#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lby s ASP 302 N 0.00 5.37 0.41 6.12 -1.08 -1.26 -4.95 116.67 121.28 1lby s ASP 302 Ca 0.00 -0.14 0.22 0.00 -0.52 0.00 0.00 52.55 52.11 1lby s ASP 302 Cb 0.00 -1.37 1.21 0.00 -1.46 0.00 0.00 42.92 41.30 1lby s ASP 302 CO 0.00 0.11 1.72 -0.33 0.52 0.00 0.00 175.17 177.19 1lby h GLU 303 N 2.79 0.28 0.00 4.34 5.08 -2.00 1.20 114.58 126.27 1lby h GLU 303 Ca -0.47 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 57.76 1lby h GLU 303 Cb 1.19 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 1lby h GLU 303 CO 0.63 0.18 -0.53 -0.09 -1.00 0.00 0.00 179.01 178.20 1lby h ARG 304 N 0.29 0.00 0.17 2.33 2.43 -1.96 -3.04 114.38 114.59 1lby h ARG 304 Ca 0.67 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.83 1lby h ARG 304 Cb 1.86 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.41 1lby h ARG 304 CO -0.35 0.53 -0.08 -0.44 -1.51 0.00 0.00 179.97 178.12 1lby h ASP 305 N 0.00 -0.19 -0.96 -3.80 3.32 0.83 -3.16 116.42 112.45 1lby h ASP 305 Ca -0.01 -0.34 0.17 0.00 0.02 0.00 0.00 57.03 56.88 1lby h ASP 305 Cb 1.25 0.05 -0.10 0.00 0.22 0.00 0.00 39.33 40.75 1lby h ASP 305 CO 0.07 0.31 0.56 0.00 -1.72 0.00 0.00 179.24 178.45 1lby h ALA 306 N -0.15 1.54 -0.62 3.45 0.00 -0.30 0.00 119.26 123.19 1lby h ALA 306 Ca -0.02 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1lby h ALA 306 Cb 0.52 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1lby h ALA 306 CO 0.04 -0.05 0.02 1.25 0.00 0.00 0.00 179.25 180.50 1lby h LEU 307 N 0.73 1.06 -0.40 0.00 5.85 -1.63 0.59 115.31 121.51 1lby h LEU 307 Ca 0.54 -0.29 -0.16 0.00 0.84 0.00 0.00 57.88 58.81 1lby h LEU 307 Cb 0.81 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1lby h LEU 307 CO -0.38 1.10 -0.40 -0.09 -0.34 0.00 0.00 178.44 178.33 1lby h ARG 308 N 0.99 0.92 0.52 1.25 2.43 -1.04 0.22 114.38 119.69 1lby h ARG 308 Ca 0.18 -0.49 -0.02 0.00 -0.81 0.00 0.00 59.98 58.84 1lby h ARG 308 Cb 0.54 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1lby h ARG 308 CO 0.03 1.15 -0.50 0.82 -1.51 0.00 0.00 179.97 179.95 1lby h ILE 309 N 0.75 0.02 -0.96 1.20 1.08 -1.01 -0.74 117.51 117.85 1lby h ILE 309 Ca 0.06 0.00 0.20 0.00 -0.39 0.00 0.00 64.86 64.73 1lby h ILE 309 Cb 0.99 0.02 -0.11 0.00 -3.07 0.00 0.00 36.82 34.65 1lby h ILE 309 CO 0.10 0.00 0.55 0.28 -0.69 0.00 0.00 178.15 178.38 1lby h SER 310 N -1.02 0.64 -0.22 1.72 0.02 -0.73 -1.38 113.55 112.58 1lby h SER 310 Ca -0.06 0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1lby h SER 310 Cb 0.88 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 1lby h SER 310 CO -0.05 0.18 -0.06 0.03 -1.14 0.00 0.00 176.83 175.78 1lby h ARG 311 N 0.64 0.42 -0.34 3.45 3.08 -0.09 -1.71 114.38 119.83 1lby h ARG 311 Ca 0.58 -0.17 0.08 0.00 0.07 0.00 0.00 59.98 60.53 1lby h ARG 311 Cb 0.97 -0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.92 1lby h ARG 311 CO -0.43 0.68 -0.22 0.93 -1.07 0.00 0.00 179.97 179.86 1lby h GLU 312 N 0.15 -0.17 -0.49 0.04 5.08 -0.08 -2.36 114.58 116.75 1lby h GLU 312 Ca 0.05 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1lby h GLU 312 Cb 0.53 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1lby h GLU 312 CO 0.02 -0.11 0.22 0.82 -1.00 0.00 0.00 179.01 178.97 1lby h ILE 313 N -0.17 1.20 -0.68 3.13 2.04 -1.26 -0.52 117.51 121.25 1lby h ILE 313 Ca 0.17 -0.57 0.05 0.00 1.00 0.00 0.00 64.86 65.52 1lby h ILE 313 Cb 0.44 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1lby h ILE 313 CO -0.45 0.22 0.39 0.00 0.00 0.00 0.00 178.15 178.31 1lby h ALA 314 N 1.07 0.90 -0.32 1.87 0.00 -1.10 1.45 119.26 123.14 1lby h ALA 314 Ca 0.17 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1lby h ALA 314 Cb 0.14 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1lby h ALA 314 CO -0.02 0.09 -0.17 0.78 0.00 0.00 0.00 179.25 179.93 1lby h GLY 315 N 0.73 0.74 0.95 0.00 0.00 -1.00 0.70 103.07 105.18 1lby h GLY 315 Ca 0.30 -0.67 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1lby h GLY 315 CO -0.17 0.61 -0.04 0.83 0.00 0.00 0.00 176.54 177.78 1lby h GLU 316 N 0.44 0.70 0.00 4.80 4.39 -0.76 -1.13 114.58 123.02 1lby h GLU 316 Ca 0.07 -0.24 -0.07 0.00 0.34 0.00 0.00 59.36 59.45 1lby h GLU 316 Cb 0.71 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 1lby h GLU 316 CO 0.05 0.82 -0.35 0.28 -1.16 0.00 0.00 179.01 178.65 1lby h VAL 317 N 0.51 0.95 -0.01 3.13 2.07 0.21 -2.25 116.25 120.87 1lby h VAL 317 Ca 0.10 -1.36 -0.27 0.00 0.82 0.00 0.00 66.70 66.00 1lby h VAL 317 Cb 0.53 1.80 0.02 0.00 -1.52 0.00 0.00 31.29 32.13 1lby h VAL 317 CO 0.03 0.35 -1.03 -0.09 0.02 0.00 0.00 177.57 176.84 1lby h ARG 318 N 0.00 0.71 -0.08 1.57 1.12 0.64 -2.38 114.38 115.97 1lby h ARG 318 Ca -0.00 -0.76 -0.00 0.00 -1.11 0.00 0.00 59.98 58.11 1lby h ARG 318 Cb 0.77 0.21 -0.00 0.00 -0.01 0.00 0.00 29.97 30.94 1lby h ARG 318 CO 0.05 1.33 0.04 1.57 -3.11 0.00 0.00 179.97 179.85 1lby h LYS 319 N 0.41 0.11 -0.60 0.20 2.10 -1.06 -1.53 116.57 116.19 1lby h LYS 319 Ca -0.13 -0.01 0.11 0.00 -2.00 0.00 0.00 60.65 58.62 1lby h LYS 319 Cb 1.68 -0.02 -0.09 0.00 -0.90 0.00 0.00 32.23 32.91 1lby h LYS 319 CO 0.20 0.16 0.11 0.00 -2.00 0.00 0.00 179.45 177.93 1lby h ALA 320 N 0.94 0.70 -0.05 0.07 0.00 -1.44 -2.40 119.26 117.08 1lby h ALA 320 Ca 0.03 0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 1lby h ALA 320 Cb 0.08 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1lby h ALA 320 CO -0.00 -0.32 -0.35 0.82 0.00 0.00 0.00 179.25 179.39 1lby h ILE 321 N 0.24 1.44 -0.06 0.00 1.08 -1.31 -3.25 117.51 115.66 1lby h ILE 321 Ca 0.31 -1.81 0.02 0.00 -0.39 0.00 0.00 64.86 62.99 1lby h ILE 321 Cb 0.47 2.43 -0.00 0.00 -3.07 0.00 0.00 36.82 36.66 1lby h ILE 321 CO -0.41 0.52 0.12 0.00 -0.69 0.00 0.00 178.15 177.69 1lby h ALA 322 N 0.39 1.42 -0.64 1.87 0.00 -0.79 -1.13 119.26 120.38 1lby h ALA 322 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1lby h ALA 322 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1lby h ALA 322 CO 0.07 -0.15 0.00 -1.13 0.00 0.00 0.00 179.25 178.04 1lby n SER 323 N -3.43 3.99 -4.63 0.00 3.41 -1.03 -4.86 113.62 107.06 1lby n SER 323 Ca -0.01 -2.19 -0.35 0.00 -0.26 0.00 0.00 58.87 56.06 1lby n SER 323 Cb 0.21 -0.50 -0.10 0.00 -0.26 0.00 0.00 64.21 63.56 1lby n SER 323 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1lby s MET 324 N -1.44 3.51 0.75 4.33 1.00 -0.43 -5.09 119.30 121.93 1lby s MET 324 Ca 0.46 -0.40 -0.14 0.00 0.00 0.00 0.00 55.69 55.62 1lby s MET 324 Cb 0.27 -2.98 0.05 0.00 0.00 0.00 0.00 34.83 32.17 1lby s MET 324 CO 0.27 0.45 1.17 -2.14 0.00 0.00 0.00 175.02 174.77 1lby s PRO 325 N -0.18 2.07 0.39 2.03 0.02 -1.26 -4.82 135.00 133.25 1lby s PRO 325 Ca 0.06 1.61 0.06 0.00 0.02 0.00 0.00 61.00 62.75 1lby s PRO 325 Cb -0.12 -1.84 0.80 0.00 0.02 0.00 0.00 34.50 33.35 1lby s PRO 325 CO 0.02 -1.85 2.01 -0.07 -0.33 0.00 0.00 177.00 176.78 1lby h LEU 326 N -0.58 0.57 -0.43 -5.54 3.38 -1.92 -1.15 115.31 109.64 1lby h LEU 326 Ca -0.46 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 57.59 1lby h LEU 326 Cb 1.28 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.80 1lby h LEU 326 CO 0.49 0.39 -0.24 -0.09 0.09 0.00 0.00 178.44 179.09 1lby h ARG 327 N 0.66 -0.15 0.00 1.13 2.43 -1.91 -2.48 114.38 114.06 1lby h ARG 327 Ca 0.23 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.29 1lby h ARG 327 Cb 0.10 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 1lby h ARG 327 CO -0.06 -0.10 -0.58 0.93 -1.51 0.00 0.00 179.97 178.65 1lby h GLU 328 N -0.16 0.00 0.47 0.20 3.07 -1.74 -3.37 114.58 113.05 1lby h GLU 328 Ca 0.20 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.04 1lby h GLU 328 Cb 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1lby h GLU 328 CO -0.52 0.58 -0.23 0.00 -1.40 0.00 0.00 179.01 177.44 1lby h ARG 329 N 0.00 -0.61 0.00 2.33 3.08 -0.80 -3.32 114.38 115.06 1lby h ARG 329 Ca -0.01 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1lby h ARG 329 Cb 1.35 0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.54 1lby h ARG 329 CO 0.08 -0.32 0.00 1.55 -1.07 0.00 0.00 179.97 180.20 1lby n VAL 330 N -5.21 0.00 -2.35 2.04 3.14 -0.99 -2.58 118.33 112.37 1lby n VAL 330 Ca -0.09 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.86 1lby n VAL 330 Cb 0.29 -0.75 -0.02 0.00 -1.06 0.00 0.00 33.84 32.30 1lby n VAL 330 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1lby s LYS 331 N -2.00 4.00 0.26 1.45 1.02 -1.25 -4.81 119.74 118.42 1lby s LYS 331 Ca 0.19 1.47 -0.30 0.00 0.02 0.00 0.00 55.97 57.35 1lby s LYS 331 Cb 0.09 -3.88 -0.13 0.00 -0.52 0.00 0.00 37.83 33.38 1lby s LYS 331 CO 0.14 -1.02 1.33 -0.25 -0.92 0.00 0.00 175.35 174.63 1lby n ASP 332 N 7.46 2.55 0.00 2.83 8.00 -1.26 0.79 116.55 136.92 1lby n ASP 332 Ca 0.15 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.81 1lby n ASP 332 Cb 0.46 -1.