#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3r s SER 264 N 0.00 4.35 0.17 1.96 1.04 -1.26 -4.79 113.70 115.16 1u3r s SER 264 Ca 0.00 1.78 -0.16 0.00 0.48 0.00 0.00 55.95 58.05 1u3r s SER 264 Cb 0.00 -2.47 0.10 0.00 0.10 0.00 0.00 66.02 63.75 1u3r s SER 264 CO 0.00 -2.13 1.69 -0.65 0.98 0.00 0.00 173.24 173.13 1u3r h PRO 265 N -1.19 0.07 -0.97 4.02 0.11 -1.92 0.09 132.00 132.20 1u3r h PRO 265 Ca -0.44 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.71 1u3r h PRO 265 Cb 1.24 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.27 1u3r h PRO 265 CO 0.52 0.04 0.63 1.49 -0.21 0.00 0.00 178.00 180.47 1u3r h GLU 266 N 0.07 1.14 -0.23 1.05 4.81 -1.92 0.20 114.58 119.70 1u3r h GLU 266 Ca 0.19 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.26 1u3r h GLU 266 Cb 0.28 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1u3r h GLU 266 CO -0.35 0.76 -0.28 1.96 -0.73 0.00 0.00 179.01 180.36 1u3r h GLN 267 N 1.18 0.46 0.08 1.92 4.20 -1.67 0.12 115.11 121.39 1u3r h GLN 267 Ca 0.40 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.93 1u3r h GLN 267 Cb 0.08 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1u3r h GLN 267 CO -0.15 0.70 -0.04 1.25 -0.67 0.00 0.00 178.83 179.92 1u3r h LEU 268 N 0.40 -0.09 -0.43 1.46 5.85 0.59 -0.25 115.31 122.84 1u3r h LEU 268 Ca 0.06 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.59 1u3r h LEU 268 Cb 0.70 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.71 1u3r h LEU 268 CO 0.05 0.19 0.17 0.58 -0.34 0.00 0.00 178.44 179.09 1u3r h VAL 269 N -0.38 0.89 -0.68 1.05 2.07 -0.47 -0.69 116.25 118.04 1u3r h VAL 269 Ca -0.01 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1u3r h VAL 269 Cb 0.33 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1u3r h VAL 269 CO 0.02 0.06 0.37 -0.07 0.02 0.00 0.00 177.57 177.97 1u3r h LEU 270 N 0.35 0.84 -0.73 2.57 4.07 -0.69 -0.35 115.31 121.37 1u3r h LEU 270 Ca 0.20 -0.07 -0.11 0.00 0.08 0.00 0.00 57.88 57.98 1u3r h LEU 270 Cb 0.17 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.68 1u3r h LEU 270 CO -0.18 0.68 -0.19 0.74 -1.08 0.00 0.00 178.44 178.41 1u3r h THR 271 N 0.95 1.27 -0.20 0.22 2.02 -0.14 -2.19 112.91 114.84 1u3r h THR 271 Ca 0.24 -1.29 -0.16 0.00 0.77 0.00 0.00 66.41 65.97 1u3r h THR 271 Cb 0.03 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1u3r h THR 271 CO -0.04 0.43 -0.55 -0.07 0.37 0.00 0.00 175.52 175.67 1u3r h LEU 272 N 0.68 0.65 -0.23 2.58 3.38 -0.51 -1.56 115.31 120.31 1u3r h LEU 272 Ca 0.10 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.75 1u3r h LEU 272 Cb 0.69 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1u3r h LEU 272 CO 0.05 1.07 0.05 0.25 0.09 0.00 0.00 178.44 179.95 1u3r h LEU 273 N 0.45 0.03 -0.79 1.67 6.46 -0.86 -1.95 115.31 120.32 1u3r h LEU 273 Ca 0.01 0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 57.74 1u3r h LEU 273 Cb 1.10 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 41.04 1u3r h LEU 273 CO 0.10 0.05 0.20 -0.08 -0.62 0.00 0.00 178.44 178.10 1u3r h GLU 274 N 0.14 1.11 0.00 1.25 4.81 -1.29 -2.72 114.58 117.89 1u3r h GLU 274 Ca 0.10 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1u3r h GLU 274 Cb 0.09 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1u3r h GLU 274 CO -0.13 0.96 0.00 0.00 -0.73 0.00 0.00 179.01 179.11 1u3r n ALA 275 N -2.45 1.38 -1.61 2.92 0.00 -0.60 -4.83 120.51 115.33 1u3r n ALA 275 Ca 0.06 -0.01 -0.49 0.00 0.00 0.00 0.00 53.44 53.00 1u3r n ALA 275 Cb 0.24 -1.16 -0.04 0.00 0.00 0.00 0.00 19.45 18.48 1u3r n ALA 275 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1u3r n GLU 276 N -1.60 1.43 -2.36 0.00 -0.58 -0.87 -4.66 120.64 111.99 1u3r n GLU 276 Ca 0.02 0.51 -0.34 0.00 -0.42 0.00 0.00 57.16 56.93 1u3r n GLU 276 Cb 0.10 -2.11 -0.02 0.00 -0.57 0.00 0.00 31.44 28.85 1u3r n GLU 276 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1u3r s PRO 277 N 0.01 3.58 0.60 3.49 0.04 -1.26 -5.01 135.00 136.46 1u3r s PRO 277 Ca 0.76 1.38 -0.17 0.00 0.04 0.00 0.00 61.00 63.01 1u3r s PRO 277 Cb -0.82 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.63 1u3r s PRO 277 CO 0.49 -0.62 1.11 -1.25 0.04 0.00 0.00 177.00 176.77 1u3r s PRO 278 N -3.43 3.10 0.03 0.56 0.04 -1.26 -4.93 135.00 129.10 1u3r s PRO 278 Ca 0.68 1.47 -0.30 0.00 0.04 0.00 0.00 61.00 62.88 1u3r s PRO 278 Cb -0.18 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.32 1u3r s PRO 278 CO 0.25 -1.03 1.35 -1.01 0.04 0.00 0.00 177.00 176.61 1u3r s HIS 279 N -2.09 3.07 0.04 0.56 3.76 -1.26 -4.95 115.29 114.41 1u3r s HIS 279 Ca 0.69 0.96 -0.31 0.00 -0.15 0.00 0.00 55.06 56.25 1u3r s HIS 279 Cb -0.22 -3.61 -0.06 0.00 1.11 0.00 0.00 32.58 29.80 1u3r s HIS 279 CO 0.34 -2.16 1.38 0.08 -0.85 0.00 0.00 174.74 173.54 1u3r s VAL 280 N 1.85 3.62 -0.46 -0.90 1.01 -1.26 -4.98 120.40 119.28 1u3r s VAL 280 Ca 0.63 1.07 -0.18 0.00 0.00 0.00 0.00 61.98 63.50 1u3r s VAL 280 Cb -0.32 -3.69 0.05 0.00 0.00 0.00 0.00 36.38 32.42 1u3r s VAL 280 CO 0.27 0.03 0.52 -0.76 0.00 0.00 0.00 175.10 175.16 1u3r s LEU 281 N 1.91 5.02 -0.04 3.92 1.43 -1.26 -4.52 118.68 125.14 1u3r s LEU 281 Ca 0.64 -0.86 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 1u3r s LEU 281 Cb -0.33 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 43.50 1u3r s LEU 281 CO 0.28 -0.73 -0.13 -0.51 0.23 0.00 0.00 176.35 175.49 1u3r s ILE 282 N 2.29 1.08 0.17 -0.59 2.07 -1.26 -5.11 121.20 119.84 1u3r s ILE 282 Ca 0.12 -0.51 -0.18 0.00 -1.41 0.00 0.00 60.65 58.67 1u3r s ILE 282 Cb -0.19 -0.95 -0.08 0.00 0.13 0.00 0.00 42.46 41.38 1u3r s ILE 282 CO 0.12 0.32 0.65 -0.44 -1.91 0.00 0.00 174.94 173.68 1u3r s SER 283 N 0.18 7.01 0.20 4.50 0.01 -1.26 -4.26 113.70 120.08 1u3r s SER 283 Ca -0.04 1.30 -0.30 0.00 1.31 0.00 0.00 55.95 58.22 1u3r s SER 283 Cb -0.10 -2.37 -0.08 0.00 0.21 0.00 0.00 66.02 63.67 1u3r s SER 283 CO 0.01 0.10 1.17 -0.60 0.41 0.00 0.00 173.24 174.34 1u3r s ARG 284 N -1.79 4.52 0.38 12.44 3.52 -1.20 -4.96 118.95 131.87 1u3r s ARG 284 Ca 0.39 1.85 -0.27 0.00 -0.13 0.00 0.00 55.73 57.57 1u3r s ARG 284 Cb -0.17 -3.23 -0.11 0.00 -1.56 0.00 0.00 34.95 29.88 1u3r s ARG 284 CO 0.20 -0.03 1.35 -0.35 -0.81 0.00 0.00 175.30 175.66 1u3r n PRO 285 N 2.25 2.22 -0.09 5.12 -0.04 -1.26 -4.89 135.00 138.30 1u3r n PRO 285 Ca 0.03 0.78 -0.08 0.00 -0.04 0.00 0.00 63.50 64.19 1u3r n PRO 285 Cb 0.45 -2.45 -0.02 0.00 -0.04 0.00 0.00 33.50 31.44 1u3r n PRO 285 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1u3r h SER 286 N 2.49 -1.01 -4.25 3.54 0.02 -2.03 -3.43 113.55 108.89 1u3r h SER 286 Ca -0.48 0.18 -0.49 0.00 -0.84 0.00 0.00 61.79 60.16 1u3r h SER 286 Cb 1.28 0.47 0.07 0.00 0.14 0.00 0.00 62.40 64.36 1u3r h SER 286 CO 0.62 -0.32 0.35 0.00 -1.14 0.00 0.00 176.83 176.34 1u3r s ALA 287 N -6.02 3.02 0.38 3.77 0.00 -1.26 -5.01 121.76 116.65 1u3r s ALA 287 Ca -0.15 -0.42 -0.28 0.00 0.00 0.00 0.00 51.96 51.12 1u3r s ALA 287 Cb 0.13 -2.92 -0.10 0.00 0.00 0.00 0.00 23.12 20.23 1u3r s ALA 287 CO 0.68 -1.01 1.41 -2.14 0.00 0.00 0.00 175.76 174.70 1u3r s PRO 288 N -5.24 4.10 0.49 0.00 0.02 -1.26 -4.89 135.00 128.21 1u3r s PRO 288 Ca 0.57 2.40 -0.20 0.00 0.02 0.00 0.00 61.00 63.78 1u3r s PRO 288 Cb -0.11 -2.92 -0.11 0.00 0.02 0.00 0.00 34.50 31.38 1u3r s PRO 288 CO 0.50 -0.48 0.51 1.19 -0.33 0.00 0.00 177.00 178.40 1u3r n PHE 289 N 0.41 -0.67 -4.43 6.54 3.72 -1.26 -5.03 117.46 116.75 1u3r n PHE 289 Ca 0.02 0.52 -0.21 0.00 -0.05 0.00 0.00 57.45 57.73 1u3r n PHE 289 Cb 0.41 -1.96 -0.10 0.00 -0.94 0.00 0.00 39.48 36.88 1u3r n PHE 289 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1u3r s THR 290 N -1.60 1.68 0.19 4.37 -4.23 -1.26 -4.96 115.64 109.83 1u3r s THR 290 Ca 0.65 -2.14 -0.16 0.00 -1.18 0.00 0.00 61.69 58.86 1u3r s THR 290 Cb -0.53 -2.42 0.17 0.00 1.34 0.00 0.00 72.50 71.06 1u3r s THR 290 CO 0.57 -0.32 1.63 -0.08 -0.54 0.00 0.00 174.62 175.88 1u3r h GLU 291 N 2.29 -0.04 -0.21 3.99 4.81 -1.95 -0.65 114.58 122.83 1u3r h GLU 291 Ca -0.40 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.82 