#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pdu s ILE 320 N 0.00 3.99 0.77 0.00 -4.36 -1.26 -5.03 121.20 115.31 1pdu s ILE 320 Ca 0.00 1.06 -0.14 0.00 -0.26 0.00 0.00 60.65 61.31 1pdu s ILE 320 Cb 0.00 -3.49 0.06 0.00 1.25 0.00 0.00 42.46 40.28 1pdu s ILE 320 CO 0.00 -0.44 1.18 -0.94 0.24 0.00 0.00 174.94 174.98 1pdu s SER 321 N -2.53 3.99 0.15 4.36 1.04 -1.26 -4.78 113.70 114.67 1pdu s SER 321 Ca 0.64 2.28 -0.17 0.00 0.48 0.00 0.00 55.95 59.18 1pdu s SER 321 Cb -0.14 -2.58 0.07 0.00 0.10 0.00 0.00 66.02 63.46 1pdu s SER 321 CO 0.28 -2.40 1.73 0.25 0.98 0.00 0.00 173.24 174.08 1pdu h LEU 322 N -0.66 -0.01 -1.24 2.42 5.85 -1.99 0.46 115.31 120.16 1pdu h LEU 322 Ca -0.46 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.26 1pdu h LEU 322 Cb 1.28 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 1pdu h LEU 322 CO 0.48 0.03 -0.02 -0.29 -0.34 0.00 0.00 178.44 178.30 1pdu h ILE 323 N 0.18 1.20 -0.01 4.05 2.10 -1.94 0.69 117.51 123.77 1pdu h ILE 323 Ca 0.16 -0.80 -0.16 0.00 1.08 0.00 0.00 64.86 65.15 1pdu h ILE 323 Cb 0.19 0.99 -0.02 0.00 -1.09 0.00 0.00 36.82 36.89 1pdu h ILE 323 CO -0.22 0.27 -0.73 0.74 -1.08 0.00 0.00 178.15 177.13 1pdu h THR 324 N 0.47 1.49 -0.44 2.19 2.02 -1.79 -0.39 112.91 116.46 1pdu h THR 324 Ca 0.10 -2.40 -0.14 0.00 0.77 0.00 0.00 66.41 64.74 1pdu h THR 324 Cb 0.34 2.30 -0.01 0.00 -1.74 0.00 0.00 68.15 69.04 1pdu h THR 324 CO 0.01 0.69 -0.27 0.00 0.37 0.00 0.00 175.52 176.32 1pdu h ALA 325 N 1.21 0.68 -0.06 6.16 0.00 -0.01 -1.23 119.26 126.01 1pdu h ALA 325 Ca -0.01 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1pdu h ALA 325 Cb 1.28 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1pdu h ALA 325 CO 0.10 0.67 -0.01 -0.07 0.00 0.00 0.00 179.25 179.94 1pdu h LEU 326 N 0.80 0.12 -1.01 0.00 3.38 -0.71 -1.32 115.31 116.57 1pdu h LEU 326 Ca 0.09 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1pdu h LEU 326 Cb 0.85 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.52 1pdu h LEU 326 CO 0.07 0.44 0.66 0.58 0.09 0.00 0.00 178.44 180.29 1pdu h VAL 327 N -0.21 1.26 -0.48 1.22 2.07 -1.03 0.79 116.25 119.87 1pdu h VAL 327 Ca 0.02 -0.48 -0.09 0.00 0.82 0.00 0.00 66.70 66.97 1pdu h VAL 327 Cb 0.38 -0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 1pdu h VAL 327 CO 0.01 0.25 -0.08 0.03 0.02 0.00 0.00 177.57 177.80 1pdu h ARG 328 N 1.37 0.87 -0.24 1.57 3.08 -1.15 -0.10 114.38 119.78 1pdu h ARG 328 Ca 0.37 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 60.10 1pdu h ARG 328 Cb -0.15 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 1pdu h