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 1lby n ASP 332 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1lby n VAL 333 N 1.36 0.00 -1.90 2.53 0.24 0.16 -4.78 118.33 115.94 1lby n VAL 333 Ca 0.10 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 1lby n VAL 333 Cb 0.32 1.22 0.00 0.00 -1.47 0.00 0.00 33.84 33.91 1lby n VAL 333 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1lby n GLY 334 N 0.28 -1.49 3.58 7.63 0.00 -1.12 -4.97 105.19 109.11 1lby n GLY 334 Ca 0.00 -1.03 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 1lby n GLY 334 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1lby s MET 335 N -1.27 3.84 0.82 1.61 1.75 -1.26 -0.21 119.30 124.58 1lby s MET 335 Ca 0.00 -0.11 -0.11 0.00 -1.25 0.00 0.00 55.69 54.23 1lby s MET 335 Cb 0.00 -3.72 0.08 0.00 2.84 0.00 0.00 34.83 34.04 1lby s MET 335 CO 0.00 -0.39 1.09 0.20 -0.65 0.00 0.00 175.02 175.27 1lby s GLY 336 N 1.68 1.66 0.38 2.11 0.00 0.26 -4.75 107.32 108.66 1lby s GLY 336 Ca 0.15 0.18 0.28 0.00 0.00 0.00 0.00 44.72 45.32 1lby s GLY 336 CO 0.11 0.57 1.82 0.50 0.00 0.00 0.00 173.10 176.10 1lby h LYS 337 N -1.28 0.00 0.00 2.90 1.79 -1.22 -2.12 116.57 116.64 1lby h LYS 337 Ca -0.45 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 1lby h LYS 337 Cb 1.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 1lby h LYS 337 CO 0.52 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.49 1lby n ASP 338 N -2.61 0.00 0.00 0.86 5.75 -0.98 -4.87 116.55 114.70 1lby n ASP 338 Ca 0.02 -1.24 0.00 0.00 -0.01 0.00 0.00 54.79 53.55 1lby n ASP 338 Cb 0.29 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1lby n ASP 338 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1lby n GLY 339 N 0.48 0.74 3.36 6.12 0.00 -0.80 -5.05 105.19 110.05 1lby n GLY 339 Ca 0.10 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 1lby n GLY 339 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lby s THR 340 N -2.00 1.50 0.29 2.61 -4.23 -1.26 -4.95 115.64 107.59 1lby s THR 340 Ca 0.00 -2.13 -0.29 0.00 -1.18 0.00 0.00 61.69 58.09 1lby s THR 340 Cb 0.00 -2.24 -0.10 0.00 1.34 0.00 0.00 72.50 71.50 1lby s THR 340 CO 0.00 -0.44 1.23 -2.16 -0.54 0.00 0.00 174.62 172.71 1lby s PRO 341 N -3.73 4.47 -0.04 3.99 0.04 -1.26 0.93 135.00 139.39 1lby s PRO 341 Ca 0.26 2.03 -0.27 0.00 0.04 0.00 0.00 61.00 63.06 1lby s PRO 341 Cb 0.03 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 31.40 1lby s PRO 341 CO 0.08 -0.05 0.86 0.99 0.04 0.00 0.00 177.00 178.92 1lby s THR 342 N -0.92 4.94 0.39 1.26 2.01 0.71 -4.64 115.64 119.39 1lby s THR 342 Ca 0.49 1.79 0.02 0.00 0.31 0.00 0.00 61.69 64.29 1lby s THR 342 Cb -0.36 -4.20 -0.01 0.00 0.01 0.00 0.00 72.50 67.94 1lby s THR 342 CO 0.46 0.19 0.59 -0.54 -0.69 0.00 0.00 174.62 174.63 1lby s LYS 343 N 1.01 3.19 0.38 4.92 1.02 -1.26 0.40 119.74 129.40 1lby s LYS 343 Ca 0.45 -0.56 0.06 0.00 0.02 0.00 0.00 55.97 55.94 1lby s LYS 343 Cb -0.19 -2.65 0.76 0.00 -0.52 0.00 0.00 37.83 35.23 1lby s LYS 343 CO 0.23 -0.07 2.01 0.00 -0.92 0.00 0.00 175.35 176.60 1lby h ALA 344 N 0.61 1.61 -0.10 5.17 0.00 0.65 0.33 119.26 127.54 1lby h ALA 344 Ca -0.47 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1lby h ALA 344 Cb 1.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1lby h ALA 344 CO 0.58 0.33 0.01 0.00 0.00 0.00 0.00 179.25 180.17 1lby h ALA 345 N 1.67 1.84 -0.15 0.00 0.00 -1.74 -2.32 119.26 118.55 1lby h ALA 345 Ca 0.16 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1lby h ALA 345 Cb 0.01 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1lby h ALA 345 CO -0.03 0.13 -0.26 -0.44 0.00 0.00 0.00 179.25 178.65 1lby h ASP 346 N 0.14 0.49 0.47 0.00 3.32 -1.24 -3.07 116.42 116.52 1lby h ASP 346 Ca 0.03 -0.54 -0.30 0.00 0.02 0.00 0.00 57.03 56.24 1lby h ASP 346 Cb 0.08 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.49 1lby h ASP 346 CO -0.00 0.93 -1.43 -0.09 -1.72 0.00 0.00 179.24 176.93 1lby h ARG 347 N 0.06 0.32 -0.33 3.56 9.65 -1.31 -0.33 114.38 126.00 1lby h ARG 347 Ca 0.01 -0.55 0.06 0.00 -1.10 0.00 0.00 59.98 58.40 1lby h ARG 347 Cb 0.84 0.20 -0.08 0.00 -1.39 0.00 0.00 29.97 29.54 1lby h ARG 347 CO 0.06 1.23 -0.47 0.28 2.80 0.00 0.00 179.97 183.87 1lby h VAL 348 N 0.09 0.08 -0.00 0.20 2.07 -1.55 1.50 116.25 118.63 1lby h VAL 348 Ca -0.21 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.33 1lby h VAL 348 Cb 2.03 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1lby h VAL 348 CO 0.20 0.00 -0.12 0.00 0.02 0.00 0.00 177.57 177.67 1lby h ALA 349 N 0.19 -0.13 -0.10 1.67 0.00 -1.62 -2.02 119.26 117.26 1lby h ALA 349 Ca 0.10 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1lby h ALA 349 Cb 0.61 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1lby h ALA 349 CO -0.53 -0.61 0.05 1.49 0.00 0.00 0.00 179.25 179.65 1lby h GLU 350 N -0.20 0.14 -0.92 0.00 4.81 -0.28 -1.36 114.58 116.76 1lby h GLU 350 Ca 0.04 -0.02 0.13 0.00 -0.13 0.00 0.00 59.36 59.39 1lby h GLU 350 Cb 0.25 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.53 1lby h GLU 350 CO -0.12 0.18 0.59 -0.44 -0.73 0.00 0.00 179.01 178.49 1lby h ASP 351 N 0.06 0.75 0.01 1.04 5.19 0.21 0.68 116.42 124.36 1lby h ASP 351 Ca 0.03 0.04 -0.15 0.00 -0.62 0.00 0.00 57.03 56.34 1lby h ASP 351 Cb 0.08 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 1lby h ASP 351 CO -0.01 0.39 -0.48 0.00 -3.12 0.00 0.00 179.24 176.02 1lby h ALA 352 N 1.58 0.77 0.07 3.45 0.00 -0.67 -0.86 119.26 123.60 1lby h ALA 352 Ca 0.46 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1lby h ALA 352 Cb 0.62 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1lby h ALA 352 CO -0.22 0.67 -0.03 0.00 0.00 0.00 0.00 179.25 179.66 1lby h ALA 353 N 1.03 -0.09 -0.98 0.00 0.00 -0.66 -3.27 119.26 115.30 1lby h ALA 353 Ca 0.02 -0.29 0.19 0.00 0.00 0.00 0.00 54.91 54.83 1lby h ALA 353 Cb 1.01 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.74 1lby h ALA 353 CO 0.09 -0.19 0.61 -0.07 0.00 0.00 0.00 179.25 179.69 1lby h LEU 354 N -0.82 0.66 -1.70 0.00 3.38 -0.91 0.57 115.31 116.49 1lby h LEU 354 Ca -0.01 0.07 0.28 0.00 0.09 0.00 0.00 57.88 58.31 1lby h LEU 354 Cb 0.61 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.25 1lby h LEU 354 CO 0.02 0.25 0.71 -0.33 0.09 0.00 0.00 178.44 179.17 1lby h GLU 355 N 0.66 0.19 0.03 1.13 5.08 -1.20 -0.10 114.58 120.36 1lby h GLU 355 Ca 0.54 -0.01 -0.35 0.00 -1.00 0.00 0.00 59.36 58.54 1lby h GLU 355 Cb 0.98 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.14 1lby h GLU 355 CO -0.30 0.13 -1.97 -0.89 -1.00 0.00 0.00 179.01 174.98 1lby n ILE 356 N -4.41 1.58 0.20 3.13 5.41 0.19 -4.30 119.36 121.17 1lby n ILE 356 Ca 0.23 -0.35 0.16 0.00 1.00 0.00 0.00 62.75 63.79 1lby n ILE 356 Cb 0.98 -1.83 0.80 0.00 -0.71 0.00 0.00 39.64 38.87 1lby n ILE 356 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1lby h LEU 357 N -0.60 0.00 -2.03 1.39 3.38 -0.76 0.21 115.31 116.89 1lby h LEU 357 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1lby h LEU 357 Cb 1.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.40 1lby h LEU 357 CO -0.18 0.00 0.00 0.08 0.09 0.00 0.00 178.44 178.43 1lby h ARG 358 N 0.00 0.00 0.00 1.13 0.11 -1.21 0.49 114.38 114.90 1lby h ARG 358 Ca 0.08 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.16 1lby h ARG 358 Cb 0.41 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.49 1lby h ARG 358 CO -0.00 0.00 -0.16 1.63 0.10 0.00 0.00 179.97 181.54 1lby n LYS 359 N -2.63 0.12 -4.05 0.08 5.02 0.75 -4.89 118.16 112.57 1lby n LYS 359 Ca -0.02 0.08 -0.22 0.00 -2.02 0.00 0.00 58.31 56.13 1lby n LYS 359 Cb 0.07 -1.62 -0.03 0.00 -0.02 0.00 0.00 35.03 33.43 1lby n LYS 359 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1lby s GLU 360 N -3.05 3.14 -1.17 1.97 0.41 0.16 -5.01 118.70 115.16 1lby s GLU 360 Ca 0.11 -0.90 -0.17 0.00 -0.41 0.00 0.00 54.97 53.60 1lby s GLU 360 Cb 0.16 -2.72 0.12 0.00 -1.78 0.00 0.00 34.13 29.91 1lby s GLU 360 CO 0.60 0.43 1.48 0.50 -0.49 0.00 0.00 175.26 177.78 1lby s ARG 361 N -3.79 3.91 0.13 1.61 3.52 -1.26 -4.92 118.95 118.15 1lby s ARG 361 Ca 0.33 -2.06 -0.05 0.00 -0.13 0.00 0.00 55.73 53.82 1lby s ARG 361 Cb -0.09 -5.23 -0.02 0.00 -1.56 0.00 0.00 34.95 28.05 1lby s ARG 361 CO 0.27 -1.99 0.15 0.14 -0.81 0.00 0.00 175.30 173.06 1lby s VAL 362 N 3.07 0.10 -0.17 7.11 -7.23 -1.26 -3.19 120.40 118.84 1lby s VAL 362 Ca 0.45 -1.64 -0.04 0.00 -1.81 0.00 0.00 61.98 58.94 