1u3r h GLU 291 Cb 1.23 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1u3r h GLU 291 CO 0.67 -0.03 0.08 0.00 -0.73 0.00 0.00 179.01 179.00 1u3r h ALA 292 N 1.44 0.28 0.00 2.92 0.00 -1.87 -2.63 119.26 119.40 1u3r h ALA 292 Ca 0.26 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1u3r h ALA 292 Cb 0.43 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1u3r h ALA 292 CO -0.57 -0.13 -0.29 0.66 0.00 0.00 0.00 179.25 178.92 1u3r h SER 293 N 0.19 0.00 -0.13 0.00 4.64 -1.83 -0.21 113.55 116.21 1u3r h SER 293 Ca 0.07 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.26 1u3r h SER 293 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1u3r h SER 293 CO -0.01 0.29 -0.43 -0.03 -0.87 0.00 0.00 176.83 175.78 1u3r h MET 294 N 0.00 0.52 0.00 4.77 -1.53 -1.02 -2.08 114.93 115.59 1u3r h MET 294 Ca -0.00 -0.39 -0.08 0.00 -3.44 0.00 0.00 59.70 55.79 1u3r h MET 294 Cb 0.63 0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.74 1u3r h MET 294 CO 0.04 1.01 -0.37 0.52 0.14 0.00 0.00 176.91 178.24 1u3r h MET 295 N 0.13 0.00 -0.16 0.39 2.07 -1.29 -0.95 114.93 115.11 1u3r h MET 295 Ca -0.02 0.00 -0.03 0.00 -2.07 0.00 0.00 59.70 57.58 1u3r h MET 295 Cb 1.06 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.78 1u3r h MET 295 CO 0.09 0.37 -0.01 0.52 1.07 0.00 0.00 176.91 178.95 1u3r h MET 296 N 0.00 0.30 -0.40 1.72 2.86 -0.94 -0.93 114.93 117.54 1u3r h MET 296 Ca -0.00 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 1u3r h MET 296 Cb 0.70 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.32 1u3r h MET 296 CO 0.05 0.53 0.15 0.77 1.06 0.00 0.00 176.91 179.47 1u3r h SER 297 N 0.03 0.56 -0.54 1.22 0.02 -1.11 -1.37 113.55 112.37 1u3r h SER 297 Ca 0.04 -0.18 -0.11 0.00 -0.84 0.00 0.00 61.79 60.71 1u3r h SER 297 Cb 0.41 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1u3r h SER 297 CO 0.01 0.59 -0.08 -0.07 -1.14 0.00 0.00 176.83 176.15 1u3r h LEU 298 N 0.50 1.00 -0.35 5.07 3.38 -1.13 -1.42 115.31 122.36 1u3r h LEU 298 Ca 0.13 -0.34 -0.14 0.00 0.09 0.00 0.00 57.88 57.62 1u3r h LEU 298 Cb 0.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1u3r h LEU 298 CO -0.01 1.10 -0.33 0.71 0.09 0.00 0.00 178.44 180.01 1u3r h THR 299 N 0.87 1.28 -0.56 0.22 1.35 -1.11 -1.86 112.91 113.11 1u3r h THR 299 Ca 0.14 -1.50 -0.04 0.00 -0.55 0.00 0.00 66.41 64.47 1u3r h THR 299 Cb 0.64 1.45 -0.02 0.00 -1.73 0.00 0.00 68.15 68.49 1u3r h THR 299 CO 0.04 0.49 0.20 0.11 -0.25 0.00 0.00 175.52 176.11 1u3r h LYS 300 N 0.63 0.85 0.17 4.72 1.57 -1.20 -1.03 116.57 122.28 1u3r h LYS 300 Ca 0.06 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1u3r h LYS 300 Cb 0.91 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1u3r h LYS 300 CO 0.08 0.76 -0.12 1.25 -0.57 0.00 0.00 179.45 180.85 1u3r h LEU 301 N 0.77 -0.29 -0.90 2.94 5.85 -1.18 -1.60 115.31 120.91 1u3r h LEU 301 Ca 0.18 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.99 1u3r h LEU 301 Cb 0.25 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 1u3r h LEU 301 CO -0.01 -0.19 0.56 0.00 -0.34 0.00 0.00 178.44 178.46 1u3r h ALA 302 N 0.53 1.24 -0.50 1.25 0.00 -1.24 0.91 119.26 121.46 1u3r h ALA 302 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1u3r h ALA 302 Cb 0.25 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1u3r h ALA 302 CO 0.01 0.32 0.27 0.22 0.00 0.00 0.00 179.25 180.06 1u3r h ASP 303 N 1.02 0.62 -0.38 0.00 1.82 -0.85 0.15 116.42 118.80 1u3r h ASP 303 Ca 0.39 -0.10 -0.14 0.00 -0.39 0.00 0.00 57.03 56.80 1u3r h ASP 303 Cb 0.18 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 40.02 1u3r h ASP 303 CO -0.18 0.54 -0.29 0.11 -1.61 0.00 0.00 179.24 177.82 1u3r h LYS 304 N 0.66 0.91 -0.18 0.28 6.56 -0.69 -3.15 116.57 120.96 1u3r h LYS 304 Ca 0.17 -0.42 -0.13 0.00 -1.06 0.00 0.00 60.65 59.21 1u3r h LYS 304 Cb 0.06 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 31.69 1u3r h LYS 304 CO -0.03 1.07 -0.45 0.93 -2.06 0.00 0.00 179.45 178.91 1u3r h GLU 305 N 0.77 0.45 -0.83 3.15 5.08 -0.54 -3.02 114.58 119.64 1u3r h GLU 305 Ca 0.09 -0.24 0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1u3r h GLU 305 Cb 0.85 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.07 1u3r h GLU 305 CO 0.08 0.82 0.55 -0.07 -1.00 0.00 0.00 179.01 179.38 1u3r h LEU 306 N 0.37 0.94 -0.53 1.33 3.38 -0.66 0.12 115.31 120.25 1u3r h LEU 306 Ca 0.02 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1u3r h LEU 306 Cb 0.94 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 1u3r h LEU 306 CO 0.08 0.67 0.31 0.58 0.09 0.00 0.00 178.44 180.17 1u3r h VAL 307 N 1.11 1.17 0.00 1.22 2.07 -1.51 -2.33 116.25 117.98 1u3r h VAL 307 Ca 0.31 -0.41 -0.12 0.00 0.82 0.00 0.00 66.70 67.31 1u3r h VAL 307 Cb -0.09 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 1u3r h VAL 307 CO -0.07 0.18 -0.57 0.45 0.02 0.00 0.00 177.57 177.58 1u3r h HIS 308 N 0.71 0.00 -0.79 1.57 3.86 -1.37 -3.12 115.15 116.01 1u3r h HIS 308 Ca 0.19 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.36 1u3r h HIS 308 Cb 0.02 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.45 1u3r h HIS 308 CO -0.02 0.57 0.35 1.98 0.86 0.00 0.00 177.93 181.67 1u3r h MET 309 N 0.00 1.16 -0.49 2.45 -1.53 -0.27 0.31 114.93 116.55 1u3r h MET 309 Ca -0.01 -0.19 -0.10 0.00 -3.44 0.00 0.00 59.70 55.97 1u3r h MET 309 Cb 1.05 -0.20 -0.02 0.00 -0.55 0.00 0.00 31.60 31.88 1u3r h MET 309 CO 0.07 0.91 -0.08 0.82 0.14 0.00 0.00 176.91 178.78 1u3r h ILE 310 N 1.13 1.26 -0.23 1.77 2.04 -1.38 0.23 117.51 122.32 1u3r h ILE 310 Ca 0.27 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 1u3r h ILE 310 Cb 0.16 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1u3r h ILE 310 CO -0.03 0.41 0.06 0.28 0.00 0.00 0.00 178.15 178.87 1u3r h SER 311 N 0.79 0.35 -0.04 1.72 0.02 -1.42 -2.19 113.55 112.79 1u3r h SER 311 Ca 0.14 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1u3r h SER 311 Cb 0.59 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1u3r h SER 311 CO 0.04 0.48 -0.21 -0.25 -1.14 0.00 0.00 176.83 175.74 1u3r h TRP 312 N 0.20 -0.56 -0.79 3.45 7.01 -0.54 -2.57 115.95 122.15 1u3r h TRP 312 Ca 0.07 0.02 0.12 0.00 2.11 0.00 0.00 58.89 61.22 1u3r h TRP 312 Cb 0.26 0.25 -0.08 0.00 -2.10 0.00 0.00 29.16 27.50 1u3r h TRP 312 CO 0.01 -0.30 0.39 0.00 -2.79 0.00 0.00 178.44 175.76 1u3r h ALA 313 N 0.59 1.13 0.00 2.65 0.00 -0.38 0.87 119.26 124.13 1u3r h ALA 313 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1u3r h ALA 313 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1u3r h ALA 313 CO -0.22 -0.07 0.00 0.87 0.00 0.00 0.00 179.25 179.83 1u3r h LYS 314 N 0.61 0.00 0.00 0.00 1.57 -0.98 -1.49 116.57 116.27 1u3r h LYS 314 Ca 0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.19 1u3r h LYS 314 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1u3r h LYS 314 CO -0.32 0.00 -0.79 1.63 -0.57 0.00 0.00 179.45 179.40 1u3r n LYS 315 N -2.38 0.07 -2.19 3.15 5.02 0.29 -4.61 118.16 117.50 1u3r n LYS 315 Ca -0.01 -0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 1u3r n LYS 315 Cb 0.08 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.54 1u3r n LYS 315 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1u3r s ILE 316 N -3.05 3.59 -0.38 -0.18 1.01 -0.56 -4.86 121.20 116.76 1u3r s ILE 316 Ca 0.08 1.02 -0.39 0.00 0.00 0.00 0.00 60.65 61.37 1u3r s ILE 316 Cb 0.16 -3.65 -0.14 0.00 0.01 0.00 0.00 42.46 38.84 1u3r s ILE 316 CO 0.78 0.01 2.11 -2.65 0.00 0.00 0.00 174.94 175.19 1u3r n PRO 317 N 5.12 0.76 -0.01 2.79 -0.02 -1.26 -1.50 135.00 140.87 1u3r n PRO 317 Ca 0.13 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1u3r n PRO 317 Cb 0.43 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1u3r n PRO 317 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u3r n GLY 318 N 6.49 0.94 0.14 -1.23 0.00 -1.26 -4.95 105.19 105.33 1u3r n GLY 318 Ca 0.43 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.37 1u3r n GLY 318 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u3r