ARG 328 CO -0.08 0.91 0.03 0.77 -1.07 0.00 0.00 179.97 180.54 1pdu h SER 329 N 0.79 0.38 0.16 7.04 0.02 -0.41 0.16 113.55 121.68 1pdu h SER 329 Ca 0.13 -0.27 0.02 0.00 -0.84 0.00 0.00 61.79 60.83 1pdu h SER 329 Cb 0.58 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.98 1pdu h SER 329 CO 0.04 0.55 -0.35 -0.74 -1.14 0.00 0.00 176.83 175.19 1pdu h HIS 330 N 0.19 -0.96 -0.38 3.45 -0.00 -0.61 -0.95 115.15 115.91 1pdu h HIS 330 Ca 0.07 0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.51 1pdu h HIS 330 Cb 0.33 0.40 -0.05 0.00 -0.00 0.00 0.00 27.41 28.10 1pdu h HIS 330 CO 0.02 -0.46 0.09 0.28 -0.00 0.00 0.00 177.93 177.86 1pdu h VAL 331 N -0.60 0.83 0.00 5.26 2.07 -0.86 -0.90 116.25 122.04 1pdu h VAL 331 Ca 0.02 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1pdu h VAL 331 Cb 0.62 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1pdu h VAL 331 CO -0.18 0.04 -0.01 0.44 0.02 0.00 0.00 177.57 177.89 1pdu h ASP 332 N 0.23 0.00 -0.25 0.57 3.45 -0.36 -2.58 116.42 117.48 1pdu h ASP 332 Ca 0.18 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.64 1pdu h ASP 332 Cb 0.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.96 1pdu h ASP 332 CO -0.22 0.01 0.00 0.35 -1.57 0.00 0.00 179.24 177.81 1pdu n THR 333 N -3.13 1.28 -3.80 0.35 -2.24 -0.39 -4.92 114.28 101.42 1pdu n THR 333 Ca -0.02 -1.23 -0.37 0.00 -2.27 0.00 0.00 64.05 60.17 1pdu n THR 333 Cb 0.16 0.32 -0.13 0.00 -2.10 0.00 0.00 70.33 68.58 1pdu n THR 333 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1pdu s THR 334 N -1.43 3.72 0.12 4.28 2.01 -0.44 -4.89 115.64 119.01 1pdu s THR 334 Ca 0.23 -0.78 -0.35 0.00 0.31 0.00 0.00 61.69 61.10 1pdu s THR 334 Cb 0.15 -2.92 -0.17 0.00 0.01 0.00 0.00 72.50 69.57 1pdu s THR 334 CO 0.11 0.10 1.17 -2.65 -0.69 0.00 0.00 174.62 172.66 1pdu n PRO 335 N 4.82 0.92 -3.39 4.92 -0.02 -1.26 -4.93 135.00 136.06 1pdu n PRO 335 Ca -0.15 0.33 -0.35 0.00 -2.02 0.00 0.00 63.50 61.31 1pdu n PRO 335 Cb 0.48 -1.85 -0.06 0.00 -0.02 0.00 0.00 33.50 32.05 1pdu n PRO 335 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1pdu s ASP 336 N 0.10 6.80 0.32 2.55 -4.77 -1.26 -4.98 116.67 115.42 1pdu s ASP 336 Ca 0.79 1.03 0.04 0.00 -3.30 0.00 0.00 52.55 51.11 1pdu s ASP 336 Cb -0.95 -2.27 0.82 0.00 -1.09 0.00 0.00 42.92 39.43 1pdu s ASP 336 CO 0.51 0.12 1.56 -2.65 0.70 0.00 0.00 175.17 175.42 1pdu n PRO 337 N 0.86 -0.08 0.16 2.11 -0.02 -1.26 -0.64 135.00 136.14 1pdu n PRO 337 Ca -0.06 1.48 0.13 0.00 -2.02 0.00 0.00 63.50 63.03 1pdu n PRO 337 Cb 0.52 -2.38 0.58 0.00 -0.02 0.00 0.00 33.50 32.19 1pdu n PRO 337 