0.11 0.09 1.03 -0.81 0.00 0.00 175.30 175.95 1u41 s ARG 333 N 0.53 3.32 0.20 5.12 0.52 -0.82 0.40 118.95 128.22 1u41 s ARG 333 Ca -0.01 -0.24 0.09 0.00 -0.52 0.00 0.00 55.73 55.05 1u41 s ARG 333 Cb -0.05 -3.06 0.08 0.00 0.52 0.00 0.00 34.95 32.45 1u41 s ARG 333 CO -0.02 0.72 1.45 0.87 0.02 0.00 0.00 175.30 178.35 1u41 h LYS 334 N 5.15 0.00 -0.49 3.54 1.57 -1.62 -0.90 116.57 123.82 1u41 h LYS 334 Ca -0.53 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.24 1u41 h LYS 334 Cb 1.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 1u41 h LYS 334 CO 0.58 0.80 0.23 0.66 -0.57 0.00 0.00 179.45 181.14 1u41 h SER 335 N 0.00 0.64 0.00 0.86 4.64 -1.94 -3.35 113.55 114.39 1u41 h SER 335 Ca -0.01 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1u41 h SER 335 Cb 1.42 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1u41 h SER 335 CO 0.10 0.59 0.00 -0.90 -0.87 0.00 0.00 176.83 175.75 1u41 n ASP 336 N -4.62 0.32 0.00 4.97 5.68 -1.25 -5.02 116.55 116.63 1u41 n ASP 336 Ca 0.02 -1.15 0.00 0.00 -0.50 0.00 0.00 54.79 53.16 1u41 n ASP 336 Cb 0.12 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.10 1u41 n ASP 336 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1u41 n LEU 337 N -0.07 0.97 -4.69 -2.12 4.77 -0.34 -4.96 117.00 110.56 1u41 n LEU 337 Ca 0.00 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.60 1u41 n LEU 337 Cb 0.41 -2.15 0.05 0.00 -2.33 0.00 0.00 43.42 39.40 1u41 n LEU 337 CO 0.00 -0.83 0.79 -0.62 -1.33 0.00 0.00 177.39 175.40 1u41 n GLU 338 N 0.03 1.32 -4.15 3.23 -0.58 -1.26 -4.75 120.64 114.48 1u41 n GLU 338 Ca 0.00 0.49 -0.13 0.00 -0.42 0.00 0.00 57.16 57.10 1u41 n GLU 338 Cb 0.34 -2.38 -0.11 0.00 -0.57 0.00 0.00 31.44 28.72 1u41 n GLU 338 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1u41 s THR 339 N -1.37 0.80 0.75 2.62 -4.23 -1.26 -1.94 115.64 111.01 1u41 s THR 339 Ca 0.74 -1.61 -0.11 0.00 -1.18 0.00 0.00 61.69 59.53 1u41 s THR 339 Cb -0.43 -1.30 0.05 0.00 1.34 0.00 0.00 72.50 72.17 1u41 s THR 339 CO 0.48 -0.61 1.12 -0.94 -0.54 0.00 0.00 174.62 174.14 1u41 s SER 340 N -2.43 4.95 0.44 3.99 1.04 -0.91 -4.81 113.70 115.97 1u41 s SER 340 Ca 0.04 0.90 -0.25 0.00 0.48 0.00 0.00 55.95 57.12 1u41 s SER 340 Cb -0.02 -1.54 -0.08 0.00 0.10 0.00 0.00 66.02 64.48 1u41 s SER 340 CO -0.01 -1.62 1.36 -0.70 0.98 0.00 0.00 173.24 173.25 1u41 s GLU 341 N -5.44 3.75 0.57 4.02 2.56 -1.26 -4.60 118.70 118.29 1u41 s GLU 341 Ca 0.60 