h PHE 319 N 0.00 0.32 0.00 1.61 3.57 -1.55 -1.93 116.94 118.95 1u3r h PHE 319 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1u3r h PHE 319 Cb 0.00 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.64 1u3r h PHE 319 CO 0.00 0.19 0.00 -0.39 -2.23 0.00 0.00 178.31 175.88 1u3r h VAL 320 N 0.35 0.00 0.00 1.41 -1.51 -1.81 -1.96 116.25 112.73 1u3r h VAL 320 Ca 0.12 -0.32 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 1u3r h VAL 320 Cb 0.01 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 30.39 1u3r h VAL 320 CO -0.07 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 175.65 1u3r n GLU 321 N -2.82 0.01 -1.78 5.19 1.02 -0.73 -4.76 120.64 116.78 1u3r n GLU 321 Ca 0.00 0.07 -0.29 0.00 -0.02 0.00 0.00 57.16 56.92 1u3r n GLU 321 Cb 0.23 -1.51 0.12 0.00 -0.02 0.00 0.00 31.44 30.25 1u3r n GLU 321 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1u3r s LEU 322 N -3.07 2.34 0.47 -4.62 1.43 -0.74 -5.01 118.68 109.49 1u3r s LEU 322 Ca 0.12 0.76 -0.20 0.00 -1.03 0.00 0.00 54.13 53.78 1u3r s LEU 322 Cb 0.16 -3.12 -0.09 0.00 0.03 0.00 0.00 46.19 43.17 1u3r s LEU 322 CO 0.47 -2.26 1.00 -0.94 0.23 0.00 0.00 176.35 174.84 1u3r s SER 323 N -4.45 6.61 0.37 2.29 1.04 -1.26 -4.87 113.70 113.43 1u3r s SER 323 Ca 0.64 1.79 0.13 0.00 0.48 0.00 0.00 55.95 58.99 1u3r s SER 323 Cb -0.11 -2.55 0.93 0.00 0.10 0.00 0.00 66.02 64.40 1u3r s SER 323 CO 0.51 -0.59 1.83 0.25 0.98 0.00 0.00 173.24 176.22 1u3r h LEU 324 N 1.63 0.57 -0.95 2.42 5.85 -1.95 0.09 115.31 122.96 1u3r h LEU 324 Ca -0.49 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.20 1u3r h LEU 324 Cb 1.20 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 1u3r h LEU 324 CO 0.60 0.23 -0.13 -0.26 -0.34 0.00 0.00 178.44 178.54 1u3r h PHE 325 N 0.57 0.67 -0.10 1.25 0.04 -1.99 -0.20 116.94 117.19 1u3r h PHE 325 Ca 0.50 -0.12 -0.21 0.00 2.80 0.00 0.00 57.97 60.94 1u3r h PHE 325 Cb 1.01 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.99 1u3r h PHE 325 CO -0.00 0.72 -0.79 -0.44 -0.60 0.00 0.00 178.31 177.19 1u3r h ASP 326 N 0.56 0.71 -0.05 2.17 3.32 -1.40 -1.95 116.42 119.77 1u3r h ASP 326 Ca 0.10 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1u3r h ASP 326 Cb 0.56 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1u3r h ASP 326 CO 0.04 1.26 0.02 1.56 -1.72 0.00 0.00 179.24 180.39 1u3r h GLN 327 N 0.39 0.05 -0.53 3.56 4.20 -0.93 -0.18 115.11 121.66 1u3r h GLN 327 Ca -0.05 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1u3r h GLN 327 Cb 1.40 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 29.15 1u3r h GLN 327 CO 0.15 0.03 0.34 0.28 -0.67 0.00 0.00 178.83 178.96 1u3r h VAL 328 N 0.05 1.15 -0.00 -0.54 2.07 -1.02 -2.31 116.25 115.64 1u3r h VAL 328 Ca 0.02 -0.29 -0.11 0.00 0.82 0.00 0.00 66.70 67.14 1u3r h VAL 328 Cb 0.01 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1u3r h VAL 328 CO -0.02 0.14 -0.52 0.03 0.02 0.00 0.00 177.57 177.22 1u3r h ARG 329 N 0.72 0.01 -0.19 1.57 3.08 -1.10 -1.37 114.38 117.10 1u3r h ARG 329 Ca 0.19 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.19 1u3r h ARG 329 Cb -0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1u3r h ARG 329 CO -0.04 0.53 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.26 1u3r h LEU 330 N 0.00 0.38 -0.65 3.04 3.38 -0.73 -2.55 115.31 118.18 1u3r h LEU 330 Ca -0.00 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.51 1u3r h LEU 330 Cb 0.93 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 1u3r h LEU 330 CO 0.07 0.68 0.10 -0.07 0.09 0.00 0.00 178.44 179.31 1u3r h LEU 331 N 0.09 1.04 -0.99 1.67 3.38 -1.34 -1.73 115.31 117.43 1u3r h LEU 331 Ca 0.05 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 1u3r h LEU 331 Cb 0.52 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1u3r h LEU 331 CO 0.02 1.04 0.02 -0.33 0.09 0.00 0.00 178.44 179.28 1u3r h GLU 332 N 1.01 0.75 0.02 1.13 5.08 -1.28 -1.78 114.58 119.51 1u3r h GLU 332 Ca 0.20 -0.19 -0.21 0.00 -1.00 0.00 0.00 59.36 58.16 1u3r h GLU 332 Cb 0.44 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1u3r h GLU 332 CO 0.01 0.75 -0.95 1.03 -1.00 0.00 0.00 179.01 178.85 1u3r h SER 333 N 0.71 0.29 -0.00 1.42 0.87 -1.23 -3.39 113.55 112.21 1u3r h SER 333 Ca 0.14 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1u3r h SER 333 Cb 0.41 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1u3r h SER 333 CO 0.01 1.09 -0.25 0.00 -0.53 0.00 0.00 176.83 177.15 1u3r h TRP 335 N 0.58 -0.46 -0.55 0.00 5.08 -1.52 0.24 115.95 119.31 1u3r h TRP 335 Ca 0.00 0.08 -0.08 0.00 1.08 0.00 0.00 58.89 59.97 1u3r h TRP 335 Cb 0.25 0.33 -0.02 0.00 -3.00 0.00 0.00 29.16 26.72 1u3r h TRP 335 CO 0.00 -0.37 0.03 1.98 -1.28 0.00 0.00 178.44 178.81 1u3r h MET 336 N -0.00 0.92 -0.47 0.12 4.05 -1.87 -0.69 114.93 116.98 1u3r h MET 336 Ca 0.41 -0.25 0.01 0.00 -0.28 0.00 0.00 59.70 59.58 1u3r h MET 336 Cb 0.62 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.29 1u3r h MET 336 CO -0.87 0.90 0.31 0.93 0.23 0.00 0.00 176.91 178.40 1u3r h GLU 337 N 0.86 0.61 -0.11 0.39 5.08 -1.33 -0.08 114.58 119.99 1u3r h GLU 337 Ca 0.17 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1u3r h GLU 337 Cb 0.46 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1u3r h GLU 337 CO 0.02 0.40 0.03 0.28 -1.00 0.00 0.00 179.01 178.74 1u3r h VAL 338 N 0.62 1.20 -0.46 3.13 2.07 -0.83 -0.46 116.25 121.52 1u3r h VAL 338 Ca 0.18 -0.61 0.08 0.00 0.82 0.00 0.00 66.70 67.16 1u3r h VAL 338 Cb -0.06 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 1u3r h VAL 338 CO -0.05 0.18 0.09 -0.07 0.02 0.00 0.00 177.57 177.74 1u3r h LEU 339 N -0.03 0.00 -1.37 2.57 3.38 -0.89 -1.95 115.31 117.02 1u3r h LEU 339 Ca 0.03 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1u3r h LEU 339 Cb 0.25 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1u3r h LEU 339 CO 0.00 0.03 0.00 0.24 0.09 0.00 0.00 178.44 178.81 1u3r h MET 340 N 0.22 0.42 -0.33 1.13 2.86 -0.76 -1.12 114.93 117.35 1u3r h MET 340 Ca 0.23 -0.08 -0.11 0.00 -2.06 0.00 0.00 59.70 57.68 1u3r h MET 340 Cb 0.29 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 1u3r h MET 340 CO -0.30 0.45 -0.23 1.98 1.06 0.00 0.00 176.91 179.87 1u3r h MET 341 N 0.41 0.64 -0.45 1.72 1.85 -0.44 -1.23 114.93 117.44 1u3r h MET 341 Ca 0.09 -0.25 -0.06 0.00 -0.61 0.00 0.00 59.70 58.87 1u3r h MET 341 Cb 0.27 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.25 1u3r h MET 341 CO 0.01 0.82 0.04 0.78 -0.40 0.00 0.00 176.91 178.16 1u3r h GLY 342 N 0.99 0.82 0.81 1.39 0.00 -0.64 -1.46 103.07 104.98 1u3r h GLY 342 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1u3r h GLY 342 CO 0.05 0.53 -0.16 -2.00 0.00 0.00 0.00 176.54 174.96 1u3r h LEU 343 N 0.62 -0.43 -0.77 3.11 5.85 -0.87 -0.71 115.31 122.11 1u3r h LEU 343 Ca 0.13 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.98 1u3r h LEU 343 Cb 0.43 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.54 1u3r h LEU 343 CO 0.02 -0.24 0.42 0.24 -0.34 0.00 0.00 178.44 178.53 1u3r h MET 344 N -0.35 0.69 -0.21 1.25 2.86 -1.11 0.11 114.93 118.17 1u3r h MET 344 Ca 0.00 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 1u3r h MET 344 Cb 0.33 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1u3r h MET 344 CO -0.04 0.45 0.07 2.35 1.06 0.00 0.00 176.91 180.80 1u3r h TRP 345 N 0.71 0.34 0.00 -0.22 2.91 -1.01 -0.93 115.95 117.74 1u3r h TRP 345 Ca 0.37 -0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.33 1u3r h TRP 345 Cb 0.35 -0.10 -0.00 0.00 -0.51 0.00 0.00 29.16 28.90 1u3r h TRP 345 CO -0.08 0.40 -0.12 0.00 -1.03 0.00 0.00 178.44 177.61 1u3r h ARG 346 N 0.18 0.00 -0.00 2.65 3.08 -0.32 -2.52 114.38 117.44 1u3r h ARG 346 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1u3r h ARG 346 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1u3r h ARG 346 CO -0.00 0.12 -0.58 0.43 -1.07 0.00 0.00 179.97 178.86 1u3r n SER 347 N -3.95 0.86 -0.32 7.04 7.64 0.31 -4.54 113.62 120.67 1u3r n SER 347 Ca -0.02 -0.67 0.11 0.00 1.01 0.00 0.00 58.87 