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1pdu h SER 338 N 0.00 0.00 -0.14 2.55 4.64 -2.02 -3.06 113.55 115.51 1pdu h SER 338 Ca 0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.95 1pdu h SER 338 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1pdu h SER 338 CO -0.92 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.04 1pdu s LEU 340 N -2.38 3.59 -0.30 0.00 1.43 -1.16 -4.90 118.68 114.96 1pdu s LEU 340 Ca 0.31 2.37 -0.11 0.00 -1.03 0.00 0.00 54.13 55.67 1pdu s LEU 340 Cb 0.25 -4.60 -0.03 0.00 0.03 0.00 0.00 46.19 41.84 1pdu s LEU 340 CO 0.06 -1.71 0.19 -0.62 0.23 0.00 0.00 176.35 174.50 1pdu s ASP 341 N -1.70 5.83 0.00 2.29 2.15 0.12 -4.95 116.67 120.40 1pdu s ASP 341 Ca 0.77 -0.29 0.18 0.00 0.43 0.00 0.00 52.55 53.63 1pdu s ASP 341 Cb -0.30 -2.08 0.35 0.00 -0.30 0.00 0.00 42.92 40.59 1pdu s ASP 341 CO 0.36 -0.15 1.27 -1.22 -0.17 0.00 0.00 175.17 175.26 1pdu n TYR 342 N 5.04 0.43 0.25 -5.34 4.02 -1.26 -2.03 117.16 118.28 1pdu n TYR 342 Ca -0.14 -0.28 0.15 0.00 -0.01 0.00 0.00 57.90 57.62 1pdu n TYR 342 Cb 0.50 -0.01 0.79 0.00 -0.02 0.00 0.00 39.34 40.61 1pdu n TYR 342 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1pdu h SER 343 N 3.45 0.00 -0.01 7.72 4.64 -1.92 -1.99 113.55 125.43 1pdu h SER 343 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pdu h SER 343 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1pdu h SER 343 CO 0.00 0.00 -0.12 1.41 -0.87 0.00 0.00 176.83 177.25 1pdu n HIS 344 N -2.60 0.00 -0.07 4.77 8.25 -1.26 -4.69 115.22 119.61 1pdu n HIS 344 Ca -0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.34 1pdu n HIS 344 Cb 0.17 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.24 1pdu n HIS 344 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1pdu h TYR 345 N 1.83 0.38 -2.00 4.41 3.20 -1.40 -3.43 116.97 119.95 1pdu h TYR 345 Ca 0.00 -0.03 -0.63 0.00 3.14 0.00 0.00 58.73 61.21 1pdu h TYR 345 Cb 0.45 -0.11 0.03 0.00 1.54 0.00 0.00 36.73 38.64 1pdu h TYR 345 CO 0.00 0.41 0.95 -1.91 -1.64 0.00 0.00 178.16 175.97 1pdu n GLU 346 N -4.77 1.96 -2.20 1.82 2.13 -1.26 -4.61 120.64 113.70 1pdu n GLU 346 Ca -0.03 0.71 -0.43 0.00 0.66 0.00 0.00 57.16 58.08 1pdu n GLU 346 Cb 0.14 -2.50 -0.02 0.00 0.27 0.00 0.00 31.44 29.32 1pdu n GLU 346 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1pdu s GLU 347 N 2.93 3.95 0.18 5.31 2.02 -1.26 -4.98 118.70 126.85 1pdu s GLU 347 Ca 0.89 1.68 0.05 0.00 0.02 0.00 0.00 54.97 57.61 1pdu s GLU 347 Cb -0.76 -3.95 -0.05 0.00 0.10 0.00 0.00 34.13 29.47 1pdu s GLU 347 CO 0.50 -1.09 -0.08 -0.65 0.02 0.00 0.00 175.26 173.95 