1lby s VAL 362 Cb -0.01 -1.87 -0.03 0.00 0.56 0.00 0.00 36.38 35.04 1lby s VAL 362 CO -0.00 -0.46 -0.03 -0.89 -0.31 0.00 0.00 175.10 173.41 1lby s THR 363 N -3.99 3.90 -0.26 5.32 2.01 -0.61 -1.90 115.64 120.10 1lby s THR 363 Ca 0.19 -0.35 -0.10 0.00 0.31 0.00 0.00 61.69 61.73 1lby s THR 363 Cb 0.06 -2.72 -0.05 0.00 0.01 0.00 0.00 72.50 69.80 1lby s THR 363 CO -0.01 0.48 0.15 -0.69 -0.69 0.00 0.00 174.62 173.86 1lby s VAL 364 N 0.52 5.13 -0.49 3.82 1.01 -0.84 -0.36 120.40 129.20 1lby s VAL 364 Ca -0.03 0.10 -0.10 0.00 0.00 0.00 0.00 61.98 61.95 1lby s VAL 364 Cb -0.14 -3.41 0.12 0.00 0.00 0.00 0.00 36.38 32.95 1lby s VAL 364 CO 0.03 0.31 0.38 0.54 0.00 0.00 0.00 175.10 176.35 1lby s VAL 365 N 1.43 4.40 0.04 2.92 0.11 0.07 -1.44 120.40 127.93 1lby s VAL 365 Ca 0.07 -1.74 0.09 0.00 -2.93 0.00 0.00 61.98 57.46 1lby s VAL 365 Cb -0.15 -3.88 -0.03 0.00 -1.53 0.00 0.00 36.38 30.79 1lby s VAL 365 CO 0.07 -0.80 -0.26 0.28 -3.33 0.00 0.00 175.10 171.07 1lby s THR 366 N 1.40 2.09 0.25 5.04 -1.32 -0.62 -1.79 115.64 120.68 1lby s THR 366 Ca 0.05 -1.34 -0.03 0.00 -1.21 0.00 0.00 61.69 59.17 1lby s THR 366 Cb -0.27 -1.78 0.10 0.00 -1.51 0.00 0.00 72.50 69.04 1lby s THR 366 CO -0.00 0.38 1.73 -0.08 -2.21 0.00 0.00 174.62 174.44 1lby h GLU 367 N 4.89 0.80 0.06 7.08 4.81 -1.81 0.31 114.58 130.71 1lby h GLU 367 Ca -0.46 -0.23 -0.32 0.00 -0.13 0.00 0.00 59.36 58.22 1lby h GLU 367 Cb 1.14 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 1lby h GLU 367 CO 0.44 0.83 -1.78 0.39 -0.73 0.00 0.00 179.01 178.15 1lby n GLU 368 N -4.20 0.66 0.00 1.92 -0.58 -1.26 -2.31 120.64 114.87 1lby n GLU 368 Ca 0.02 0.38 0.09 0.00 -0.42 0.00 0.00 57.16 57.23 1lby n GLU 368 Cb 0.32 -1.69 0.01 0.00 -0.57 0.00 0.00 31.44 29.51 1lby n GLU 368 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1lby n SER 369 N -3.91 1.92 0.00 1.62 7.64 -1.25 -1.33 113.62 118.31 1lby n SER 369 Ca -0.35 -1.46 0.00 0.00 1.01 0.00 0.00 58.87 58.07 1lby n SER 369 Cb 0.88 0.39 0.00 0.00 -1.01 0.00 0.00 64.21 64.47 1lby n SER 369 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lby n GLY 370 N 1.22 0.14 3.57 0.23 0.00 0.11 -4.76 105.19 105.70 1lby n GLY 370 Ca 0.08 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 1lby n GLY 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lby s VAL 371 N 0.00 4.82 -0.08 1.61 1.01 -1.24 -1.60 120.40 124.93 1lby s VAL 371 Ca 0.00 0.66 0.03 0.00 0.00 0.00 0.00 61.98 62.67 1lby s VAL 371 Cb 0.00 -4.14 0.01 0.00 0.00 0.00 0.00 36.38 32.25 1lby s VAL 371 CO 0.00 -0.38 -0.16 -0.76 0.00 0.00 0.00 175.10 173.79 1lby s LEU 372 N 2.87 1.80 0.00 3.92 1.02 -0.52 -4.98 118.68 122.80 1lby s LEU 372 Ca 0.27 -0.39 0.00 0.00 0.02 0.00 0.00 54.13 54.03 1lby s LEU 372 Cb -0.14 -1.03 0.00 0.00 0.02 0.00 0.00 46.19 45.04 1lby s LEU 372 CO 0.16 0.08 0.00 0.61 0.02 0.00 0.00 176.35 177.22 1lby n GLY 373 N 3.69 0.44 2.22 -3.19 0.00 -1.26 -1.98 105.19 105.10 1lby n GLY 373 Ca -0.21 -2.13 0.01 0.00 0.00 0.00 0.00 46.02 43.69 1lby n GLY 373 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1lby n GLU 374 N -0.03 0.94 -1.00 1.61 0.28 -1.23 -4.72 120.64 116.48 1lby n GLU 374 Ca 0.00 -2.74 -0.29 0.00 -0.16 0.00 0.00 57.16 53.98 1lby n GLU 374 Cb 0.00 -0.81 0.21 0.00 1.43 0.00 0.00 31.44 32.27 1lby n GLU 374 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1lby s GLY 375 N -2.89 1.55 0.07 -1.84 0.00 -0.80 -4.80 107.32 98.61 1lby s GLY 375 Ca 0.29 -0.48 0.22 0.00 0.00 0.00 0.00 44.72 44.75 1lby s GLY 375 CO -0.10 0.23 0.84 2.09 0.00 0.00 0.00 173.10 176.16 1lby n ASP 376 N -4.52 0.49 -4.66 1.64 5.75 -1.19 -3.80 116.55 110.25 1lby n ASP 376 Ca 0.06 0.01 -0.41 0.00 -0.01 0.00 0.00 54.79 54.44 1lby n ASP 376 Cb 0.57 1.10 -0.05 0.00 -1.03 0.00 0.00 41.12 41.72 1lby n ASP 376 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1lby s VAL 377 N -3.35 4.92 -0.08 2.12 1.01 -1.23 -4.39 120.40 119.39 1lby s VAL 377 Ca -0.02 1.48 -0.14 0.00 0.00 0.00 0.00 61.98 63.30 1lby s VAL 377 Cb 0.13 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 1lby s VAL 377 CO 0.84 0.04 0.36 -0.36 0.00 0.00 0.00 175.10 175.97 1lby s PHE 378 N 2.17 3.60 -0.10 5.22 0.08 -0.97 -1.58 117.98 126.40 1lby s PHE 378 Ca 0.35 0.81 0.01 0.00 0.12 0.00 0.00 56.93 58.22 1lby s PHE 378 Cb -0.16 -2.31 0.02 0.00 -0.57 0.00 0.00 43.02 40.00 1lby s PHE 378 CO 0.11 0.46 -0.13 0.08 -0.10 0.00 0.00 175.22 175.65 1lby s VAL 379 N -0.37 1.31 -0.22 -0.44 1.01 0.52 -1.28 120.40 120.94 1lby s VAL 379 Ca 0.21 -0.52 -0.12 0.00 0.00 0.00 0.00 61.98 61.55 1lby s VAL 379 Cb -0.15 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 1lby s VAL 379 CO 0.09 0.41 0.21 0.00 0.00 0.00 0.00 175.10 175.81 1lby s ALA 380 N 1.12 3.61 -0.06 5.51 0.00 -0.13 -0.75 121.76 131.07 1lby s ALA 380 Ca -0.05 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 1lby s ALA 380 Cb -0.14 -2.35 0.03 0.00 0.00 0.00 0.00 23.12 20.65 1lby s ALA 380 CO -0.03 -0.11 -0.00 -1.17 0.00 0.00 0.00 175.76 174.45 1lby s LEU 381 N 0.90 0.75 -0.45 0.00 2.96 -0.74 -1.54 118.68 120.56 1lby s LEU 381 Ca 0.11 -0.07 -0.17 0.00 -0.22 0.00 0.00 54.13 53.78 1lby s LEU 381 Cb -0.13 -0.38 0.04 0.00 0.50 0.00 0.00 46.19 46.22 1lby s LEU 381 CO 0.04 -0.16 0.46 -0.62 -1.32 0.00 0.00 176.35 174.74 1lby s ASP 382 N 1.69 6.19 0.23 3.68 -1.08 -1.00 -3.16 116.67 123.22 1lby s ASP 382 Ca 0.00 -0.85 -0.07 0.00 -0.52 0.00 0.00 52.55 51.11 1lby s ASP 382 Cb -0.13 -2.23 0.25 0.00 -1.46 0.00 0.00 42.92 39.36 1lby s ASP 382 CO -0.04 -0.65 1.89 1.55 0.52 0.00 0.00 175.17 178.45 1lby h PRO 383 N 8.78 1.12 -2.81 4.34 0.13 -1.89 -2.15 132.00 139.51 1lby h PRO 383 Ca -0.27 -0.07 -0.27 0.00 -0.87 0.00 0.00 66.00 64.53 1lby h PRO 383 Cb 1.11 -0.25 -0.34 0.00 0.13 0.00 0.00 31.00 31.64 1lby h PRO 383 CO 0.84 0.74 -0.59 -1.17 -0.23 0.00 0.00 178.00 177.59 1lby s LEU 384 N -10.15 -0.19 -0.34 1.56 2.96 -1.26 -4.34 118.68 106.93 1lby s LEU 384 Ca -0.13 0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.03 1lby s LEU 384 Cb 0.17 0.49 0.06 0.00 0.50 0.00 0.00 46.19 47.42 1lby s LEU 384 CO 0.80 -0.27 0.07 -0.62 -1.32 0.00 0.00 176.35 175.01 1lby s ASP 385 N 2.36 5.06 0.00 3.68 2.15 -0.89 -4.49 116.67 124.54 1lby s ASP 385 Ca 0.04 -1.45 0.00 0.00 0.43 0.00 0.00 52.55 51.56 1lby s ASP 385 Cb -0.13 -1.77 0.00 0.00 -0.30 0.00 0.00 42.92 40.72 1lby s ASP 385 CO -0.09 -0.35 0.00 0.61 -0.17 0.00 0.00 175.17 175.18 1lby n GLY 386 N 4.65 1.79 0.37 2.66 0.00 -1.25 -2.62 105.19 110.79 1lby n GLY 386 Ca -0.10 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1lby n GLY 386 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1lby h THR 387 N 0.00 0.85 -0.67 2.61 2.02 -1.86 0.10 112.91 115.96 1lby h THR 387 Ca 0.00 -0.20 0.01 0.00 0.77 0.00 0.00 66.41 66.99 1lby h THR 387 Cb 0.00 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.60 1lby h THR 387 CO 0.00 0.11 0.44 0.15 0.37 0.00 0.00 175.52 176.59 1lby h PHE 388 N 0.58 0.85 0.87 3.16 3.57 -1.96 0.24 116.94 124.25 1lby h PHE 388 Ca 0.39 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.86 1lby h PHE 388 Cb 0.69 -0.29 0.01 0.00 2.79 0.00 0.00 35.95 39.15 1lby h PHE 388 CO -0.00 0.54 -0.42 -0.91 -2.23 0.00 0.00 178.31 175.29 1lby h ASN 389 N 0.91 -0.99 -0.95 0.41 -0.26 -1.14 -2.82 115.58 110.74 1lby h ASN 389 Ca 0.25 0.03 0.30 0.00 -0.56 0.00 0.00 56.30 56.31 1lby h ASN 389 Cb -0.10 0.26 -0.16 0.00 -1.06 0.00 0.00 38.32 37.26 1lby h ASN 389 CO -0.05 -0.67 0.32 0.00 -1.06 0.00 0.00 177.43 175.96 1lby h ALA 390 N -1.14 1.56 -0.15 -0.83 0.00 -0.85 1.68 119.26 119.52 1lby h ALA 390 Ca -0.12 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1lby h ALA 390 Cb 0.90 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1lby h ALA 390 CO 0.20 -0.61 0.00 0.25 0.00 0.00 0.00 179.25 179.09 1lby n THR 391 N -5.26 0.20 0.00 0.00 -2.24 0.80 -2.73 114.28 105.06 1lby n THR 391 Ca 0.27 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1lby n THR 391 Cb 0.88 0.11 -0.00 0.00 -2.10 0.00 0.00 70.33 69.22 1lby n THR 391 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1lby n ARG 392 N -0.02 3.93 -0.58 -0.78 3.00 0.50 -4.78 116.66 117.93 1lby n ARG 392 Ca 0.11 -0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.95 1lby n ARG 392 Cb 0.19 -0.72 0.00 0.00 0.00 0.00 0.00 32.46 31.93 1lby n ARG 392 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1lby n GLY 393 N 1.66 1.14 3.65 -0.13 0.00 0.28 -4.99 105.19 106.80 1lby n GLY 393 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1lby n GLY 393 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lby s ILE 394 N -3.30 3.38 -1.45 -0.61 1.01 -0.91 -4.87 121.20 