59.30 1u3r n SER 347 Cb 0.21 0.44 0.29 0.00 -1.01 0.00 0.00 64.21 64.15 1u3r n SER 347 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1u3r h ILE 348 N 0.43 0.62 -0.70 0.44 2.10 -0.71 0.04 117.51 119.74 1u3r h ILE 348 Ca 0.00 -0.20 -0.37 0.00 1.08 0.00 0.00 64.86 65.37 1u3r h ILE 348 Cb 0.52 -0.01 -0.21 0.00 -1.09 0.00 0.00 36.82 36.03 1u3r h ILE 348 CO 0.00 0.11 0.48 0.47 -1.08 0.00 0.00 178.15 178.12 1u3r n ASP 349 N -4.90 3.90 -3.03 2.19 8.00 -1.26 -4.50 116.55 116.95 1u3r n ASP 349 Ca 0.21 -3.15 -0.17 0.00 0.71 0.00 0.00 54.79 52.40 1u3r n ASP 349 Cb 0.57 -0.77 -0.01 0.00 -0.02 0.00 0.00 41.12 40.89 1u3r n ASP 349 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1u3r n HIS 350 N -0.60 -1.24 -1.50 1.24 8.25 0.00 -5.13 115.22 116.25 1u3r n HIS 350 Ca 0.42 -3.03 -0.43 0.00 -0.26 0.00 0.00 57.72 54.42 1u3r n HIS 350 Cb 1.24 0.34 0.00 0.00 1.12 0.00 0.00 29.99 32.70 1u3r n HIS 350 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1u3r n PRO 351 N 0.98 0.80 0.00 -0.41 -0.04 -1.26 -1.11 135.00 133.95 1u3r n PRO 351 Ca 0.17 0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 1u3r n PRO 351 Cb 0.61 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 1u3r n PRO 351 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1u3r n GLY 352 N 1.59 2.93 3.66 0.55 0.00 -1.26 -4.99 105.19 107.68 1u3r n GLY 352 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1u3r n GLY 352 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u3r s LYS 353 N -0.06 2.42 -0.28 1.61 1.02 -0.27 -4.01 119.74 120.17 1u3r s LYS 353 Ca 0.00 -1.03 0.01 0.00 0.02 0.00 0.00 55.97 54.97 1u3r s LYS 353 Cb 0.00 -2.40 0.06 0.00 -0.52 0.00 0.00 37.83 34.97 1u3r s LYS 353 CO 0.00 0.48 -0.06 -0.51 -0.92 0.00 0.00 175.35 174.34 1u3r s LEU 354 N -2.73 3.68 -1.19 3.17 1.43 -0.56 -4.83 118.68 117.65 1u3r s LEU 354 Ca 0.26 -1.40 -0.14 0.00 -1.03 0.00 0.00 54.13 51.83 1u3r s LEU 354 Cb -0.10 -1.61 0.18 0.00 0.03 0.00 0.00 46.19 44.69 1u3r s LEU 354 CO 0.18 -0.23 1.39 -0.63 0.23 0.00 0.00 176.35 177.29 1u3r s ILE 355 N 1.14 5.11 0.40 -0.59 1.01 -1.26 -1.67 121.20 125.34 1u3r s ILE 355 Ca -0.07 -2.66 0.08 0.00 0.00 0.00 0.00 60.65 58.00 1u3r s ILE 355 Cb -0.20 -4.88 0.23 0.00 0.01 0.00 0.00 42.46 37.63 1u3r s ILE 355 CO -0.04 -1.57 2.01 -0.26 0.00 0.00 0.00 174.94 175.08 1u3r h PHE 356 N 7.18 0.43 -2.67 3.97 -1.00 -1.78 -3.43 116.94 119.64 1u3r h PHE 356 Ca 0.30 -0.01 0.05 0.00 2.81 0.00 0.00 57.97 61.12 1u3r h PHE 356 Cb 0.88 -0.14 -0.13 0.00 3.61 0.00 0.00 35.95 40.17 1u3r h PHE 356 CO 1.07 0.34 0.34 0.00 -1.61 0.00 0.00 178.31 178.45 1u3r s ALA 357 N -5.24 -1.68 0.35 2.45 0.00 -1.16 -4.96 121.76 111.53 1u3r s ALA 357 Ca -0.07 0.66 0.17 0.00 0.00 0.00 0.00 51.96 52.71 1u3r s ALA 357 Cb 0.17 0.68 1.21 0.00 0.00 0.00 0.00 23.12 25.18 1u3r s ALA 357 CO 0.73 -0.76 1.59 -1.35 0.00 0.00 0.00 175.76 175.97 1u3r h PRO 358 N 2.00 0.06 -0.18 0.00 0.11 -1.88 0.11 132.00 132.21 1u3r h PRO 358 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1u3r h PRO 358 Cb 1.28 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1u3r h PRO 358 CO 0.34 0.04 0.00 -3.47 -0.21 0.00 0.00 178.00 174.69 1u3r n ASP 359 N -5.26 3.03 -3.32 -2.05 2.03 -1.26 -4.72 116.55 105.00 1u3r n ASP 359 Ca 0.34 -2.64 -0.26 0.00 0.52 0.00 0.00 54.79 52.75 1u3r n ASP 359 Cb 1.15 -0.36 -0.07 0.00 -0.72 0.00 0.00 41.12 41.11 1u3r n ASP 359 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1u3r n LEU 360 N -0.47 2.92 -4.55 -2.67 7.94 0.37 -3.21 117.00 117.32 1u3r n LEU 360 Ca 0.15 -5.28 -0.41 0.00 -1.11 0.00 0.00 56.01 49.36 1u3r n LEU 360 Cb 0.63 -0.32 -0.09 0.00 0.53 0.00 0.00 43.42 44.17 1u3r n LEU 360 CO 0.08 2.09 0.05 -0.69 -1.11 0.00 0.00 177.39 177.81 1u3r s VAL 361 N -2.33 5.16 0.01 1.96 1.01 -1.25 -2.21 120.40 122.74 1u3r s VAL 361 Ca 0.40 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.54 1u3r s VAL 361 Cb 0.17 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1u3r s VAL 361 CO -0.04 -0.07 -0.07 -0.76 0.00 0.00 0.00 175.10 174.16 1u3r s LEU 362 N 2.05 3.18 0.41 3.92 1.43 -0.67 -4.95 118.68 124.04 1u3r s LEU 362 Ca 0.13 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.09 1u3r s LEU 362 Cb -0.16 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1u3r s LEU 362 CO 0.12 0.28 0.62 -1.81 0.23 0.00 0.00 176.35 175.78 1u3r s ASP 363 N -1.44 6.01 0.47 2.29 1.01 -1.26 -1.50 116.67 122.24 1u3r s ASP 363 Ca 0.17 0.32 0.21 0.00 0.71 0.00 0.00 52.55 53.96 1u3r s ASP 363 Cb -0.11 -1.69 1.19 0.00 1.01 0.00 0.00 42.92 43.31 1u3r s ASP 363 CO 0.08 -0.54 2.00 -0.09 0.21 0.00 0.00 175.17 176.83 1u3r h ARG 364 N 0.55 0.00 0.17 8.23 2.43 -1.97 -3.12 114.38 120.67 1u3r h ARG 364 Ca -0.47 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.69 1u3r h ARG 364 Cb 1.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1u3r h ARG 364 CO 0.58 0.18 -0.08 0.38 -1.51 0.00 0.00 179.97 179.52 1u3r h ASP 365 N 0.00 -0.19 -0.20 -3.80 -0.00 -1.93 -2.52 116.42 107.78 1u3r h ASP 365 Ca -0.00 -0.03 0.06 0.00 -0.00 0.00 0.00 57.03 57.06 1u3r h ASP 365 Cb 0.39 0.05 -0.01 0.00 -0.00 0.00 0.00 39.33 39.76 1u3r h ASP 365 CO 0.02 -0.10 0.40 -0.33 -0.00 0.00 0.00 179.24 179.24 1u3r h GLU 366 N -0.27 0.00 0.00 4.15 5.08 -1.95 0.72 114.58 122.32 1u3r h GLU 366 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1u3r h GLU 366 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1u3r h GLU 366 CO 0.04 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.46 1u3r n GLY 367 N -1.35 -0.32 0.07 -3.84 0.00 -0.95 -2.59 105.19 96.21 1u3r n GLY 367 Ca 0.03 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1u3r n GLY 367 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u3r h LYS 368 N 0.00 0.03 0.00 1.61 1.79 -1.03 -3.15 116.57 115.82 1u3r h LYS 368 Ca 0.00 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 1u3r h LYS 368 Cb 0.00 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1u3r h LYS 368 CO 0.00 0.92 0.00 0.00 -1.08 0.00 0.00 179.45 179.29 1u3r s VAL 370 N -2.59 1.93 -0.07 0.00 1.01 -1.24 -3.18 120.40 116.26 1u3r s VAL 370 Ca 0.08 -1.33 -0.32 0.00 0.00 0.00 0.00 61.98 60.41 1u3r s VAL 370 Cb 0.06 -2.01 -0.10 0.00 0.00 0.00 0.00 36.38 34.32 1u3r s VAL 370 CO 0.13 0.09 1.96 1.21 0.00 0.00 0.00 175.10 178.48 1u3r n GLU 371 N 4.55 2.33 -0.64 2.72 4.07 -1.26 -2.20 120.64 130.22 1u3r n GLU 371 Ca -0.15 0.84 0.00 0.00 -0.06 0.00 0.00 57.16 57.79 1u3r n GLU 371 Cb 0.45 -2.80 0.00 0.00 -0.06 0.00 0.00 31.44 29.02 1u3r n GLU 371 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1u3r n GLY 372 N 4.67 0.84 0.08 8.31 0.00 -1.26 -4.92 105.19 112.92 1u3r n GLY 372 Ca 0.23 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.17 1u3r n GLY 372 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1u3r n ILE 373 N -2.00 1.53 -0.30 -0.61 3.06 -0.93 -4.13 119.36 115.97 1u3r n ILE 373 Ca 0.00 -0.80 0.09 0.00 -2.50 0.00 0.00 62.75 59.54 1u3r n ILE 373 Cb 0.00 -0.92 0.25 0.00 0.54 0.00 0.00 39.64 39.51 1u3r n ILE 373 CO 0.00 0.00 0.00 0.25 -2.50 0.00 0.00 176.55 174.30 1u3r h LEU 374 N 0.00 0.49 -0.43 9.51 5.85 -1.71 0.13 115.31 129.14 1u3r h LEU 374 Ca -0.32 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.55 1u3r h LEU 374 Cb 2.01 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 43.04 1u3r h LEU 374 CO 0.07 0.16 0.21 -0.08 -0.34 0.00 0.00 178.44 178.47 1u3r h GLU 375 N 0.57 0.42 -0.49 1.25 4.81 -1.91 -0.12 114.58 119.10 1u3r h GLU 375 Ca 0.49 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.64 1u3r h GLU 375 Cb 0.77 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 1u3r h GLU 375 CO -0.41 0.28 0.08 0.82 -0.73 0.00 0.00 179.01 179.05 1u3r h ILE 376 N 0.43 1.25 0.00 2.32 2.04 -1.12 -1.59 117.51 120.84 1u3r h ILE 376 Ca 0.19 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1u3r h ILE 376 Cb 0.09 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1u3r h ILE 376 CO -0.13 0.33 -0.03 -0.26 0.00 0.00 0.00 178.15 178.06 1u3r h PHE 377 N 0.68 0.00 -0.10 