2.28 -0.15 0.00 0.00 0.00 0.00 54.97 57.69 1u41 s GLU 341 Cb -0.11 -2.65 -0.05 0.00 2.00 0.00 0.00 34.13 33.32 1u41 s GLU 341 CO 0.50 -0.72 1.03 -1.25 -0.56 0.00 0.00 175.26 174.26 1u41 s PRO 342 N -2.42 3.53 -0.05 4.30 0.04 -1.26 -4.69 135.00 134.45 1u41 s PRO 342 Ca 0.60 1.08 0.04 0.00 0.04 0.00 0.00 61.00 62.76 1u41 s PRO 342 Cb -0.41 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.04 1u41 s PRO 342 CO 0.52 -0.63 -0.16 0.15 0.04 0.00 0.00 177.00 176.92 1u41 s LYS 343 N -4.19 2.52 0.43 4.56 -0.14 0.74 -4.90 119.74 118.76 1u41 s LYS 343 Ca 0.61 -0.73 -0.26 0.00 -1.36 0.00 0.00 55.97 54.23 1u41 s LYS 343 Cb -0.13 -2.35 -0.09 0.00 -1.68 0.00 0.00 37.83 33.58 1u41 s LYS 343 CO 0.37 0.58 1.41 -2.14 -0.76 0.00 0.00 175.35 174.80 1u41 s PRO 344 N -0.62 3.79 -0.04 -1.68 0.02 -1.26 -0.74 135.00 134.48 1u41 s PRO 344 Ca 0.09 2.38 -0.05 0.00 0.02 0.00 0.00 61.00 63.44 1u41 s PRO 344 Cb -0.11 -2.71 0.01 0.00 0.02 0.00 0.00 34.50 31.71 1u41 s PRO 344 CO 0.01 -0.72 0.13 0.12 -0.33 0.00 0.00 177.00 176.21 1u41 s PHE 345 N -1.21 -0.10 -0.19 6.54 5.36 0.04 -4.82 117.98 123.61 1u41 s PHE 345 Ca 0.59 0.24 0.01 0.00 -0.96 0.00 0.00 56.93 56.81 1u41 s PHE 345 Cb -0.43 0.02 0.02 0.00 -0.34 0.00 0.00 43.02 42.30 1u41 s PHE 345 CO 0.55 -0.12 -0.19 -1.17 -1.46 0.00 0.00 175.22 172.84 1u41 s LEU 346 N -0.28 2.22 0.02 6.12 2.96 -0.75 -0.05 118.68 128.92 1u41 s LEU 346 Ca -0.04 -0.71 -0.25 0.00 -0.22 0.00 0.00 54.13 52.91 1u41 s LEU 346 Cb -0.03 -1.46 -0.05 0.00 0.50 0.00 0.00 46.19 45.15 1u41 s LEU 346 CO 0.00 -0.02 0.78 -0.31 -1.32 0.00 0.00 176.35 175.48 1u41 s TYR 347 N 1.29 3.69 0.17 5.38 2.02 -0.63 -1.31 117.35 127.96 1u41 s TYR 347 Ca 0.04 1.46 0.10 0.00 -0.37 0.00 0.00 57.07 58.30 1u41 s TYR 347 Cb -0.14 -2.86 -0.04 0.00 -0.40 0.00 0.00 41.96 38.52 1u41 s TYR 347 CO -0.12 0.20 -0.18 1.52 -1.57 0.00 0.00 175.55 175.39 1u41 s TYR 348 N 0.26 2.46 0.54 2.71 -0.85 0.13 -1.25 117.35 121.35 1u41 s TYR 348 Ca 0.40 -0.30 -0.18 0.00 -0.52 0.00 0.00 57.07 56.48 1u41 s TYR 348 Cb -0.20 -1.24 -0.12 0.00 0.38 0.00 0.00 41.96 40.78 1u41 s TYR 348 CO 0.23 0.46 0.18 -2.30 -1.52 0.00 0.00 175.55 172.60 1u41 n PRO 349 N 0.37 0.24 0.00 -3.49 -0.02 -1.26 -2.01 135.00 128.83 1u41 n PRO 349 Ca -0.13 0.09 0.16 0.00 -2.02 0.00 0.00 63.50 61.60 1u41 n PRO 349 Cb 0.55 -1.33 0.95 0.00 -0.02 0.00 0.00 33.50 33.64 1u41 n PRO 349 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57