1pdu s GLN 348 N 4.29 1.18 0.16 1.61 -0.21 -1.26 -5.12 119.66 120.31 1pdu s GLN 348 Ca 0.66 -1.54 -0.31 0.00 0.02 0.00 0.00 55.36 54.20 1pdu s GLN 348 Cb -0.24 -0.72 -0.09 0.00 1.00 0.00 0.00 33.01 32.97 1pdu s GLN 348 CO 0.26 0.05 1.38 0.45 -2.12 0.00 0.00 175.29 175.31 1pdu s SER 349 N -3.23 6.81 -0.26 5.90 0.15 -1.26 -5.01 113.70 116.80 1pdu s SER 349 Ca 0.21 2.41 -0.26 0.00 0.70 0.00 0.00 55.95 59.01 1pdu s SER 349 Cb 0.03 -2.60 0.09 0.00 -1.71 0.00 0.00 66.02 61.83 1pdu s SER 349 CO 0.04 -0.62 0.84 0.00 1.20 0.00 0.00 173.24 174.70 1pdu s MET 350 N 0.49 0.72 1.09 5.44 0.23 -1.26 -5.16 119.30 120.85 1pdu s MET 350 Ca 0.61 0.78 -0.12 0.00 -1.03 0.00 0.00 55.69 55.94 1pdu s MET 350 Cb -0.38 0.35 0.24 0.00 -1.53 0.00 0.00 34.83 33.51 1pdu s MET 350 CO 0.35 -0.10 1.06 -1.13 -2.03 0.00 0.00 175.02 173.17 1pdu n SER 351 N 2.35 -1.01 0.14 -1.18 3.41 -1.26 -4.77 113.62 111.31 1pdu n SER 351 Ca -0.14 0.04 0.03 0.00 -0.26 0.00 0.00 58.87 58.55 1pdu n SER 351 Cb 0.56 -1.34 0.43 0.00 -0.26 0.00 0.00 64.21 63.59 1pdu n SER 351 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1pdu h GLU 352 N -2.42 0.19 -0.35 4.33 9.09 -2.02 -1.23 114.58 122.17 1pdu h GLU 352 Ca -0.55 -0.04 -0.12 0.00 0.05 0.00 0.00 59.36 58.70 1pdu h GLU 352 Cb 1.31 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 28.37 1pdu h GLU 352 CO 0.46 0.32 -0.29 0.00 0.05 0.00 0.00 179.01 179.55 1pdu h ALA 353 N 1.71 0.84 -0.25 1.06 0.00 -1.93 -2.68 119.26 118.00 1pdu h ALA 353 Ca 0.04 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1pdu h ALA 353 Cb 0.32 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1pdu h ALA 353 CO 0.02 0.64 0.07 -0.44 0.00 0.00 0.00 179.25 179.53 1pdu h ASP 354 N 0.63 0.37 -0.24 0.00 3.32 -1.59 -1.21 116.42 117.71 1pdu h ASP 354 Ca 0.08 -0.22 0.05 0.00 0.02 0.00 0.00 57.03 56.95 1pdu h ASP 354 Cb 0.80 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 1pdu h ASP 354 CO 0.07 0.49 0.17 0.11 -1.72 0.00 0.00 179.24 178.36 1pdu h LYS 355 N 0.22 0.10 0.10 3.56 1.57 -1.19 0.15 116.57 121.08 1pdu h LYS 355 Ca 0.08 -0.01 -0.21 0.00 -1.87 0.00 0.00 60.65 58.64 1pdu h LYS 355 Cb 0.27 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 32.57 1pdu h LYS 355 CO -0.00 0.07 -0.87 0.28 -0.57 0.00 0.00 179.45 178.35 1pdu h VAL 356 N 0.10 1.42 -0.16 0.50 2.07 -1.24 -2.61 116.25 116.34 1pdu h VAL 356 Ca 0.11 -2.37 0.05 0.00 0.82 0.00 0.00 66.70 65.30 1pdu h VAL 356 Cb 0.30 2.88 -0.06 0.00 -1.52 0.00 0.00 31.29 32.89 1pdu h VAL 356 CO -0.01 0.69 -0.23 -0.61 0.02 0.00 0.00 177.57 177.43 1pdu h GLN 357 N -0.11 -0.27 -1.00 