1.37 -1.00 -0.41 -1.63 116.94 115.85 1u3r h PHE 377 Ca 0.15 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.86 1u3r h PHE 377 Cb 0.39 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.95 1u3r h PHE 377 CO 0.03 0.03 -0.19 -0.44 -1.61 0.00 0.00 178.31 176.12 1u3r h ASP 378 N 0.00 0.34 0.03 2.17 3.32 -0.06 -1.54 116.42 120.68 1u3r h ASP 378 Ca -0.00 -0.55 0.01 0.00 0.02 0.00 0.00 57.03 56.51 1u3r h ASP 378 Cb 0.06 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1u3r h ASP 378 CO 0.00 0.83 -0.11 0.24 -1.72 0.00 0.00 179.24 178.49 1u3r h MET 379 N -0.13 -0.19 -0.67 3.56 2.86 -0.85 0.24 114.93 119.75 1u3r h MET 379 Ca 0.00 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.73 1u3r h MET 379 Cb 0.77 0.04 -0.06 0.00 0.06 0.00 0.00 31.60 32.41 1u3r h MET 379 CO 0.04 -0.13 0.35 -0.07 1.06 0.00 0.00 176.91 178.16 1u3r h LEU 380 N -0.20 0.47 -0.68 1.22 3.38 -1.33 0.15 115.31 118.33 1u3r h LEU 380 Ca 0.03 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 1u3r h LEU 380 Cb 0.23 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1u3r h LEU 380 CO -0.09 0.29 -0.38 -0.07 0.09 0.00 0.00 178.44 178.29 1u3r h LEU 381 N 0.62 0.62 0.04 1.67 3.38 -1.03 -1.11 115.31 119.49 1u3r h LEU 381 Ca 0.32 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1u3r h LEU 381 Cb 0.28 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1u3r h LEU 381 CO -0.23 0.94 -0.02 0.00 0.09 0.00 0.00 178.44 179.22 1u3r h ALA 382 N 1.09 -0.05 -0.80 1.53 0.00 -0.04 -1.65 119.26 119.34 1u3r h ALA 382 Ca 0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1u3r h ALA 382 Cb 0.88 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 1u3r h ALA 382 CO 0.08 -0.38 0.38 1.15 0.00 0.00 0.00 179.25 180.48 1u3r h THR 383 N -0.34 1.25 -0.93 0.00 2.02 -0.72 -1.88 112.91 112.31 1u3r h THR 383 Ca -0.01 -0.71 0.03 0.00 0.77 0.00 0.00 66.41 66.49 1u3r h THR 383 Cb 0.32 0.23 -0.05 0.00 -1.74 0.00 0.00 68.15 66.90 1u3r h THR 383 CO 0.01 0.30 0.61 0.74 0.37 0.00 0.00 175.52 177.55 1u3r h THR 384 N 1.15 1.19 -0.84 3.16 2.02 -1.09 -2.01 112.91 116.48 1u3r h THR 384 Ca 0.28 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1u3r h THR 384 Cb 0.12 -0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 66.37 1u3r h THR 384 CO -0.03 0.22 0.49 0.28 0.37 0.00 0.00 175.52 176.85 1u3r h SER 385 N 1.21 1.02 -0.33 4.18 0.02 -0.50 -0.54 113.55 118.61 1u3r h SER 385 Ca 0.36 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 61.18 1u3r h SER 385 Cb -0.05 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.22 1u3r h SER 385 CO -0.10 0.79 -0.04 -0.09 -1.14 0.00 0.00 176.83 176.25 1u3r h ARG 386 N 1.16 0.61 -0.81 3.45 9.65 -0.93 0.35 114.38 127.87 1u3r h ARG 386 Ca 0.30 -0.21 -0.01 0.00 -1.10 0.00 0.00 59.98 58.96 1u3r h ARG 386 Cb -0.03 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.47 1u3r h ARG 386 CO -0.05 0.76 0.48 0.74 2.80 0.00 0.00 179.97 184.70 1u3r h PHE 387 N 0.41 1.08 -0.42 2.20 0.04 -1.05 0.10 116.94 119.29 1u3r h PHE 387 Ca 0.09 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 1u3r h PHE 387 Cb 0.51 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 1u3r h PHE 387 CO 0.04 0.73 0.21 -0.09 -0.60 0.00 0.00 178.31 178.60 1u3r h ARG 388 N 1.11 0.59 -0.52 1.51 2.43 -0.91 0.13 114.38 118.73 1u3r h ARG 388 Ca 0.29 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1u3r h ARG 388 Cb -0.03 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 1u3r h ARG 388 CO -0.05 0.50 0.24 1.49 -1.51 0.00 0.00 179.97 180.64 1u3r h GLU 389 N 0.53 0.73 -0.00 0.20 4.81 -0.37 0.14 114.58 120.62 1u3r h GLU 389 Ca 0.14 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1u3r h GLU 389 Cb 0.10 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1u3r h GLU 389 CO -0.02 0.57 -0.07 1.28 -0.73 0.00 0.00 179.01 180.05 1u3r n LEU 390 N -4.37 0.14 -3.58 1.64 4.77 0.30 -4.93 117.00 110.97 1u3r n LEU 390 Ca 0.04 0.28 -0.20 0.00 -0.03 0.00 0.00 56.01 56.11 1u3r n LEU 390 Cb 0.13 -0.34 0.06 0.00 -2.33 0.00 0.00 43.42 40.94 1u3r n LEU 390 CO 0.37 0.03 0.00 0.29 -1.33 0.00 0.00 177.39 176.76 1u3r n LYS 391 N -1.31 -5.38 -1.59 3.23 5.02 0.50 -4.87 118.16 113.76 1u3r n LYS 391 Ca 0.11 0.71 -0.48 0.00 -2.02 0.00 0.00 58.31 56.64 1u3r n LYS 391 Cb 0.29 -5.45 -0.03 0.00 -0.02 0.00 0.00 35.03 29.82 1u3r n LYS 391 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1u3r n LEU 392 N -4.17 1.70 -4.94 -0.35 7.94 -0.53 -4.97 117.00 111.68 1u3r n LEU 392 Ca -0.28 1.15 -0.24 0.00 -1.11 0.00 0.00 56.01 55.52 1u3r n LEU 392 Cb 0.67 -1.25 -0.03 0.00 0.53 0.00 0.00 43.42 43.34 1u3r n LEU 392 CO 0.65 -1.26 -0.09 -1.10 -1.11 0.00 0.00 177.39 174.48 1u3r s GLN 393 N -0.61 3.38 0.15 1.96 -1.52 -1.26 -4.98 119.66 116.78 1u3r s GLN 393 Ca 0.70 -0.68 -0.22 0.00 -1.95 0.00 0.00 55.36 53.20 1u3r s GLN 393 Cb -0.80 -2.90 0.03 0.00 -0.22 0.00 0.00 33.01 29.11 1u3r s GLN 393 CO 0.53 0.49 1.63 1.25 -0.25 0.00 0.00 175.29 178.94 1u3r h HIS 394 N 1.85 -0.61 -0.20 0.91 6.17 -1.99 0.11 115.15 121.39 1u3r h HIS 394 Ca -0.49 0.04 -0.02 0.00 0.71 0.00 0.00 60.37 60.61 1u3r h HIS 394 Cb 1.21 0.31 -0.01 0.00 2.52 0.00 0.00 27.41 31.43 1u3r h HIS 394 CO 0.51 -0.31 0.05 0.87 0.71 0.00 0.00 177.93 179.76 1u3r h LYS 395 N -0.24 0.28 -0.18 5.26 6.56 -1.99 -1.23 116.57 125.03 1u3r h LYS 395 Ca 0.14 -0.03 -0.06 0.00 -1.06 0.00 0.00 60.65 59.64 1u3r h LYS 395 Cb 0.45 -0.06 -0.00 0.00 -0.57 0.00 0.00 32.23 32.05 1u3r h LYS 395 CO -0.38 0.27 -0.12 0.93 -2.06 0.00 0.00 179.45 178.08 1u3r h GLU 396 N 0.28 0.41 -0.23 3.15 5.08 -1.69 -2.85 114.58 118.73 1u3r h GLU 396 Ca 0.07 -0.19 0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1u3r h GLU 396 Cb 0.11 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 1u3r h GLU 396 CO -0.00 0.73 -0.12 -0.92 -1.00 0.00 0.00 179.01 177.70 1u3r h TYR 397 N 0.08 -0.29 -0.61 4.33 3.20 -0.38 -0.31 116.97 123.00 1u3r h TYR 397 Ca 0.04 0.03 0.09 0.00 3.14 0.00 0.00 58.73 62.03 1u3r h TYR 397 Cb 0.62 0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.99 1u3r h TYR 397 CO 0.07 -0.18 0.23 -0.07 -1.64 0.00 0.00 178.16 176.57 1u3r h LEU 398 N -0.09 0.23 -0.36 2.82 3.38 -1.20 -0.04 115.31 120.04 1u3r h LEU 398 Ca 0.13 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 1u3r h LEU 398 Cb 0.28 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1u3r h LEU 398 CO -0.29 0.14 0.01 0.00 0.09 0.00 0.00 178.44 178.39 1u3r h VAL 400 N 0.44 1.17 -0.89 0.00 2.07 -0.42 0.38 116.25 119.00 1u3r h VAL 400 Ca 0.10 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.18 1u3r h VAL 400 Cb 0.44 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 1u3r h VAL 400 CO 0.02 0.18 0.59 0.50 0.02 0.00 0.00 177.57 178.87 1u3r h LYS 401 N 0.55 1.15 -0.31 1.57 3.64 -1.02 -0.29 116.57 121.86 1u3r h LYS 401 Ca 0.15 -0.07 -0.13 0.00 -1.27 0.00 0.00 60.65 59.33 1u3r h LYS 401 Cb 0.09 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 1u3r h LYS 401 CO -0.02 0.76 -0.34 0.00 -2.27 0.00 0.00 179.45 177.58 1u3r h ALA 402 N 1.34 0.83 -0.38 5.00 0.00 -1.22 -2.75 119.26 122.09 1u3r h ALA 402 Ca 0.33 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1u3r h ALA 402 Cb -0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1u3r h ALA 402 CO -0.08 0.64 -0.01 0.52 0.00 0.00 0.00 179.25 180.32 1u3r h MET 403 N 0.57 0.60 -0.57 0.00 2.86 -0.04 -1.73 114.93 116.61 1u3r h MET 403 Ca 0.06 -0.14 0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1u3r h MET 403 Cb 0.85 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.40 1u3r h MET 403 CO 0.07 0.63 0.36 0.82 1.06 0.00 0.00 176.91 179.85 1u3r h ILE 404 N 0.57 1.10 -0.05 -1.22 2.04 -0.79 0.96 117.51 120.11 1u3r h ILE 404 Ca 0.12 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1u3r h ILE 404 Cb 0.37 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1u3r h ILE 404 CO 0.01 0.13 0.00 0.25 0.00 0.00 0.00 178.15 178.55 1u3r h LEU 405 N 0.73 0.09 -0.44 1.44 5.85 -1.32 -3.02 115.31 118.64 1u3r h LEU 405 Ca 0.22 