114.45 1lby s ILE 394 Ca 0.00 0.46 -0.09 0.00 0.00 0.00 0.00 60.65 61.02 1lby s ILE 394 Cb 0.00 -3.32 0.04 0.00 0.01 0.00 0.00 42.46 39.19 1lby s ILE 394 CO 0.00 -0.07 2.51 -0.81 0.00 0.00 0.00 174.94 176.58 1lby n PRO 395 N 7.43 3.94 -3.32 2.79 -0.04 -1.26 -3.98 135.00 140.56 1lby n PRO 395 Ca 0.19 -2.91 -0.24 0.00 -0.04 0.00 0.00 63.50 60.50 1lby n PRO 395 Cb 0.43 -2.81 -0.09 0.00 -0.04 0.00 0.00 33.50 30.99 1lby n PRO 395 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1lby s VAL 396 N 0.77 0.15 0.00 0.52 1.01 -1.26 -4.76 120.40 116.83 1lby s VAL 396 Ca 0.57 -2.37 -0.23 0.00 0.00 0.00 0.00 61.98 59.95 1lby s VAL 396 Cb 0.17 -1.08 0.05 0.00 0.00 0.00 0.00 36.38 35.51 1lby s VAL 396 CO -0.07 -1.07 0.51 -0.72 0.00 0.00 0.00 175.10 173.75 1lby s TYR 397 N 0.23 -0.42 0.17 5.22 -0.85 -1.26 -4.59 117.35 115.85 1lby s TYR 397 Ca 0.32 0.59 -0.04 0.00 -0.52 0.00 0.00 57.07 57.41 1lby s TYR 397 Cb 0.02 0.29 -0.03 0.00 0.38 0.00 0.00 41.96 42.62 1lby s TYR 397 CO -0.17 -0.57 0.18 -1.12 -1.52 0.00 0.00 175.55 172.36 1lby s SER 398 N -1.60 0.15 -0.10 -0.18 0.01 -1.08 -0.86 113.70 110.05 1lby s SER 398 Ca -0.09 -1.14 -0.14 0.00 1.31 0.00 0.00 55.95 55.90 1lby s SER 398 Cb -0.02 0.39 -0.05 0.00 0.21 0.00 0.00 66.02 66.55 1lby s SER 398 CO 0.03 -0.85 0.33 -0.69 0.41 0.00 0.00 173.24 172.47 1lby s VAL 399 N -4.05 5.24 -0.14 3.43 1.01 -0.10 -2.10 120.40 123.68 1lby s VAL 399 Ca 0.26 0.63 0.01 0.00 0.00 0.00 0.00 61.98 62.88 1lby s VAL 399 Cb 0.05 -3.64 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 1lby s VAL 399 CO 0.05 0.47 -0.18 -0.55 0.00 0.00 0.00 175.10 174.90 1lby s SER 400 N -0.19 3.51 -0.07 3.32 0.15 -0.81 -1.92 113.70 117.69 1lby s SER 400 Ca 0.19 -0.50 0.01 0.00 0.70 0.00 0.00 55.95 56.36 1lby s SER 400 Cb -0.14 -1.52 0.02 0.00 -1.71 0.00 0.00 66.02 62.66 1lby s SER 400 CO 0.07 0.10 -0.08 -0.76 1.20 0.00 0.00 173.24 173.78 1lby s LEU 401 N 0.71 1.32 -0.10 3.45 1.02 0.27 -2.37 118.68 122.98 1lby s LEU 401 Ca -0.08 -0.24 0.02 0.00 0.02 0.00 0.00 54.13 53.86 1lby s LEU 401 Cb -0.16 -0.70 0.01 0.00 0.02 0.00 0.00 46.19 45.37 1lby s LEU 401 CO 0.01 -0.06 -0.16 0.00 0.02 0.00 0.00 176.35 176.16 1lby s PHE 403 N 0.85 2.91 0.15 0.00 0.40 -0.55 -0.95 117.98 120.79 1lby s PHE 403 Ca -0.09 -0.20 0.05 0.00 -0.60 0.00 0.00 56.93 56.09 1lby s PHE 403 Cb -0.15 -1.79 -0.04 0.00 0.51 0.00 0.00 43.02 41.55 1lby s PHE 403 CO 0.00 0.13 -0.12 0.45 0.70 0.00 0.00 175.22 176.38 1lby s SER 404 N -0.30 1.97 -0.01 1.36 0.15 -0.40 0.16 113.70 116.63 1lby s SER 404 Ca 0.04 -0.95 0.13 0.00 0.70 0.00 0.00 55.95 55.87 1lby s SER 404 Cb -0.13 -0.05 0.39 0.00 -1.71 0.00 0.00 66.02 64.53 1lby s SER 404 CO 0.02 -0.25 1.32 -1.22 1.20 0.00 0.00 173.24 174.31 1lby n TYR 405 N -0.02 0.62 -3.26 3.44 4.01 -0.13 -2.30 117.16 119.52 1lby n TYR 405 Ca -0.11 -0.30 0.00 0.00 -0.16 0.00 0.00 57.90 57.33 1lby n TYR 405 Cb 0.60 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.61 1lby n TYR 405 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1lby n SER 406 N 0.78 0.00 0.26 7.72 3.41 -1.26 -4.90 113.62 119.63 1lby n SER 406 Ca 0.15 -0.99 0.11 0.00 -0.26 0.00 0.00 58.87 57.87 1lby n SER 406 Cb 0.39 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 65.03 1lby n SER 406 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1lby h ASP 407 N 0.00 0.00 -2.26 4.04 -0.00 -1.92 -3.40 116.42 112.89 1lby h ASP 407 Ca 0.00 0.00 -0.50 0.00 -0.00 0.00 0.00 57.03 56.53 1lby h ASP 407 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 39.33 39.29 1lby h ASP 407 CO 0.00 0.11 -0.51 -0.54 -0.00 0.00 0.00 179.24 178.30 1lby s LYS 408 N -4.47 3.03 0.31 0.28 3.01 -1.26 -0.38 119.74 120.26 1lby s LYS 408 Ca -0.04 -0.97 0.02 0.00 -1.01 0.00 0.00 55.97 53.98 1lby s LYS 408 Cb 0.15 -2.64 0.49 0.00 -1.01 0.00 0.00 37.83 34.81 1lby s LYS 408 CO 0.62 0.42 1.82 1.25 0.51 0.00 0.00 175.35 179.97 1lby h LEU 409 N 1.55 0.58 -2.43 3.17 5.85 0.06 -2.77 115.31 121.33 1lby h LEU 409 Ca -0.49 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.12 1lby h LEU 409 Cb 1.23 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 1lby h LEU 409 CO 0.61 0.67 0.16 0.50 -0.34 0.00 0.00 178.44 180.04 1lby h LYS 410 N 0.57 0.00 -0.27 1.25 1.63 -0.53 0.56 116.57 119.78 1lby h LYS 410 Ca 0.12 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1lby h LYS 410 Cb 0.40 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.03 1lby h LYS 410 CO 0.02 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 175.77 1lby n ASP 411 N -3.37 1.69 -4.63 4.20 8.00 -1.04 -4.95 116.55 116.46 1lby n ASP 411 Ca -0.01 -1.89 -0.39 0.00 0.71 0.00 0.00 54.79 53.21 1lby n ASP 411 Cb 0.25 -0.18 0.03 0.00 -0.02 0.00 0.00 41.12 41.20 1lby n ASP 411 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lby n ALA 412 N 0.39 0.35 -0.43 2.24 0.00 0.19 -0.96 120.51 122.29 1lby n ALA 412 Ca 0.13 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1lby n ALA 412 Cb 0.29 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1lby n ALA 412 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1lby n PHE 413 N -1.07 0.00 -3.60 0.00 1.16 0.12 -4.82 117.46 109.25 1lby n PHE 413 Ca 0.11 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.57 1lby n PHE 413 Cb 0.43 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.24 1lby n PHE 413 CO 0.00 0.00 0.00 0.12 -1.87 0.00 0.00 176.76 175.01 1lby s PHE 414 N -0.11 -0.57 -0.01 2.97 2.19 -1.10 -4.57 117.98 116.77 1lby s PHE 414 Ca 0.00 1.26 0.02 0.00 0.33 0.00 0.00 56.93 58.54 1lby s PHE 414 Cb 0.00 0.36 0.00 0.00 -1.31 0.00 0.00 43.02 42.07 1lby s PHE 414 CO 0.00 -0.35 -0.05 0.20 1.83 0.00 0.00 175.22 176.84 1lby s GLY 415 N -0.22 0.29 -0.12 13.12 0.00 -0.83 -1.49 107.32 118.08 1lby s GLY 415 Ca -0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 44.72 44.47 1lby s GLY 415 CO -0.00 -0.08 0.23 -0.47 0.00 0.00 0.00 173.10 172.77 1lby s TYR 416 N 0.05 -0.33 -0.14 1.90 5.04 0.17 -1.45 117.35 122.60 1lby s TYR 416 Ca -0.00 0.78 0.00 0.00 -2.44 0.00 0.00 57.07 55.41 1lby s TYR 416 Cb -0.04 -0.14 0.02 0.00 0.35 0.00 0.00 41.96 42.15 1lby s TYR 416 CO -0.00 -0.36 -0.13 0.08 -1.34 0.00 0.00 175.55 173.80 1lby s VAL 417 N 2.37 1.46 -0.13 3.14 1.01 0.10 0.96 120.40 129.30 1lby s VAL 417 Ca 0.03 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.45 1lby s VAL 417 Cb -0.12 -1.38 0.02 0.00 0.00 0.00 0.00 36.38 34.90 1lby s VAL 417 CO -0.08 0.44 -0.15 -0.47 0.00 0.00 0.00 175.10 174.83 1lby s TYR 418 N 1.46 2.16 -0.45 5.22 5.04 -0.81 -0.08 117.35 129.90 1lby s TYR 418 Ca 0.03 -1.13 -0.29 0.00 -2.44 0.00 0.00 57.07 53.24 1lby s TYR 418 Cb -0.13 -1.56 0.02 0.00 0.35 0.00 0.00 41.96 40.64 1lby s TYR 418 CO -0.09 -0.60 1.20 1.21 -1.34 0.00 0.00 175.55 175.93 1lby s ASN 419 N 1.23 6.59 0.00 4.32 3.84 -0.47 -0.92 114.94 129.53 1lby s ASN 419 Ca -0.00 0.61 0.21 0.00 0.21 0.00 0.00 52.86 53.89 1lby s ASN 419 Cb -0.14 -2.55 0.98 0.00 -0.55 0.00 0.00 41.25 39.00 1lby s ASN 419 CO -0.07 -1.26 1.68 0.18 -2.79 0.00 0.00 177.10 174.84 1lby n LEU 420 N 8.00 0.00 -0.11 3.21 4.77 -0.04 -0.56 117.00 132.27 1lby n LEU 420 Ca 0.13 0.41 -0.25 0.00 -0.03 0.00 0.00 56.01 56.27 1lby n LEU 420 Cb 0.49 -0.41 -0.11 0.00 -2.33 0.00 0.00 43.42 41.06 1lby n LEU 420 CO 0.70 -0.11 -1.01 0.00 -1.33 0.00 0.00 177.39 175.64 1lby n ALA 421 N -1.41 1.02 0.06 -1.18 0.00 -1.26 -4.68 120.51 113.06 1lby n ALA 421 Ca 0.07 -0.81 -0.16 0.00 0.00 0.00 0.00 53.44 52.54 1lby n ALA 421 Cb 0.21 -0.24 -0.14 0.00 0.00 0.00 0.00 19.45 19.28 1lby n ALA 421 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1lby h THR 422 N -0.84 1.14 0.00 0.00 1.35 -1.84 -3.48 112.91 109.23 1lby h THR 422 Ca -0.53 -2.79 0.00 0.00 -0.55 0.00 0.00 66.41 62.54 1lby h THR 422 Cb 1.54 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 70.70 1lby h THR 422 CO -0.27 0.81 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 1lby n GLY 423 N 1.66 0.43 3.75 5.82 0.00 0.28 -5.05 105.19 112.08 1lby n GLY 423 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1lby n GLY 423 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lby n ASP 424 N 0.00 3.41 -4.08 1.61 8.00 -1.24 -4.79 116.55 119.46 1lby n ASP 424 Ca 0.00 1.21 -0.32 0.00 0.71 0.00 0.00 54.79 56.39 1lby n ASP 424 Cb 0.00 -1.58 -0.16 0.00 -0.02 0.00 0.00 41.12 39.37 1lby n ASP 424 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1lby s GLU 425 N -2.07 2.62 -0.21 -1.24 2.12 -1.26 -1.37 118.70 117.29 1lby s GLU 425 Ca 0.55 -0.95 -0.03 0.00 0.36 0.00 0.00 54.97 54.90 1lby s GLU 425 Cb -0.50 -2.60 -0.00 0.00 0.26 0.00 0.00 34.13 31.28 1lby s GLU 425 CO 0.63 -0.33 -0.07 