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1u3r h LEU 405 Cb -0.03 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1u3r h LEU 405 CO -0.08 0.38 0.00 0.18 -0.34 0.00 0.00 178.44 178.58 1u3r n LEU 406 N -4.88 0.54 -0.51 2.25 4.77 -0.69 -3.26 117.00 115.22 1u3r n LEU 406 Ca -0.07 0.61 0.10 0.00 -0.03 0.00 0.00 56.01 56.63 1u3r n LEU 406 Cb 0.18 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1u3r n LEU 406 CO 0.34 -0.42 0.33 -3.20 -1.33 0.00 0.00 177.39 173.10 1u3r n ASN 407 N -2.07 2.04 -0.63 -1.43 4.05 0.32 -4.40 115.26 113.14 1u3r n ASN 407 Ca 0.03 -1.52 0.00 0.00 0.45 0.00 0.00 54.58 53.54 1u3r n ASN 407 Cb 0.25 0.43 0.00 0.00 1.23 0.00 0.00 39.78 41.69 1u3r n ASN 407 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1u3r n SER 408 N 0.09 1.16 -4.20 1.20 3.41 -1.15 -5.06 113.62 109.06 1u3r n SER 408 Ca 0.09 -1.54 -0.34 0.00 -0.26 0.00 0.00 58.87 56.82 1u3r n SER 408 Cb 0.46 -0.38 0.14 0.00 -0.26 0.00 0.00 64.21 64.16 1u3r n SER 408 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1u3r n SER 409 N 0.24 -2.54 0.00 4.04 2.88 -1.26 -4.85 113.62 112.13 1u3r n SER 409 Ca 0.00 -0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1u3r n SER 409 Cb 0.24 -0.83 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 1u3r n SER 409 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1u3r n SER 422 N -0.35 0.00 -0.33 -3.46 7.64 -1.26 -5.14 113.62 110.72 1u3r n SER 422 Ca -0.00 0.00 0.29 0.00 1.01 0.00 0.00 58.87 60.16 1u3r n SER 422 Cb 0.66 0.00 0.61 0.00 -1.01 0.00 0.00 64.21 64.47 1u3r n SER 422 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1u3r h SER 423 N 0.00 0.26 0.52 6.43 0.87 -2.02 0.40 113.55 120.01 1u3r h SER 423 Ca 0.00 0.06 -0.29 0.00 -1.23 0.00 0.00 61.79 60.32 1u3r h SER 423 Cb 0.00 0.02 0.01 0.00 -0.44 0.00 0.00 62.40 61.99 1u3r h SER 423 CO 0.00 0.03 -1.34 0.03 -0.53 0.00 0.00 176.83 175.02 1u3r h ARG 424 N 0.22 0.34 0.00 2.24 2.47 -2.06 -3.14 114.38 114.46 1u3r h ARG 424 Ca 0.60 -0.58 -0.08 0.00 -1.26 0.00 0.00 59.98 58.66 1u3r h ARG 424 Cb 1.87 0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 30.40 1u3r h ARG 424 CO -0.20 1.27 -0.39 -0.22 0.56 0.00 0.00 179.97 181.00 1u3r h LYS 425 N 0.09 0.00 -0.34 0.04 3.64 -0.91 -2.89 116.57 116.21 1u3r h LYS 425 Ca -0.18 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.10 1u3r h LYS 425 Cb 2.03 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.84 1u3r h LYS 425 CO 0.22 0.39 -0.18 1.25 -2.27 0.00 0.00 179.45 178.85 1u3r h LEU 426 N 0.00 0.74 -1.00 5.20 5.85 -0.45 -1.56 115.31 124.10 1u3r h LEU 426 Ca -0.00 -0.41 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 1u3r h LEU 426 Cb 0.84 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.62 1u3r h LEU 426 CO 0.05 0.99 0.54 0.00 -0.34 0.00 0.00 178.44 179.69 1u3r h ALA 427 N 0.77 1.25 -0.34 1.25 0.00 -1.47 -0.25 119.26 120.48 1u3r h ALA 427 Ca 0.07 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1u3r h ALA 427 Cb 0.72 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1u3r h ALA 427 CO 0.05 0.64 -0.29 1.25 0.00 0.00 0.00 179.25 180.90 1u3r h HIS 428 N 1.25 0.95 -0.90 0.00 -0.00 -1.39 -1.63 115.15 113.43 1u3r h HIS 428 Ca 0.32 -0.27 -0.01 0.00 -0.00 0.00 0.00 60.37 60.41 1u3r h HIS 428 Cb -0.05 -0.20 -0.04 0.00 -0.00 0.00 0.00 27.41 27.12 1u3r h HIS 428 CO 0.01 1.05 0.51 -0.07 -0.00 0.00 0.00 177.93 179.42 1u3r h LEU 429 N 0.58 1.11 -0.63 0.26 4.07 -0.88 -0.70 115.31 119.12 1u3r h LEU 429 Ca 0.06 -0.09 -0.10 0.00 0.08 0.00 0.00 57.88 57.83 1u3r h LEU 429 Cb 0.87 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 42.30 1u3r h LEU 429 CO 0.08 0.88 0.01 0.25 -1.08 0.00 0.00 178.44 178.57 1u3r h LEU 430 N 1.26 1.05 -0.70 1.67 5.85 -0.88 -2.47 115.31 121.08 1u3r h LEU 430 Ca 0.32 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.62 1u3r h LEU 430 Cb 0.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 1u3r h LEU 430 CO -0.05 1.10 -0.36 0.78 -0.34 0.00 0.00 178.44 179.56 1u3r h ASN 431 N 0.98 0.61 0.06 1.25 2.35 -0.88 -1.01 115.58 118.95 1u3r h ASN 431 Ca 0.17 -0.26 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1u3r h ASN 431 Cb 0.55 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.75 1u3r h ASN 431 CO 0.03 0.92 -0.04 0.00 -1.65 0.00 0.00 177.43 176.69 1u3r h ALA 432 N 1.12 -0.09 -0.46 -0.83 0.00 -0.92 0.68 119.26 118.75 1u3r h ALA 432 Ca 0.05 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1u3r h ALA 432 Cb 0.86 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1u3r h ALA 432 CO 0.07 -0.55 -0.04 0.28 0.00 0.00 0.00 179.25 179.01 1u3r h VAL 433 N -0.10 1.25 -0.55 0.00 2.07 -1.38 -0.75 116.25 116.79 1u3r h VAL 433 Ca -0.00 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 1u3r h VAL 433 Cb 0.08 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1u3r h VAL 433 CO 0.00 0.37 0.26 0.74 0.02 0.00 0.00 177.57 178.96 1u3r h THR 434 N 0.72 1.20 -0.81 2.57 2.02 -0.66 0.38 112.91 118.34 1u3r h THR 434 Ca 0.13 -0.58 0.11 0.00 0.77 0.00 0.00 66.41 66.84 1u3r h THR 434 Cb 0.49 0.58 -0.08 0.00 -1.74 0.00 0.00 68.15 67.41 1u3r h THR 434 CO 0.03 0.23 0.44 0.44 0.37 0.00 0.00 175.52 177.03 1u3r h ASP 435 N 0.74 0.60 -0.42 4.18 3.32 0.10 -0.03 116.42 124.91 1u3r h ASP 435 Ca 0.19 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 1u3r h ASP 435 Cb 0.13 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1u3r h ASP 435 CO -0.02 0.33 0.21 0.00 -1.72 0.00 0.00 179.24 178.03 1u3r h ALA 436 N 1.47 0.53 -0.43 3.45 0.00 -0.12 -0.17 119.26 123.99 1u3r h ALA 436 Ca 0.40 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1u3r h ALA 436 Cb 0.43 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1u3r h ALA 436 CO -0.28 0.09 0.27 1.25 0.00 0.00 0.00 179.25 180.58 1u3r h LEU 437 N 0.53 0.52 -0.54 0.00 5.85 0.21 -0.09 115.31 121.78 1u3r h LEU 437 Ca 0.14 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.85 1u3r h LEU 437 Cb 0.11 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 1u3r h LEU 437 CO -0.02 0.41 0.31 0.58 -0.34 0.00 0.00 178.44 179.38 1u3r h VAL 438 N 0.58 1.03 -0.68 1.05 2.07 -0.82 -1.27 116.25 118.21 1u3r h VAL 438 Ca 0.16 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.50 1u3r h VAL 438 Cb -0.02 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.07 1u3r h VAL 438 CO -0.03 0.11 0.41 -0.25 0.02 0.00 0.00 177.57 177.83 1u3r h TRP 439 N 0.61 0.77 0.19 1.57 7.01 -0.37 -1.28 115.95 124.45 1u3r h TRP 439 Ca 0.23 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.24 1u3r h TRP 439 Cb 0.06 -0.25 0.00 0.00 -2.10 0.00 0.00 29.16 26.88 1u3r h TRP 439 CO -0.07 0.42 -0.09 0.28 -2.79 0.00 0.00 178.44 176.19 1u3r h VAL 440 N 0.79 0.86 -0.87 2.65 2.07 -0.44 -2.20 116.25 119.12 1u3r h VAL 440 Ca 0.28 -0.21 0.07 0.00 0.82 0.00 0.00 66.70 67.67 1u3r h VAL 440 Cb 0.06 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 1u3r h VAL 440 CO -0.13 0.05 0.56 0.40 0.02 0.00 0.00 177.57 178.48 1u3r h ILE 441 N -0.35 1.03 -0.28 4.57 2.04 -0.99 -1.25 117.51 122.29 1u3r h ILE 441 Ca -0.03 -0.32 -0.09 0.00 1.00 0.00 0.00 64.86 65.42 1u3r h ILE 441 Cb 0.27 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 1u3r h ILE 441 CO 0.04 0.17 -0.22 0.00 0.00 0.00 0.00 178.15 178.15 1u3r h ALA 442 N 1.54 1.11 0.00 1.87 0.00 -1.09 -1.82 119.26 120.87 1u3r h ALA 442 Ca 0.38 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1u3r h ALA 442 Cb 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1u3r h ALA 442 CO -0.15 0.55 0.00 1.17 0.00 0.00 0.00 179.25 180.83 1u3r n LYS 443 N -4.14 0.20 0.19 0.00 4.81 -0.48 -0.95 118.16 117.79 1u3r n LYS 443 Ca -0.00 0.15 0.08 0.00 -0.87 0.00 0.00 58.31 57.67 1u3r n LYS 443 Cb 0.39 -1.50 0.15 0.00 0.02 0.00 0.00 35.03 34.08 1u3r n LYS 443 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1u3r h SER 444 N 0.00 0.00 0.00 3.14 4.64 -1.23 -3.48 113.55 116.62 1u3r h SER 444 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u3r h SER 444 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1u3r h SER 444 CO 0.00 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.80 1u3r n GLY 445 N 1.05 0.79 3.81 -0.77 0.00 -0.13 -5.06 105.19 104.89 1u3r n GLY 445 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1u3r n GLY 445 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1u3r s ILE 446 N -3.01 3.64 0.69 -0.61 -4.36 -1.26 -4.97 121.20 111.31 1u3r s ILE 446 Ca 0.00 0.53 -0.17 0.00 -0.26 0.00 0.00 60.65 60.76 1u3r s ILE 446 Cb 0.00 -3.26 -0.03 0.00 1.25 0.00 0.00 42.46 40.41 1u3r s ILE 446 CO 0.00 -0.69 0.69 -1.54 0.24 0.00 0.00 174.94 173.64 1u3r n SER 447 N -3.26 -0.52 -0.33 4.36 3.41 -1.26 -4.67 113.62 111.35 1u3r n SER 447 Ca 0.07 0.65 0.07 0.00 -0.26 0.00 0.00 58.87 59.40 1u3r n SER 447 Cb 0.55 -1.28 0.23 0.00 -0.26 0.00 0.00 64.21 63.44 1u3r n SER 447 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1u3r h SER 448 N -0.18 0.79 0.24 4.04 0.87 -1.99 -0.46 113.55 116.85 1u3r h SER 448 Ca -0.46 0.06 -0.10 0.00 -1.23 0.00 0.00 61.79 60.06 1u3r h SER 448 Cb 1.35 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 63.21 1u3r h SER 448 CO 0.45 0.40 -0.38 -0.61 -0.53 0.00 0.00 176.83 176.16 1u3r h GLN 449 N 0.87 0.20 0.00 2.24 -0.00 -2.00 -2.34 115.11 114.07 1u3r h GLN 449 Ca 0.47 -0.09 0.00 0.00 -0.00 0.00 0.00 58.65 59.04 1u3r h GLN 449 Cb 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 27.99 1u3r h GLN 449 CO -0.29 0.56 0.00 1.96 0.00 0.00 0.00 178.83 181.06 1u3r h GLN 450 N 0.17 0.00 -0.11 1.69 1.08 -1.53 -2.54 115.11 113.87 1u3r h GLN 450 Ca 0.02 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.09 1u3r h GLN 450 Cb 0.76 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.19 1u3r h GLN 450 CO 0.06 0.00 -0.41 1.96 -0.95 0.00 0.00 178.83 179.49 1u3r h GLN 451 N 0.00 0.47 -0.82 1.46 4.20 -0.63 -1.35 115.11 118.45 1u3r h GLN 451 Ca 0.00 -0.36 -0.02 0.00 0.06 0.00 0.00 58.65 58.33 1u3r h GLN 451 Cb 0.97 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.78 1u3r h GLN 451 CO 0.00 0.99 0.42 0.77 -0.67 0.00 0.00 178.83 180.34 1u3r h SER 452 N 0.06 1.05 -0.52 1.46 0.02 -1.42 -0.68 113.55 113.51 1u3r h SER 452 Ca -0.02 -0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 60.73 1u3r h SER 452 Cb 1.04 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.30 1u3r h SER 452 CO 0.09 0.87 -0.01 -0.03 -1.14 0.00 0.00 176.83 176.61 1u3r h MET 453 N 1.15 0.93 -0.50 3.45 -1.53 -1.39 -1.64 114.93 115.41 1u3r h MET 453 Ca 0.29 -0.30 -0.12 0.00 -3.44 0.00 0.00 59.70 56.12 1u3r h MET 453 Cb 0.08 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 31.03 1u3r h MET 453 CO -0.04 0.95 -0.16 -0.09 0.14 0.00 0.00 176.91 177.71 1u3r h ARG 454 N 0.80 0.99 -0.94 0.39 2.43 -1.03 -0.59 114.38 116.42 1u3r h ARG 454 Ca 0.15 -0.40 0.02 0.00 -0.81 0.00 0.00 59.98 58.94 1u3r h ARG 454 Cb 0.54 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.99 1u3r h ARG 454 CO 0.03 1.07 0.62 1.25 -1.51 0.00 0.00 179.97 181.43 1u3r h LEU 455 N 0.85 1.05 -0.31 3.80 5.85 -0.95 -0.93 115.31 124.67 1u3r h LEU 455 Ca 0.12 -0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.70 1u3r h LEU 455 Cb 0.73 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1u3r h LEU 455 CO 0.06 0.74 -0.28 0.00 -0.34 0.00 0.00 178.44 178.61 1u3r h ALA 456 N 1.37 0.46 -0.70 1.25 0.00 -1.02 -2.46 119.26 118.16 1u3r h ALA 456 Ca 0.36 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1u3r h ALA 456 Cb -0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1u3r h ALA 456 CO -0.10 0.47 0.33 -0.91 0.00 0.00 0.00 179.25 179.04 1u3r h ASN 457 N 0.51 0.92 -0.12 0.00 2.35 -0.68 -0.82 115.58 117.73 1u3r h ASN 457 Ca 0.05 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.65 1u3r h ASN 457 Cb 0.85 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.98 1u3r h ASN 457 CO 0.07 0.80 0.01 -0.07 -1.65 0.00 0.00 177.43 176.59 1u3r h LEU 458 N 0.97 0.20 -1.12 1.61 3.38 -1.18 -3.22 115.31 115.95 1u3r h LEU 458 Ca 0.24 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 1u3r h LEU 458 Cb 0.13 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1u3r h LEU 458 CO -0.03 0.44 -0.41 -0.07 0.09 0.00 0.00 178.44 178.46 1u3r h LEU 459 N -0.05 0.00 -2.21 1.67 3.38 -1.32 -2.59 115.31 114.19 1u3r h LEU 459 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1u3r h LEU 459 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1u3r h LEU 459 CO 0.00 0.41 0.00 0.24 0.09 0.00 0.00 178.44 179.19 1u3r h MET 460 N 0.00 0.00 0.00 1.13 2.86 -1.16 -1.58 114.93 116.18 1u3r h MET 460 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1u3r h MET 460 Cb 0.80 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.46 1u3r h MET 460 CO 0.05 0.00 -0.03 -0.07 1.06 0.00 0.00 176.91 177.92 1u3r h LEU 461 N 0.00 0.00 -1.55 1.22 3.38 -1.52 -3.27 115.31 113.57 1u3r h LEU 461 Ca 0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1u3r h LEU 461 Cb 0.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1u3r h LEU 461 CO 0.00 0.00 0.25 -0.07 0.09 0.00 0.00 178.44 178.71 1u3r h LEU 462 N 0.00 0.49 -1.16 1.67 3.38 -1.41 -0.77 115.31 117.51 1u3r h LEU 462 Ca 0.00 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1u3r h LEU 462 Cb 0.80 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1u3r h LEU 462 CO 0.00 0.37 0.32 0.28 0.09 0.00 0.00 178.44 179.50 1u3r h SER 463 N 0.57 0.82 -0.38 -0.43 0.02 -1.74 0.07 113.55 112.47 1u3r h SER 463 Ca 0.15 -0.08 -0.14 0.00 -0.84 0.00 0.00 61.79 60.88 1u3r h SER 463 Cb -0.03 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 1u3r h SER 463 CO -0.03 0.68 -0.33 0.45 -1.14 0.00 0.00 176.83 176.47 1u3r h HIS 464 N 0.91 1.06 -0.31 3.45 3.86 -1.35 -0.98 115.15 121.78 1u3r h HIS 464 Ca 0.23 -0.31 -0.02 0.00 -1.16 0.00 0.00 60.37 59.11 1u3r h HIS 464 Cb 0.08 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.30 1u3r h HIS 464 CO 0.01 1.12 0.12 0.28 0.86 0.00 0.00 177.93 180.32 1u3r h VAL 465 N 0.70 1.18 -0.94 2.45 2.07 -0.95 -1.09 116.25 119.68 1u3r h VAL 465 Ca 0.07 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.07 1u3r h VAL 465 Cb 0.92 0.97 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 1u3r h VAL 465 CO 0.08 0.19 0.61 -0.09 0.02 0.00 0.00 177.57 178.39 1u3r h ARG 466 N 0.36 1.13 -0.28 1.57 9.65 -0.86 0.03 114.38 125.97 1u3r h ARG 466 Ca 0.10 -0.07 -0.05 0.00 -1.10 0.00 0.00 59.98 58.87 1u3r h ARG 466 Cb 0.19 -0.25 -0.01 0.00 -1.39 0.00 0.00 29.97 28.50 1u3r h ARG 466 CO -0.01 0.74 -0.02 1.25 2.80 0.00 0.00 179.97 184.74 1u3r h HIS 467 N 1.16 0.56 -0.49 2.20 2.76 -0.82 -1.43 115.15 119.09 1u3r h HIS 467 Ca 0.38 -0.10 -0.02 0.00 -2.20 0.00 0.00 60.37 58.43 1u3r h HIS 467 Cb 0.05 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 1u3r h HIS 467 CO -0.01 0.67 0.21 0.00 -1.30 0.00 0.00 177.93 177.50 1u3r h ALA 468 N 0.81 1.44 -0.14 5.26 0.00 -0.80 -1.27 119.26 124.57 1u3r h ALA 468 Ca 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1u3r h ALA 468 Cb 0.46 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1u3r h ALA 468 CO 0.02 0.43 0.05 1.03 0.00 0.00 0.00 179.25 180.78 1u3r h SER 469 N 0.70 0.19 -0.47 0.00 0.87 -0.68 0.13 113.55 114.30 1u3r h SER 469 Ca 0.17 -0.17 0.05 0.00 -1.23 0.00 0.00 61.79 60.61 1u3r h SER 469 Cb 0.12 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 61.99 1u3r h SER 469 CO -0.02 0.31 0.20 0.78 -0.53 0.00 0.00 176.83 177.57 1u3r h ASN 470 N 0.06 0.24 -0.40 6.23 -0.26 -0.78 0.10 115.58 120.78 1u3r h ASN 470 Ca 0.05 0.04 -0.11 0.00 -0.56 0.00 0.00 56.30 55.72 1u3r h ASN 470 Cb 0.18 0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 37.43 1u3r h ASN 470 CO -0.00 0.17 -0.14 0.11 -1.06 0.00 0.00 177.43 176.51 1u3r h LYS 471 N 0.39 0.86 -0.56 0.81 1.79 -1.06 -1.46 116.57 117.34 1u3r h LYS 471 Ca 0.22 -0.32 -0.11 0.00 -2.18 0.00 0.00 60.65 58.26 1u3r h LYS 471 Cb 0.18 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 1u3r h LYS 471 CO -0.19 0.95 -0.06 0.78 -1.08 0.00 0.00 179.45 179.85 1u3r h GLY 472 N 0.96 1.11 1.49 3.86 0.00 -0.05 -0.85 103.07 109.58 1u3r