0.71 -0.54 0.00 0.00 175.26 175.65 1lby s TYR 426 N 1.27 2.93 0.22 5.30 2.02 0.88 -0.97 117.35 129.00 1lby s TYR 426 Ca 0.01 -1.07 0.00 0.00 -0.37 0.00 0.00 57.07 55.64 1lby s TYR 426 Cb -0.15 -2.07 -0.04 0.00 -0.40 0.00 0.00 41.96 39.29 1lby s TYR 426 CO -0.10 -0.60 0.10 1.52 -1.57 0.00 0.00 175.55 174.91 1lby s TYR 427 N 1.44 1.29 -0.16 2.71 1.13 -1.07 0.01 117.35 122.71 1lby s TYR 427 Ca 0.06 -1.27 -0.15 0.00 -1.41 0.00 0.00 57.07 54.30 1lby s TYR 427 Cb -0.14 -0.70 0.04 0.00 -1.10 0.00 0.00 41.96 40.06 1lby s TYR 427 CO -0.05 -0.48 0.43 0.00 -2.51 0.00 0.00 175.55 172.94 1lby s ALA 428 N -3.96 -1.06 0.00 9.51 0.00 -0.52 -0.64 121.76 125.09 1lby s ALA 428 Ca 0.37 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.54 1lby s ALA 428 Cb 0.07 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.49 1lby s ALA 428 CO 0.11 -0.20 0.00 -0.40 0.00 0.00 0.00 175.76 175.27 1lby n ASP 429 N 2.87 0.00 -0.19 0.00 5.68 0.24 -1.96 116.55 123.19 1lby n ASP 429 Ca -0.13 -0.92 0.22 0.00 -0.50 0.00 0.00 54.79 53.46 1lby n ASP 429 Cb 0.57 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.15 1lby n ASP 429 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1lby h SER 430 N 0.00 0.23 0.01 -1.12 4.64 -1.99 0.58 113.55 115.90 1lby h SER 430 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1lby h SER 430 Cb 0.00 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1lby h SER 430 CO 0.00 0.09 0.00 -1.54 -0.87 0.00 0.00 176.83 174.51 1lby n SER 431 N -4.42 0.00 0.00 4.97 3.41 -1.26 -4.98 113.62 111.34 1lby n SER 431 Ca 0.18 -0.50 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 1lby n SER 431 Cb 0.77 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 1lby n SER 431 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lby n GLY 432 N 0.05 -0.68 3.46 5.00 0.00 0.20 -5.02 105.19 108.20 1lby n GLY 432 Ca 0.12 -2.13 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 1lby n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lby s ALA 433 N -2.00 2.61 0.07 4.61 0.00 -1.26 -0.59 121.76 125.19 1lby s ALA 433 Ca 0.00 -1.03 0.05 0.00 0.00 0.00 0.00 51.96 50.98 1lby s ALA 433 Cb 0.00 -0.89 -0.03 0.00 0.00 0.00 0.00 23.12 22.20 1lby s ALA 433 CO 0.00 0.56 -0.14 0.71 0.00 0.00 0.00 175.76 176.89 1lby s TYR 434 N -0.76 1.17 -0.23 0.00 1.51 0.19 -0.95 117.35 118.28 1lby s TYR 434 Ca 0.12 -0.45 0.02 0.00 -1.01 0.00 0.00 57.07 55.75 1lby s TYR 434 Cb -0.11 -0.67 0.05 0.00 -0.11 0.00 0.00 41.96 41.13 1lby s TYR 434 CO 0.01 0.04 -0.10 0.50 -1.11 0.00 0.00 175.55 174.90 1lby s ARG 435 N -1.66 2.06 -1.31 -0.62 3.52 0.20 -2.59 118.95 118.55 1lby s ARG 435 Ca -0.02 -1.09 -0.12 0.00 -0.13 0.00 0.00 55.73 54.37 1lby s ARG 435 Cb -0.10 -2.67 0.00 0.00 -1.56 0.00 0.00 34.95 30.63 1lby s ARG 435 CO 0.02 -0.52 0.53 0.09 -0.81 0.00 0.00 175.30 174.60 1lby n ASN 436 N 4.57 -2.24 0.00 -2.12 3.02 -0.14 -0.38 115.26 117.97 1lby n ASN 436 Ca -0.14 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 1lby n ASN 436 Cb 0.44 -2.79 0.00 0.00 -0.61 0.00 0.00 39.78 36.82 1lby n ASN 436 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lby n GLY 437 N -1.97 0.20 3.59 7.41 0.00 -1.26 -4.99 105.19 108.17 1lby n GLY 437 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 1lby n GLY 437 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1lby s GLU 438 N -1.22 3.13 0.31 1.61 2.12 0.49 -5.05 118.70 120.08 1lby s GLU 438 Ca 0.00 -0.49 -0.30 0.00 0.36 0.00 0.00 54.97 54.55 1lby s GLU 438 Cb 0.00 -2.77 -0.11 0.00 0.26 0.00 0.00 34.13 31.51 1lby s GLU 438 CO 0.00 0.55 1.57 1.03 -0.54 0.00 0.00 175.26 177.87 1lby s ARG 439 N -0.47 4.12 0.34 4.30 1.81 -1.26 -0.63 118.95 127.17 1lby s ARG 439 Ca 0.08 2.58 0.09 0.00 -1.72 0.00 0.00 55.73 56.76 1lby s ARG 439 Cb -0.12 -3.01 -0.06 0.00 -0.45 0.00 0.00 34.95 31.30 1lby s ARG 439 CO 0.02 -0.61 -0.07 0.96 -0.68 0.00 0.00 175.30 174.92 1lby s ILE 440 N -0.21 2.33 0.11 1.52 -4.36 -0.13 -4.80 121.20 115.65 1lby s ILE 440 Ca 0.61 -2.15 -0.24 0.00 -0.26 0.00 0.00 60.65 58.62 1lby s ILE 440 Cb -0.48 -2.69 0.06 0.00 1.25 0.00 0.00 42.46 40.61 1lby s ILE 440 CO 0.51 -0.20 0.58 -1.83 0.24 0.00 0.00 174.94 174.24 1lby s GLU 441 N -3.64 1.19 0.93 0.37 -1.05 -1.24 -4.58 118.70 110.69 1lby s GLU 441 Ca 0.33 -0.34 -0.14 0.00 -0.15 0.00 0.00 54.97 54.66 1lby s GLU 441 Cb 0.02 0.55 0.16 0.00 -0.44 0.00 0.00 34.13 34.42 1lby s GLU 441 CO 0.17 -0.48 1.22 0.14 0.95 0.00 0.00 175.26 177.26 1lby s VAL 442 N -3.17 1.96 0.82 1.83 -7.23 -0.46 -2.65 120.40 111.50 1lby s VAL 442 Ca -0.02 0.00 -0.12 0.00 -1.81 0.00 0.00 61.98 60.04 1lby s VAL 442 Cb -0.01 -2.90 0.09 0.00 0.56 0.00 0.00 36.38 34.13 1lby s VAL 442 CO -0.08 0.00 1.16 -0.94 -0.31 0.00 0.00 175.10 174.93 1lby s SER 443 N -4.53 3.69 0.00 4.85 1.04 -1.26 -4.73 113.70 112.76 1lby s SER 443 Ca 0.68 2.17 0.22 0.00 0.48 0.00 0.00 55.95 59.51 1lby s SER 443 Cb -0.09 -2.57 0.09 0.00 0.10 0.00 0.00 66.02 63.56 1lby s SER 443 CO 0.52 -2.59 1.15 -0.90 0.98 0.00 0.00 173.24 172.40 1lby n ASP 444 N -3.56 2.49 -4.64 7.02 5.75 -1.26 -4.49 116.55 117.86 1lby n ASP 444 Ca 0.12 -1.74 -0.54 0.00 -0.01 0.00 0.00 54.79 52.62 1lby n ASP 444 Cb 0.52 0.22 -0.06 0.00 -1.03 0.00 0.00 41.12 40.76 1lby n ASP 444 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1lby n ALA 445 N 0.68 -0.55 0.23 2.12 0.00 -1.26 -4.89 120.51 116.85 1lby n ALA 445 Ca 0.11 0.46 0.03 0.00 0.00 0.00 0.00 53.44 54.04 1lby n ALA 445 Cb 0.52 -2.16 0.02 0.00 0.00 0.00 0.00 19.45 17.83 1lby n ALA 445 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1lby n GLU 446 N 3.80 0.63 -3.79 0.00 1.02 -1.26 -4.13 120.64 116.91 1lby n GLU 446 Ca 0.22 -0.71 -0.36 0.00 -0.02 0.00 0.00 57.16 56.29 1lby n GLU 446 Cb 0.17 -1.05 -0.07 0.00 -0.02 0.00 0.00 31.44 30.47 1lby n GLU 446 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1lby s GLU 447 N -0.62 3.89 0.55 3.49 0.41 -1.26 -4.75 118.70 120.40 1lby s GLU 447 Ca 0.06 -0.18 0.33 0.00 -0.41 0.00 0.00 54.97 54.77 1lby s GLU 447 Cb 0.05 -3.33 1.47 0.00 -1.78 0.00 0.00 34.13 30.54 1lby s GLU 447 CO 0.09 0.49 2.03 -0.07 -0.49 0.00 0.00 175.26 177.31 1lby h LEU 448 N 5.99 0.00 -8.02 1.80 3.38 -1.94 -3.33 115.31 113.20 1lby h LEU 448 Ca -0.47 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 56.87 1lby h LEU 448 Cb 1.18 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.84 1lby h LEU 448 CO 0.69 0.05 1.77 -0.47 0.09 0.00 0.00 178.44 180.57 1lby s TYR 449 N -3.81 2.62 0.34 1.13 5.04 -1.25 -4.02 117.35 117.40 1lby s TYR 449 Ca -0.00 -1.13 0.02 0.00 -2.44 0.00 0.00 57.07 53.51 1lby s TYR 449 Cb 0.10 -4.72 -0.01 0.00 0.35 0.00 0.00 41.96 37.68 1lby s TYR 449 CO 0.54 -1.89 0.38 0.00 -1.34 0.00 0.00 175.55 173.24 1lby s ASN 451 N -3.30 6.19 -0.03 0.00 0.02 -1.26 0.19 114.94 116.74 1lby s ASN 451 Ca 0.35 -0.75 -0.00 0.00 -1.02 0.00 0.00 52.86 51.44 1lby s ASN 451 Cb 0.01 -2.47 -0.04 0.00 0.02 0.00 0.00 41.25 38.78 1lby s ASN 451 CO 0.24 -1.55 0.03 0.00 0.02 0.00 0.00 177.10 175.83 1lby s ALA 452 N 4.60 3.39 -0.31 0.60 0.00 0.33 -1.36 121.76 129.01 1lby s ALA 452 Ca 0.27 -0.88 -0.12 0.00 0.00 0.00 0.00 51.96 51.24 1lby s ALA 452 Cb -0.14 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.49 1lby s ALA 452 CO 0.13 0.64 0.21 0.42 0.00 0.00 0.00 175.76 177.15 1lby s ILE 453 N -1.06 5.21 -0.05 0.00 1.01 -0.50 -1.62 121.20 124.19 1lby s ILE 453 Ca 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.73 1lby s ILE 453 Cb -0.12 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 38.79 1lby s ILE 453 CO 0.09 0.12 0.13 -0.51 0.00 0.00 0.00 174.94 174.77 1lby s ILE 454 N 1.73 -0.01 -0.36 2.92 2.07 -1.06 -1.39 121.20 125.09 1lby s ILE 454 Ca 0.06 0.05 -0.07 0.00 -1.41 0.00 0.00 60.65 59.29 1lby s ILE 454 Cb -0.17 -0.20 0.05 0.00 0.13 0.00 0.00 42.46 42.28 1lby s ILE 454 CO 0.10 0.02 0.14 -0.31 -1.91 0.00 0.00 174.94 172.98 1lby s TYR 455 N 0.36 3.30 -0.03 3.50 1.51 -0.08 -4.11 117.35 121.79 1lby s TYR 455 Ca -0.02 -1.52 0.03 0.00 -1.01 0.00 0.00 57.07 54.55 1lby s TYR 455 Cb -0.04 -2.48 0.00 0.00 -0.11 0.00 0.00 41.96 39.34 1lby s TYR 455 CO -0.01 -0.77 -0.10 0.71 -1.11 0.00 0.00 175.55 174.26 1lby s TYR 456 N 1.39 1.09 -0.08 2.71 4.12 -1.26 0.16 117.35 125.47 1lby s TYR 456 Ca -0.00 -0.29 -0.29 0.00 0.02 0.00 0.00 57.07 56.51 1lby s TYR 456 Cb -0.20 -0.77 -0.07 0.00 -1.52 0.00 0.00 41.96 39.40 1lby s TYR 456 CO 0.02 -0.12 2.00 -2.14 0.02 0.00 0.00 175.55 175.33 1lby s PRO 457 N 0.20 3.78 0.00 -1.71 0.02 -1.26 -4.76 135.00 131.27 1lby s PRO 457 Ca -0.04 2.31 0.01 0.00 0.02 0.00 0.00 61.00 63.30 1lby s PRO 457 Cb -0.09 -4.21 -0.00 0.00 0.02 0.00 0.00 34.50 30.21 1lby s PRO 457 CO 0.01 -1.36 0.29 -0.25 -0.33 0.00 0.00 177.00 175.35 1lby n ASP 458 N 8.97 0.56 -4.14 2.53 10.43 -1.26 -5.06 116.55 128.59 1lby n ASP 458 Ca 0.23 -0.78 -0.11 0.00 2.57 0.00 0.00 54.79 56.70 1lby n ASP 458 Cb 0.43 0.50 -0.09 0.00 1.84 0.00 0.00 41.12 43.80 1lby n ASP 458 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1lby s ARG 459 N -0.60 1.22 -0.04 -1.24 1.70 -1.26 -5.11 118.95 113.62 1lby s ARG 459 Ca 0.01 -1.50 -0.30 0.00 -0.47 0.00 0.00 55.73 53.47 1lby s ARG 459 Cb 0.01 0.31 -0.06 0.00 -0.57 0.00 0.00 34.95 34.64 1lby s ARG 459 CO 0.03 -0.42 1.74 0.21 -1.08 0.00 0.00 175.30 175.78 1lby s LYS 460 N -4.10 4.13 0.30 3.89 2.36 -1.26 -4.99 119.74 120.08 1lby s LYS 460 Ca 0.32 2.27 0.10 0.00 -2.55 0.00 0.00 55.97 56.12 1lby s LYS 460 Cb 0.05 -4.04 -0.05 0.00 -1.05 0.00 0.00 37.83 32.74 1lby s LYS 460 CO 0.09 -0.92 -0.10 -0.06 1.55 0.00 0.00 175.35 175.91 1lby s PHE 461 N 4.28 2.44 -0.23 4.03 2.99 -1.26 -5.05 117.98 125.18 1lby s PHE 461 Ca 0.78 -0.36 0.14 0.00 0.00 0.00 0.00 56.93 57.49 1lby s PHE 461 Cb -0.35 -1.19 0.66 0.00 0.00 0.00 0.00 43.02 42.13 1lby s PHE 461 CO 0.33 0.63 1.60 -0.35 -0.00 0.00 0.00 175.22 177.42 1lby n PRO 462 N -0.77 3.60 -2.28 0.24 -0.04 -1.26 -5.04 135.00 129.45 1lby n PRO 462 Ca -0.05 -3.01 -0.36 0.00 -0.04 0.00 0.00 63.50 60.04 1lby n PRO 462 Cb 0.61 -2.04 -0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1lby n PRO 462 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1lby s PHE 463 N -2.88 2.77 0.31 0.54 0.40 -1.26 -3.82 117.98 114.04 1lby s PHE 463 Ca 0.49 1.54 0.06 0.00 -0.60 0.00 0.00 56.93 58.42 1lby s PHE 463 Cb 0.39 -3.31 0.50 0.00 0.51 0.00 0.00 43.02 41.11 1lby s PHE 463 CO 0.11 -1.50 1.75 -0.22 0.70 0.00 0.00 175.22 176.06 1lby h LYS 464 N 1.54 0.33 -4.03 0.44 3.64 0.18 -3.43 116.57 115.25 1lby h LYS 464 Ca -0.50 -0.13 -0.12 0.00 -1.27 0.00 0.00 60.65 58.64 1lby h LYS 464 Cb 1.25 -0.02 -0.14 0.00 -0.41 0.00 0.00 32.23 32.92 1lby h LYS 464 CO 0.58 0.60 -0.45 1.03 -2.27 0.00 0.00 179.45 178.94 1lby s ARG 465 N -4.39 0.94 -0.01 1.90 0.52 -0.75 -4.93 118.95 112.23 1lby s ARG 465 Ca -0.06 -1.17 0.02 0.00 -0.52 0.00 0.00 55.73 54.00 1lby s ARG 465 Cb 0.14 0.32 0.00 0.00 0.52 0.00 0.00 34.95 35.92 1lby s ARG 465 CO 0.77 -0.30 -0.07 -1.64 0.02 0.00 0.00 175.30 174.09 1lby s MET 466 N -3.95 0.63 0.03 3.54 -1.94 -1.25 -0.51 119.30 115.86 1lby s MET 466 Ca 0.14 -0.22 -0.00 0.00 -1.71 0.00 0.00 55.69 53.90 1lby s MET 466 Cb 0.05 -0.62 -0.03 0.00 2.01 0.00 0.00 34.83 36.24 1lby s MET 466 CO -0.04 0.10 -0.04 1.03 -0.01 0.00 0.00 175.02 176.06 1lby s ARG 467 N 0.08 0.44 -0.28 2.03 1.81 -0.64 -4.97 118.95 117.42 1lby s ARG 467 Ca -0.01 -0.85 0.00 0.00 -1.72 0.00 0.00 55.73 53.16 1lby s ARG 467 Cb -0.05 0.10 0.15 0.00 -0.45 0.00 0.00 34.95 34.69 1lby s ARG 467 CO -0.00 -0.06 0.37 0.42 -0.68 0.00 0.00 175.30 175.35 1lby s ILE 468 N -2.34 -0.56 -1.82 1.52 1.01 -1.26 -2.57 121.20 115.19 1lby s ILE 468 Ca -0.07 -0.30 0.25 0.00 0.00 0.00 0.00 60.65 60.52 1lby s ILE 468 Cb -0.04 -0.95 0.13 0.00 0.01 0.00 0.00 42.46 41.61 1lby s ILE 468 CO -0.04 -0.30 1.35 0.49 0.00 0.00 0.00 174.94 176.44 1lby n PHE 469 N 5.34 0.00 -0.47 3.97 3.01 -1.26 -4.99 117.46 123.07 1lby n PHE 469 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1lby n PHE 469 Cb 0.49 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.88 1lby n PHE 469 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1lby n GLY 470 N 1.38 0.75 2.57 1.37 0.00 -1.26 -4.91 105.19 105.09 1lby n GLY 470 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 1lby n GLY 470 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lby s SER 471 N -2.52 2.64 0.32 1.61 0.15 -1.26 -3.86 113.70 110.78 1lby s SER 471 Ca 0.00 -1.70 0.02 0.00 0.70 0.00 0.00 55.95 54.97 1lby s SER 471 Cb 0.00 -0.11 0.54 0.00 -1.71 0.00 0.00 66.02 64.74 1lby s SER 471 CO 0.00 -0.34 1.91 0.00 1.20 0.00 0.00 173.24 176.00 1lby h ALA 472 N 7.51 1.38 -0.49 5.45 0.00 -1.89 0.28 119.26 131.49 1lby h ALA 472 Ca -0.03 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.83 1lby h ALA 472 Cb 1.01 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.50 1lby h ALA 472 CO 0.30 0.47 -0.03 0.00 0.00 0.00 0.00 179.25 179.99 1lby h ALA 473 N 1.48 0.43 -0.02 0.00 0.00 -1.93 0.59 119.26 119.81 1lby h ALA 473 Ca 0.18 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1lby h ALA 473 Cb 0.16 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1lby h ALA 473 CO -0.02 -0.40 -0.03 1.15 0.00 0.00 0.00 179.25 179.95 1lby h THR 474 N 0.08 1.41 -0.02 0.00 2.02 -1.48 -3.15 112.91 111.77 1lby h THR 474 Ca 0.24 -1.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.16 1lby h THR 474 Cb 0.37 2.20 -0.00 0.00 -1.74 0.00 0.00 68.15 68.98 1lby h THR 474 CO -0.43 0.33 -0.07 -0.33 0.37 0.00 0.00 175.52 175.39 1lby h GLU 475 N -0.44 0.02 0.00 6.66 5.08 -0.21 0.78 114.58 126.47 1lby h GLU 475 Ca 0.00 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1lby h GLU 475 Cb 0.55 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1lby h GLU 475 CO 0.01 0.09 -0.12 -0.07 -1.00 0.00 0.00 179.01 177.92 1lby h LEU 476 N 0.02 0.00 0.05 1.33 3.38 0.18 -2.37 115.31 117.90 1lby h LEU 476 Ca 0.01 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.72 1lby h LEU 476 Cb 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1lby h LEU 476 CO 0.01 0.12 -1.29 0.00 0.09 0.00 0.00 178.44 177.37 1lby h PHE 478 N 0.03 0.48 0.01 0.00 0.05 -0.87 0.17 116.94 116.81 1lby h PHE 478 Ca -0.13 0.01 -0.21 0.00 3.82 0.00 0.00 57.97 61.46 1lby h PHE 478 Cb 1.90 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 39.69 1lby h PHE 478 CO 0.03 0.29 -0.92 0.35 -0.18 0.00 0.00 178.31 177.88 1lby h PHE 479 N 0.51 0.38 -0.80 -0.55 3.57 -1.42 1.50 116.94 120.13 1lby h PHE 479 Ca 0.15 -0.21 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 1lby h PHE 479 Cb 0.00 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 1lby h PHE 479 CO -0.00 1.04 0.49 0.00 -2.23 0.00 0.00 178.31 177.61 1lby h ALA 480 N 0.89 1.01 -0.01 2.41 0.00 -0.13 -1.82 119.26 121.62 1lby h ALA 480 Ca -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1lby h ALA 480 Cb 1.55 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1lby h ALA 480 CO 0.14 0.47 -0.02 -0.40 0.00 0.00 0.00 179.25 179.44 1lby n ASP 481 N -4.48 1.20 -0.19 0.00 3.85 -0.14 -2.84 116.55 113.95 1lby n ASP 481 Ca 0.08 -1.34 -0.02 0.00 -0.71 0.00 0.00 54.79 52.79 1lby n ASP 481 Cb 0.05 0.01 -0.01 0.00 -1.35 0.00 0.00 41.12 39.82 1lby n ASP 481 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1lby n GLY 482 N 1.17 0.52 0.19 6.12 0.00 -0.68 -4.46 105.19 108.05 1lby n GLY 482 Ca 0.19 -0.95 0.07 0.00 0.00 0.00 0.00 46.02 45.33 1lby n GLY 482 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1lby h SER 483 N 0.00 0.00 -3.83 1.61 4.64 0.18 -3.43 113.55 112.72 1lby h SER 483 Ca -0.05 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.89 1lby h SER 483 Cb 0.27 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.21 1lby h SER 483 CO 0.07 0.31 -0.73 -0.36 -0.87 0.00 0.00 176.83 175.24 1lby s PHE 484 N -3.35 1.40 0.11 4.77 0.40 -0.10 -4.95 117.98 116.26 1lby s PHE 484 Ca 0.02 -0.65 -0.01 0.00 -0.60 0.00 0.00 56.93 55.69 1lby s PHE 484 Cb 0.09 -0.70 -0.17 0.00 0.51 0.00 0.00 43.02 42.75 1lby s PHE 484 CO 0.68 0.16 1.25 -0.44 0.70 0.00 0.00 175.22 177.57 1lby h ASP 485 N 2.96 0.32 -4.69 1.36 3.32 -1.51 -3.40 116.42 114.79 1lby h ASP 485 Ca -0.38 -0.31 -0.06 0.00 0.02 0.00 0.00 57.03 56.30 1lby h ASP 485 Cb 1.20 -0.10 -0.20 0.00 0.22 0.00 0.00 39.33 40.45 1lby h ASP 485 CO 0.59 1.18 0.13 0.00 -1.72 0.00 0.00 179.24 179.43 1lby s PHE 487 N -0.72 2.93 -0.06 0.00 5.36 -0.82 -1.41 117.98 123.26 1lby s PHE 487 Ca -0.08 -0.39 -0.00 0.00 -0.96 0.00 0.00 56.93 55.50 1lby s PHE 487 Cb -0.02 -1.88 0.02 0.00 -0.34 0.00 0.00 43.02 40.81 1lby s PHE 487 CO 0.07 -0.06 -0.02 -0.51 -1.46 0.00 0.00 175.22 173.24 1lby s LEU 488 N 0.21 0.98 -0.21 6.12 1.43 -0.49 0.11 118.68 126.84 1lby s LEU 488 Ca -0.05 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 52.96 1lby s LEU 488 Cb -0.14 -0.45 0.03 0.00 0.03 0.00 0.00 46.19 45.66 1lby s LEU 488 CO 0.04 -0.12 -0.16 -0.62 0.23 0.00 0.00 176.35 175.72 1lby s ASP 489 N 1.44 3.54 -0.01 2.29 -1.08 0.11 -0.91 116.67 122.06 1lby s ASP 489 Ca -0.03 -0.90 0.02 0.00 -0.52 0.00 0.00 52.55 51.12 1lby s ASP 489 Cb -0.13 -1.46 0.03 0.00 -1.46 0.00 0.00 42.92 39.90 1lby s ASP 489 CO -0.03 -0.08 0.83 2.30 0.52 0.00 0.00 175.17 178.71 1lby n ILE 490 N 4.58 0.63 -1.68 4.11 -5.35 0.41 -0.74 119.36 121.32 1lby n ILE 490 Ca -0.18 -0.67 -0.54 0.00 -0.27 0.00 0.00 62.75 61.09 1lby n ILE 490 Cb 0.47 0.62 -0.06 0.00 -1.74 0.00 0.00 39.64 38.92 1lby n ILE 490 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1lby n ARG 491 N -0.36 1.46 0.02 6.28 1.74 -1.16 -4.80 116.66 119.83 1lby n ARG 491 Ca 0.02 0.52 0.14 0.00 -0.77 0.00 0.00 57.85 57.76 1lby n ARG 491 Cb 0.42 -2.31 0.60 0.00 -1.02 0.00 0.00 32.46 30.15 1lby n ARG 491 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1lby h PRO 492 N 8.38 0.17 0.00 5.56 0.13 -1.96 0.41 132.00 144.69 1lby h PRO 492 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1lby h PRO 492 Cb 1.30 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1lby h PRO 492 CO 0.97 0.11 0.00 0.41 -0.23 0.00 0.00 178.00 179.26 1lby n GLY 493 N -1.57 -0.62 3.44 1.56 0.00 -1.26 -4.93 105.19 101.82 1lby n GLY 493 Ca 0.07 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 1lby n GLY 493 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1lby n LYS 494 N -0.81 -1.72 -0.07 1.61 4.81 0.13 -4.94 118.16 117.18 1lby n LYS 494 Ca 0.09 1.27 -0.13 0.00 -0.87 0.00 0.00 58.31 58.68 1lby n LYS 494 Cb 0.04 -3.38 -0.11 0.00 0.02 0.00 0.00 35.03 31.60 1lby n LYS 494 CO 0.00 0.00 0.00 0.52 1.17 0.00 0.00 177.40 179.09 1lby h MET 495 N 0.80 0.00 -6.11 1.64 2.86 -1.77 -3.38 114.93 108.98 1lby h MET 495 Ca -0.41 0.00 -0.65 0.00 -2.06 0.00 0.00 59.70 56.59 1lby h MET 495 Cb 1.27 0.00 0.12 0.00 0.06 0.00 0.00 31.60 33.05 1lby h MET 495 CO 0.30 0.84 -0.45 1.28 1.06 0.00 0.00 176.91 179.93 1lby n LEU 496 N -4.62 -0.81 -4.52 1.22 4.77 -1.21 -4.70 117.00 107.13 1lby n LEU 496 Ca -0.11 1.08 -0.24 0.00 -0.03 0.00 0.00 56.01 56.72 1lby n LEU 496 Cb 0.43 -1.01 -0.09 0.00 -2.33 0.00 0.00 43.42 40.41 1lby n LEU 496 CO 0.27 -2.85 -0.44 -0.13 -1.33 0.00 0.00 177.39 172.92 1lby s ARG 497 N -1.14 1.85 0.20 3.23 1.81 -1.26 -0.49 118.95 123.14 1lby s ARG 497 Ca 0.62 -1.68 -0.19 0.00 -1.72 0.00 0.00 55.73 52.77 1lby s ARG 497 Cb -0.83 -1.88 0.16 0.00 -0.45 0.00 0.00 34.95 31.96 1lby s ARG 497 CO 0.58 0.34 1.60 0.97 -0.68 0.00 0.00 175.30 178.10 1lby h ILE 498 N 2.16 0.22 0.00 1.52 6.09 -1.84 1.18 117.51 126.84 1lby h ILE 498 Ca -0.41 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.08 1lby h ILE 498 Cb 1.26 0.22 0.00 0.00 0.47 0.00 0.00 36.82 38.77 1lby h ILE 498 CO 0.60 0.00 0.00 0.00 -3.07 0.00 0.00 178.15 175.68 1lby n TYR 499 N -5.44 0.39 -0.03 2.19 0.18 -1.26 -0.90 117.16 112.29 1lby n TYR 499 Ca 0.05 0.18 -0.16 0.00 1.88 0.00 0.00 57.90 59.85 1lby n TYR 499 Cb 0.35 -0.79 -0.08 0.00 -0.38 0.00 0.00 39.34 38.44 1lby n TYR 499 CO 0.00 0.00 0.00 -0.44 -2.08 0.00 0.00 176.86 174.34 1lby h ASP 500 N 0.00 0.62 0.00 9.48 3.32 0.10 -3.37 116.42 126.57 1lby h ASP 500 Ca 0.00 -0.64 -0.15 0.00 0.02 0.00 0.00 57.03 56.26 1lby h ASP 500 Cb 0.15 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 1lby h ASP 500 CO 0.00 1.16 -1.79 0.00 -1.72 0.00 0.00 179.24 176.89 1lby n ALA 501 N -2.55 1.98 -0.09 3.45 0.00 -0.41 -3.51 120.51 119.39 1lby n ALA 501 Ca -0.08 -0.66 -0.07 0.00 0.00 0.00 0.00 53.44 52.64 1lby n ALA 501 Cb 0.60 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1lby n ALA 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lby h ALA 502 N 0.85 0.35 -0.11 0.00 0.00 -1.26 0.13 119.26 119.22 1lby h ALA 502 Ca -0.22 0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 1lby h ALA 502 Cb 1.37 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1lby h ALA 502 CO 0.01 -0.32 -0.63 0.00 0.00 0.00 0.00 179.25 178.31 1lby h ALA 503 N 1.22 0.70 -0.27 0.00 0.00 -1.84 -1.45 119.26 117.62 1lby h ALA 503 Ca 0.14 -0.56 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1lby h ALA 503 Cb 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1lby h ALA 503 CO -0.17 0.73 -0.06 0.78 0.00 0.00 0.00 179.25 180.53 1lby h GLY 504 N 1.26 0.56 0.74 0.00 0.00 -1.70 0.13 103.07 104.06 1lby h GLY 504 Ca -0.01 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1lby h GLY 504 CO 0.11 0.42 -0.24 -2.08 0.00 0.00 0.00 176.54 174.75 1lby h VAL 505 N 0.28 0.49 -1.00 4.60 2.07 -0.71 0.71 116.25 122.70 1lby h VAL 505 Ca 0.07 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.63 1lby h VAL 505 Cb 0.53 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 1lby h VAL 505 CO 0.03 0.00 0.65 0.15 0.02 0.00 0.00 177.57 178.42 1lby h PHE 506 N -0.51 1.22 -0.27 1.57 3.57 -1.21 0.16 116.94 121.48 1lby h PHE 506 Ca -0.01 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1lby h PHE 506 Cb 0.47 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1lby h PHE 506 CO -0.16 0.70 -0.01 0.82 -2.23 0.00 0.00 178.31 177.44 1lby h ILE 507 N 1.26 1.26 -0.19 1.41 2.04 -0.70 -1.71 117.51 120.88 1lby h ILE 507 Ca 0.40 -0.93 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 1lby h ILE 507 Cb 0.01 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1lby h ILE 507 CO -0.13 0.30 -0.07 0.00 0.00 0.00 0.00 178.15 178.25 1lby h ALA 508 N 0.82 0.27 -0.83 1.87 0.00 0.10 -1.60 119.26 119.88 1lby h ALA 508 Ca 0.07 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1lby h ALA 508 Cb 0.43 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1lby h ALA 508 CO 0.01 0.07 0.51 0.93 0.00 0.00 0.00 179.25 180.77 1lby h GLU 509 N 0.09 0.89 0.00 0.00 5.08 -0.79 0.36 114.58 120.21 1lby h GLU 509 Ca 0.05 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1lby h GLU 509 Cb 0.53 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1lby h GLU 509 CO 0.02 0.59 -0.04 0.87 -1.00 0.00 0.00 179.01 179.45 1lby h LYS 510 N 0.91 0.00 -0.09 2.33 1.79 -0.92 -0.57 116.57 120.03 1lby h LYS 510 Ca 0.37 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.84 1lby h LYS 510 Cb 0.20 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 1lby h LYS 510 CO -0.18 0.04 0.00 0.00 -1.08 0.00 0.00 179.45 178.23 1lby n ALA 511 N -2.26 2.56 0.00 3.86 0.00 0.11 -4.37 120.51 120.41 1lby n ALA 511 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1lby n ALA 511 Cb 0.14 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1lby n ALA 511 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lby n GLY 512 N 1.05 0.95 3.86 0.00 0.00 -0.22 -1.36 105.19 109.46 1lby n GLY 512 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1lby n GLY 512 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lby s GLY 513 N -1.78 2.29 -0.47 -0.02 0.00 -0.43 -4.56 107.32 102.35 1lby s GLY 513 Ca 0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 44.72 44.47 1lby s GLY 513 CO 0.00 0.16 0.76 1.25 0.00 0.00 0.00 173.10 175.27 1lby s LYS 514 N -3.03 3.33 -0.20 2.90 2.20 0.15 -4.15 119.74 120.95 1lby s LYS 514 Ca 0.53 -0.28 -0.02 0.00 -0.36 0.00 0.00 55.97 55.84 1lby s LYS 514 Cb -0.10 -3.98 0.00 0.00 -1.51 0.00 0.00 37.83 32.24 1lby s LYS 514 CO 0.19 -1.17 -0.10 0.08 -0.36 0.00 0.00 175.35 173.99 1lby s VAL 515 N 3.22 2.92 0.28 4.02 1.01 -1.26 -3.39 120.40 127.21 1lby s VAL 515 Ca 0.27 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.63 1lby s VAL 515 Cb -0.13 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1lby s VAL 515 CO 0.20 0.47 0.18 0.42 0.00 0.00 0.00 175.10 176.37 1lby s THR 516 N 1.33 0.16 1.00 3.92 -4.23 -0.95 -4.57 115.64 112.31 1lby s THR 516 Ca 0.04 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.41 1lby s THR 516 Cb -0.14 -2.50 0.19 0.00 1.34 0.00 0.00 72.50 71.39 1lby s THR 516 CO -0.06 0.00 1.14 -1.61 -0.54 0.00 0.00 174.62 173.55 1lby s GLU 517 N -3.81 0.37 0.55 3.99 0.41 0.78 -1.55 118.70 119.44 1lby s GLU 517 Ca 0.38 0.20 0.30 0.00 -0.41 0.00 0.00 54.97 55.43 1lby s GLU 517 Cb 0.05 -1.76 1.46 0.00 -1.78 0.00 0.00 34.13 32.10 1lby s GLU 517 CO 0.19 -2.70 1.91 1.25 -0.49 0.00 0.00 175.26 175.42 1lby h LEU 518 N -1.86 0.00 0.00 1.80 5.85 -1.87 0.10 115.31 119.34 1lby h LEU 518 Ca -0.50 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.04 1lby h LEU 518 Cb 1.32 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 1lby h LEU 518 CO 0.53 0.00 -1.07 -2.24 -0.34 0.00 0.00 178.44 175.32 1lby h ASP 519 N 0.00 0.00 0.00 1.25 2.03 -1.96 -3.47 116.42 114.26 1lby h ASP 519 Ca 0.35 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.65 1lby h ASP 519 Cb 1.45 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.95 1lby h ASP 519 CO -0.00 0.75 0.00 0.61 -1.03 0.00 0.00 179.24 179.57 1lby n GLY 520 N 1.36 1.07 3.77 7.15 0.00 0.02 -5.07 105.19 113.50 1lby n GLY 520 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 1lby n GLY 520 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1lby s GLU 521 N -0.24 4.14 1.01 1.61 2.12 -1.26 -4.72 118.70 121.36 1lby s GLU 521 Ca 0.00 1.70 -0.11 0.00 0.36 0.00 