h GLY 472 Ca 0.12 -0.86 -0.19 0.00 0.00 0.00 0.00 47.33 46.40 1u3r h GLY 472 CO 0.05 0.79 -0.70 -0.33 0.00 0.00 0.00 176.54 176.34 1u3r h MET 473 N 0.92 0.51 -0.60 4.80 2.86 -0.72 -1.20 114.93 121.50 1u3r h MET 473 Ca 0.15 -0.40 -0.06 0.00 -2.06 0.00 0.00 59.70 57.34 1u3r h MET 473 Cb 0.62 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.33 1u3r h MET 473 CO 0.04 1.02 0.15 1.49 1.06 0.00 0.00 176.91 180.68 1u3r h GLU 474 N 0.36 0.96 -0.58 1.72 4.57 -1.14 -1.58 114.58 118.89 1u3r h GLU 474 Ca -0.03 -0.23 -0.05 0.00 -1.18 0.00 0.00 59.36 57.87 1u3r h GLU 474 Cb 1.28 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.72 1u3r h GLU 474 CO 0.13 0.88 0.16 1.25 -1.18 0.00 0.00 179.01 180.24 1u3r h HIS 475 N 0.87 0.95 -0.66 0.92 2.76 -1.04 -2.39 115.15 116.56 1u3r h HIS 475 Ca 0.19 -0.11 -0.05 0.00 -2.20 0.00 0.00 60.37 58.21 1u3r h HIS 475 Cb 0.34 -0.27 -0.03 0.00 1.55 0.00 0.00 27.41 29.00 1u3r h HIS 475 CO 0.02 0.80 0.24 1.25 -1.30 0.00 0.00 177.93 178.95 1u3r h LEU 476 N 0.82 0.94 -0.36 0.26 5.85 -1.01 -1.63 115.31 120.16 1u3r h LEU 476 Ca 0.18 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1u3r h LEU 476 Cb 0.32 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1u3r h LEU 476 CO -0.00 0.87 0.23 0.25 -0.34 0.00 0.00 178.44 179.46 1u3r h LEU 477 N 0.95 0.40 -1.11 2.25 5.85 -1.12 -1.27 115.31 121.25 1u3r h LEU 477 Ca 0.22 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 1u3r h LEU 477 Cb 0.25 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1u3r h LEU 477 CO -0.01 0.29 0.27 -1.13 -0.34 0.00 0.00 178.44 177.51 1u3r h ASN 478 N 0.48 0.81 0.19 1.25 -0.73 -1.17 -0.43 115.58 115.98 1u3r h ASN 478 Ca 0.14 -0.10 -0.10 0.00 1.87 0.00 0.00 56.30 58.11 1u3r h ASN 478 Cb -0.04 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.33 1u3r h ASN 478 CO -0.04 0.71 -0.38 0.24 -0.37 0.00 0.00 177.43 177.59 1u3r h MET 479 N 0.88 0.26 -0.17 6.67 2.86 -0.85 -0.39 114.93 124.19 1u3r h MET 479 Ca 0.21 -0.12 -0.09 0.00 -2.06 0.00 0.00 59.70 57.64 1u3r h MET 479 Cb 0.14 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1u3r h MET 479 CO -0.02 0.61 -0.24 -0.22 1.06 0.00 0.00 176.91 178.10 1u3r h LYS 480 N 0.23 0.47 -0.71 1.72 3.64 -0.47 -0.22 116.57 121.22 1u3r h LYS 480 Ca 0.02 -0.27 -0.07 0.00 -1.27 0.00 0.00 60.65 59.06 1u3r h LYS 480 Cb 0.78 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.59 1u3r h LYS 480 CO 0.06 0.86 0.17 0.00 -2.27 0.00 0.00 179.45 178.27 1u3r n LYS 482 N -4.23 0.83 -1.89 0.00 5.02 -0.17 -4.86 118.16 112.86 1u3r n LYS 482 Ca 0.05 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.14 1u3r n LYS 482 Cb 0.27 -1.35 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 1u3r n LYS 482 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1u3r n ASN 483 N -0.85 -5.56 0.24 4.39 3.02 -0.75 -4.86 115.26 110.89 1u3r n ASN 483 Ca 0.14 0.30 0.11 0.00 -0.03 0.00 0.00 54.58 55.11 1u3r n ASN 483 Cb 0.06 -4.74 0.55 0.00 -0.61 0.00 0.00 39.78 35.04 1u3r n ASN 483 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1u3r h VAL 484 N 0.00 0.53 -1.81 2.41 2.07 -1.27 -3.45 116.25 114.72 1u3r h VAL 484 Ca -0.44 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.15 1u3r h VAL 484 Cb 1.33 1.64 -0.23 0.00 -1.52 0.00 0.00 31.29 32.51 1u3r h VAL 484 CO 0.59 0.18 0.30 0.54 0.02 0.00 0.00 177.57 179.20 1u3r s VAL 485 N -3.79 0.00 0.35 2.57 0.11 -1.22 -4.64 120.40 113.78 1u3r s VAL 485 Ca -0.00 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 58.79 1u3r s VAL 485 Cb 0.11 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.87 1u3r s VAL 485 CO 0.62 0.00 1.03 -2.16 -3.33 0.00 0.00 175.10 171.26 1u3r s PRO 486 N -0.05 4.37 -0.33 1.54 0.04 -1.26 -4.39 135.00 134.92 1u3r s PRO 486 Ca -0.01 1.53 -0.04 0.00 0.04 0.00 0.00 61.00 62.52 1u3r s PRO 486 Cb -0.04 -2.74 0.05 0.00 0.04 0.00 0.00 34.50 31.81 1u3r s PRO 486 CO -0.00 0.04 0.06 0.08 0.04 0.00 0.00 177.00 177.22 1u3r s VAL 487 N -1.54 3.37 0.97 -0.36 1.01 -1.26 -5.03 120.40 117.56 1u3r s VAL 487 Ca 0.53 -1.33 -0.16 0.00 0.00 0.00 0.00 61.98 61.03 1u3r s VAL 487 Cb -0.23 -2.95 -0.09 0.00 0.00 0.00 0.00 36.38 33.11 1u3r s VAL 487 CO 0.29 -0.19 -0.37 -1.22 0.00 0.00 0.00 175.10 173.62 1u3r n TYR 488 N 4.70 -3.88 0.10 5.22 4.01 -1.26 -4.40 117.16 121.66 1u3r n TYR 488 Ca -0.12 0.06 -0.10 0.00 -0.16 0.00 0.00 57.90 57.58 1u3r n TYR 488 Cb 0.44 -1.56 -0.06 0.00 -0.31 0.00 0.00 39.34 37.85 1u3r n TYR 488 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1u3r h ASP 489 N -1.17 -0.93 0.15 7.72 3.32 -1.98 1.17 116.42 124.69 1u3r h ASP 489 Ca -0.44 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 1u3r h ASP 489 Cb 1.30 0.34 0.00 0.00 0.22 0.00 0.00 39.33 41.18 1u3r h ASP 489 CO 0.27 -0.36 -0.07 0.25 -1.72 0.00 0.00 179.24 177.61 1u3r h LEU 490 N -0.50 -0.17 -0.85 1.55 5.85 -1.98 -0.60 115.31 118.62 1u3r h LEU 490 Ca -0.01 -0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.82 1u3r h LEU 490 Cb 0.48 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.47 1u3r h LEU 490 CO -0.14 -0.10 0.47 0.25 -0.34 0.00 0.00 178.44 178.59 1u3r h LEU 491 N -0.21 0.64 -0.36 2.25 5.85 -1.89 -1.07 115.31 120.52 1u3r h LEU 491 Ca -0.02 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 1u3r h LEU 491 Cb 0.17 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1u3r h LEU 491 CO 0.03 0.33 -0.07 0.25 -0.34 0.00 0.00 178.44 178.64 1u3r h LEU 492 N 0.74 0.68 -0.53 2.25 5.85 0.17 -0.43 115.31 124.05 1u3r h LEU 492 Ca 0.44 -0.35 0.03 0.00 0.84 0.00 0.00 57.88 58.83 1u3r h LEU 492 Cb 0.50 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 1u3r h LEU 492 CO -0.30 0.87 0.31 -0.33 -0.34 0.00 0.00 178.44 178.65 1u3r h GLU 493 N 0.48 0.59 -0.49 1.25 5.08 -0.29 -0.49 114.58 120.70 1u3r h GLU 493 Ca 0.09 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1u3r h GLU 493 Cb 0.56 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1u3r h GLU 493 CO 0.03 0.39 0.04 0.52 -1.00 0.00 0.00 179.01 178.99 1u3r h MET 494 N 0.60 0.79 0.43 2.33 2.86 -1.10 0.07 114.93 120.92 1u3r h MET 494 Ca 0.22 -0.19 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1u3r h MET 494 Cb 0.05 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1u3r h MET 494 CO -0.11 0.77 -0.21 1.25 1.06 0.00 0.00 176.91 179.68 1u3r h LEU 495 N 0.75 -0.49 -1.07 1.22 6.46 -0.31 -3.13 115.31 118.74 1u3r h LEU 495 Ca 0.15 -0.08 -0.03 0.00 -0.12 0.00 0.00 57.88 57.81 1u3r h LEU 495 Cb 0.40 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.42 1u3r h LEU 495 CO 0.01 -0.20 0.32 0.78 -0.62 0.00 0.00 178.44 178.73 1u3r h ASN 496 N -0.78 0.88 -4.93 1.25 -0.26 -1.07 -3.47 115.58 107.21 1u3r h ASN 496 Ca -0.06 -0.10 -0.35 0.00 -0.56 0.00 0.00 56.30 55.23 1u3r h ASN 496 Cb 0.54 -0.23 0.11 0.00 -1.06 0.00 0.00 38.32 37.68 1u3r h ASN 496 CO 0.10 0.75 -0.58 0.00 -1.06 0.00 0.00 177.43 176.64 1u3r n ALA 497 N -2.44 -1.07 -2.77 -0.83 0.00 0.00 -4.94 120.51 108.47 1u3r n ALA 497 Ca 0.06 0.33 -0.03 0.00 0.00 0.00 0.00 53.44 53.80 1u3r n ALA 497 Cb 0.14 -4.57 0.05 0.00 0.00 0.00 0.00 19.45 15.08 1u3r n ALA 497 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1u3r n HIS 498 N -4.62 0.84 -0.17 0.00 8.25 -1.26 -4.92 115.22 113.34 1u3r n HIS 498 Ca -0.02 -2.31 0.23 0.00 -0.26 0.00 0.00 57.72 55.37 1u3r n HIS 498 Cb 0.57 -0.07 0.64 0.00 1.12 0.00 0.00 29.99 32.24 1u3r n HIS 498 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1u3r h VAL 499 N 4.53 0.64 0.00 1.59 2.07 -1.92 0.82 116.25 123.98 1u3r h VAL 499 Ca -0.16 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1u3r h VAL 499 Cb 1.25 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1u3r h VAL 499 CO 0.24 0.03 -0.23 -0.07 0.02 0.00 0.00 177.57 177.56 1u3r h LEU 500 N 0.16 0.00 0.00 2.57 3.38 -1.99 -3.55 115.31 115.87 1u3r h LEU 500 Ca 0.40 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1u3r h LEU 500 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1u3r h LEU 500 CO -0.07 0.03 0.00 0.54 0.09 0.00 0.00 178.44 179.03