0.00 54.97 56.91 1lby s GLU 521 Cb 0.00 -2.65 0.20 0.00 0.26 0.00 0.00 34.13 31.93 1lby s GLU 521 CO 0.00 -0.21 1.08 -1.13 -0.54 0.00 0.00 175.26 174.46 1lby n SER 522 N 0.09 -0.45 -0.85 -1.70 3.41 -1.26 -0.16 113.62 112.70 1lby n SER 522 Ca 0.04 0.22 0.09 0.00 -0.26 0.00 0.00 58.87 58.96 1lby n SER 522 Cb 0.48 -1.39 0.14 0.00 -0.26 0.00 0.00 64.21 63.17 1lby n SER 522 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1lby n LEU 523 N -4.41 2.88 -0.32 1.04 7.99 -1.26 -4.54 117.00 118.38 1lby n LEU 523 Ca 0.09 -1.33 0.28 0.00 -0.01 0.00 0.00 56.01 55.04 1lby n LEU 523 Cb 0.53 -0.13 0.61 0.00 -0.11 0.00 0.00 43.42 44.32 1lby n LEU 523 CO 0.52 0.59 1.26 1.23 -1.51 0.00 0.00 177.39 179.48 1lby h GLY 524 N 3.57 0.72 -3.79 -0.72 0.00 -1.92 0.50 103.07 101.43 1lby h GLY 524 Ca 0.00 -0.12 -0.32 0.00 0.00 0.00 0.00 47.33 46.89 1lby h GLY 524 CO 0.00 -0.09 0.40 0.70 0.00 0.00 0.00 176.54 177.55 1lby n ASN 525 N -4.45 4.45 -4.74 0.19 3.02 -1.26 0.14 115.26 112.60 1lby n ASN 525 Ca 0.25 -3.33 -0.41 0.00 -0.03 0.00 0.00 54.58 51.07 1lby n ASN 525 Cb 1.03 -0.78 -0.04 0.00 -0.61 0.00 0.00 39.78 39.38 1lby n ASN 525 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1lby s LYS 526 N -3.04 4.57 0.16 3.52 -0.14 0.17 -4.80 119.74 120.18 1lby s LYS 526 Ca 0.55 1.80 -0.19 0.00 -1.36 0.00 0.00 55.97 56.77 1lby s LYS 526 Cb 0.45 -3.24 -0.07 0.00 -1.68 0.00 0.00 37.83 33.28 1lby s LYS 526 CO 0.13 0.05 0.64 0.21 -0.76 0.00 0.00 175.35 175.62 1lby s LYS 527 N -0.61 4.21 -1.31 1.68 2.20 -1.26 -0.19 119.74 124.46 1lby s LYS 527 Ca 0.49 0.77 -0.11 0.00 -0.36 0.00 0.00 55.97 56.76 1lby s LYS 527 Cb -0.31 -3.03 0.14 0.00 -1.51 0.00 0.00 37.83 33.11 1lby s LYS 527 CO 0.37 0.50 1.88 1.19 -0.36 0.00 0.00 175.35 178.94 1lby n PHE 528 N 1.12 3.40 -4.14 4.03 0.99 0.49 -4.73 117.46 118.62 1lby n PHE 528 Ca -0.06 -2.90 -0.15 0.00 -0.00 0.00 0.00 57.45 54.34 1lby n PHE 528 Cb 0.51 -2.13 -0.06 0.00 -1.00 0.00 0.00 39.48 36.80 1lby n PHE 528 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.76 176.92 1lby s ASP 529 N 1.72 0.95 0.27 4.37 3.84 -1.26 -4.80 116.67 121.77 1lby s ASP 529 Ca 0.42 -1.50 0.23 0.00 -0.00 0.00 0.00 52.55 51.70 1lby s ASP 529 Cb 0.09 0.60 0.17 0.00 -1.38 0.00 0.00 42.92 42.40 1lby s ASP 529 CO -0.01 -1.18 1.28 0.24 -0.00 0.00 0.00 175.17 175.50 1lby h MET 530 N 2.18 0.00 0.00 2.11 2.86 -1.98 -3.24 114.93 116.87 1lby h MET 530 Ca -0.28 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1lby h MET 530 Cb 1.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.90 1lby h MET 530 CO 0.39 0.00 0.00 1.96 1.06 0.00 0.00 176.91 180.32 1lby h GLN 531 N 0.00 0.00 -6.79 1.72 7.50 -1.98 -3.46 115.11 112.11 1lby h GLN 531 Ca 0.00 0.00 -0.53 0.00 0.50 0.00 0.00 58.65 58.62 1lby h GLN 531 Cb 0.97 0.00 0.06 0.00 0.05 0.00 0.00 27.48 28.56 1lby h GLN 531 CO 0.00 0.00 0.74 -2.00 -1.50 0.00 0.00 178.83 176.07 1lby s GLU 532 N -3.21 4.27 0.18 1.46 2.56 -1.22 -5.01 118.70 117.72 1lby s GLU 532 Ca 0.07 2.32 -0.01 0.00 0.00 0.00 0.00 54.97 57.35 1lby s GLU 532 Cb 0.07 -3.09 -0.04 0.00 2.00 0.00 0.00 34.13 33.07 1lby s GLU 532 CO 0.64 -0.40 0.11 1.03 -0.56 0.00 0.00 175.26 176.08 1lby s ARG 533 N -0.75 1.14 0.09 4.30 0.52 -1.26 -3.98 118.95 119.01 1lby s ARG 533 Ca 0.57 -1.59 -0.26 0.00 -0.52 0.00 0.00 55.73 53.93 1lby s ARG 533 Cb -0.42 0.22 0.08 0.00 0.52 0.00 0.00 34.95 35.35 1lby s ARG 533 CO 0.47 -0.34 0.86 -0.48 0.02 0.00 0.00 175.30 175.82 1lby s LEU 534 N -3.14 -0.33 0.18 2.53 2.34 0.36 -4.94 118.68 115.67 1lby s LEU 534 Ca 0.35 -0.17 0.06 0.00 0.06 0.00 0.00 54.13 54.43 1lby s LEU 534 Cb 0.07 2.20 -0.04 0.00 -0.56 0.00 0.00 46.19 47.86 1lby s LEU 534 CO 0.09 -0.81 0.10 0.20 -1.06 0.00 0.00 176.35 174.88 1lby s ASN 535 N -2.70 5.31 -0.01 1.48 -0.87 -1.26 -3.31 114.94 113.59 1lby s ASN 535 Ca 0.07 -0.22 -0.01 0.00 -1.57 0.00 0.00 52.86 51.14 1lby s ASN 535 Cb -0.01 -1.32 0.01 0.00 -0.02 0.00 0.00 41.25 39.90 1lby s ASN 535 CO -0.05 0.06 0.02 -0.63 -2.57 0.00 0.00 177.10 173.93 1lby s ILE 536 N -1.79 -0.01 -0.09 0.60 1.01 0.08 -4.22 121.20 116.78 1lby s ILE 536 Ca 0.30 0.03 -0.01 0.00 0.00 0.00 0.00 60.65 60.97 1lby s ILE 536 Cb -0.10 -0.04 0.03 0.00 0.01 0.00 0.00 42.46 42.36 1lby s ILE 536 CO 0.22 0.01 -0.03 -0.69 0.00 0.00 0.00 174.94 174.46 1lby s VAL 537 N 0.15 0.61 -0.04 2.92 1.01 -0.60 -0.71 120.40 123.75 1lby s VAL 537 Ca -0.01 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 61.96 1lby s VAL 537 Cb -0.02 -0.73 0.00 0.00 0.00 0.00 0.00 36.38 35.64 1lby s VAL 537 CO -0.00 0.29 -0.11 0.00 0.00 0.00 0.00 175.10 175.27 1lby s ALA 538 N 1.88 1.09 -0.11 5.51 0.00 0.31 -2.24 121.76 128.19 1lby s ALA 538 Ca 0.05 -0.43 -0.33 0.00 0.00 0.00 0.00 51.96 51.24 1lby s ALA 538 Cb -0.12 -0.40 0.14 0.00 0.00 0.00 0.00 23.12 22.74 1lby s ALA 538 CO -0.06 0.17 1.39 0.00 0.00 0.00 0.00 175.76 177.25 1lby s ALA 539 N 0.23 -2.39 0.83 0.00 0.00 -1.22 -1.94 121.76 117.27 1lby s ALA 539 Ca -0.05 1.08 -0.10 0.00 0.00 0.00 0.00 51.96 52.89 1lby s ALA 539 Cb -0.10 0.15 0.09 0.00 0.00 0.00 0.00 23.12 23.25 1lby s ALA 539 CO 0.01 -0.96 1.11 0.54 0.00 0.00 0.00 175.76 176.46 1lby s ASN 540 N -2.81 3.92 0.29 0.00 2.20 -1.26 -0.67 114.94 116.60 1lby s ASN 540 Ca 0.14 1.94 0.03 0.00 -0.94 0.00 0.00 52.86 54.02 1lby s ASN 540 Cb 0.05 -2.53 0.63 0.00 -2.00 0.00 0.00 41.25 37.41 1lby s ASN 540 CO -0.05 -2.43 1.79 -0.33 -2.94 0.00 0.00 177.10 173.13 1lby h GLU 541 N -1.40 0.75 -0.37 3.55 4.39 -1.93 0.33 114.58 119.90 1lby h GLU 541 Ca -0.44 -0.05 -0.15 0.00 0.34 0.00 0.00 59.36 59.06 1lby h GLU 541 Cb 1.25 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.72 1lby h GLU 541 CO 0.48 0.50 -0.37 0.87 -1.16 0.00 0.00 179.01 179.33 1lby h LYS 542 N 0.77 0.90 0.01 2.33 1.79 -1.91 -3.21 116.57 117.26 1lby h LYS 542 Ca 0.53 -0.48 -0.21 0.00 -2.18 0.00 0.00 60.65 58.31 1lby h LYS 542 Cb 0.73 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.39 1lby h LYS 542 CO -0.35 1.13 -0.91 1.25 -1.08 0.00 0.00 179.45 179.49 1lby h LEU 543 N 0.71 0.34 0.39 2.94 5.85 -1.43 -3.37 115.31 120.74 1lby h LEU 543 Ca 0.06 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1lby h LEU 543 Cb 0.97 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 1lby h LEU 543 CO 0.09 1.08 -0.36 -0.74 -0.34 0.00 0.00 178.44 178.17 1lby h HIS 544 N 0.14 -0.98 -1.10 1.25 2.76 -0.39 0.11 115.15 116.94 1lby h HIS 544 Ca -0.06 0.00 0.32 0.00 -2.20 0.00 0.00 60.37 58.43 1lby h HIS 544 Cb 1.55 0.38 -0.05 0.00 1.55 0.00 0.00 27.41 30.84 1lby h HIS 544 CO 0.04 -0.51 0.79 -1.00 -1.30 0.00 0.00 177.93 175.94 1lby h PRO 545 N -0.77 0.02 -0.34 5.26 0.13 -1.73 -1.48 132.00 133.08 1lby h PRO 545 Ca -0.03 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.07 1lby h PRO 545 Cb 0.68 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1lby h PRO 545 CO -0.04 0.01 0.11 0.87 -0.23 0.00 0.00 178.00 178.72 1lby h LYS 546 N 0.02 0.54 0.00 0.86 1.57 -0.95 -2.82 116.57 115.78 1lby h LYS 546 Ca 0.53 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 59.15 1lby h LYS 546 Cb 2.07 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 34.30 1lby h LYS 546 CO -0.02 0.57 -0.18 -0.07 -0.57 0.00 0.00 179.45 179.17 1lby h LEU 547 N 0.40 0.00 -0.30 2.94 3.38 -0.99 -0.79 115.31 119.96 1lby h LEU 547 Ca 0.11 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1lby h LEU 547 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1lby h LEU 547 CO -0.00 0.18 0.01 -0.07 0.09 0.00 0.00 178.44 178.65 1lby h LEU 548 N 0.00 0.51 -0.51 1.67 3.38 -1.34 0.14 115.31 119.16 1lby h LEU 548 Ca -0.00 -0.30 -0.17 0.00 0.09 0.00 0.00 57.88 57.50 1lby h LEU 548 Cb 0.67 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1lby h LEU 548 CO 0.02 0.69 -0.63 -0.33 0.09 0.00 0.00 178.44 178.28 1lby h GLU 549 N 0.32 0.41 0.29 1.13 4.39 -1.21 -2.49 114.58 117.43 1lby h GLU 549 Ca 0.09 -0.29 -0.01 0.00 0.34 0.00 0.00 59.36 59.49 1lby h GLU 549 Cb 0.42 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 1lby h GLU 549 CO 0.01 0.91 -0.35 1.25 -1.16 0.00 0.00 179.01 179.67 1lby h LEU 550 N 0.30 -0.98 0.00 1.33 5.85 -1.01 -2.50 115.31 118.30 1lby h LEU 550 Ca -0.01 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1lby h LEU 550 Cb 1.18 0.33 0.00 0.00 0.37 0.00 0.00 40.66 42.54 1lby h LEU 550 CO 0.11 -0.44 0.00 2.30 -0.34 0.00 0.00 178.44 180.07 1lby n ILE 551 N -4.50 1.29 0.00 4.05 -5.35 0.49 -5.08 119.36 110.26 1lby n ILE 551 Ca -0.08 0.32 0.00 0.00 -0.27 0.00 0.00 62.75 62.72 1lby n ILE 551 Cb 0.31 -1.17 0.00 0.00 -1.74 0.00 0.00 39.64 37.04 1lby n ILE 551 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96