1.57 5.75 -0.17 -0.57 115.11 120.31 1pdu h GLN 357 Ca -0.14 0.02 0.06 0.00 -0.15 0.00 0.00 58.65 58.44 1pdu h GLN 357 Cb 1.62 0.06 -0.06 0.00 1.07 0.00 0.00 27.48 30.17 1pdu h GLN 357 CO 0.17 -0.18 0.65 0.37 -2.65 0.00 0.00 178.83 177.19 1pdu h GLN 358 N -0.28 1.17 -0.12 1.69 4.15 -0.81 -1.62 115.11 119.29 1pdu h GLN 358 Ca 0.11 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.45 1pdu h GLN 358 Cb 0.44 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 1pdu h GLN 358 CO -0.32 0.77 0.03 0.35 -1.93 0.00 0.00 178.83 177.73 1pdu h PHE 359 N 1.20 0.21 -0.29 3.99 3.57 -0.94 0.04 116.94 124.71 1pdu h PHE 359 Ca 0.42 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.91 1pdu h PHE 359 Cb 0.11 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 1pdu h PHE 359 CO -0.00 0.36 0.15 1.88 -2.23 0.00 0.00 178.31 178.46 1pdu h TYR 360 N -0.00 0.27 -0.24 0.41 0.05 -0.78 0.45 116.97 117.14 1pdu h TYR 360 Ca 0.04 0.01 0.04 0.00 0.05 0.00 0.00 58.73 58.87 1pdu h TYR 360 Cb 0.25 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.88 1pdu h TYR 360 CO 0.01 0.15 0.03 0.37 -1.05 0.00 0.00 178.16 177.66 1pdu h GLN 361 N 0.31 0.11 -0.22 4.88 5.75 -1.20 0.29 115.11 125.03 1pdu h GLN 361 Ca 0.12 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.63 1pdu h GLN 361 Cb 0.04 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1pdu h GLN 361 CO -0.08 0.07 0.09 1.25 -2.65 0.00 0.00 178.83 177.51 1pdu h LEU 362 N 0.11 0.11 0.13 -2.39 5.85 -0.69 -1.43 115.31 117.00 1pdu h LEU 362 Ca 0.11 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1pdu h LEU 362 Cb 0.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1pdu h LEU 362 CO -0.16 0.10 -0.06 0.25 -0.34 0.00 0.00 178.44 178.22 1pdu h LEU 363 N 0.20 -0.15 -0.53 2.25 5.85 -0.46 -2.60 115.31 119.87 1pdu h LEU 363 Ca 0.09 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 1pdu h LEU 363 Cb 0.05 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1pdu h LEU 363 CO -0.09 0.13 0.27 0.71 -0.34 0.00 0.00 178.44 179.12 1pdu h THR 364 N -0.43 1.19 0.00 1.05 1.35 -0.37 -1.37 112.91 114.33 1pdu h THR 364 Ca -0.02 -0.51 -0.08 0.00 -0.55 0.00 0.00 66.41 65.25 1pdu h THR 364 Cb 0.34 0.55 -0.01 0.00 -1.73 0.00 0.00 68.15 67.30 1pdu h THR 364 CO 0.03 0.21 -0.39 0.77 -0.25 0.00 0.00 175.52 175.88 1pdu h SER 365 N 0.71 0.00 -0.00 5.36 4.64 -1.34 -1.32 113.55 121.60 1pdu h SER 365 Ca 0.18 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.31 1pdu h SER 365 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1pdu h SER 365 CO -0.03 0.39 -0.69 0.28 -0.87 0.00 0.00 176.83 175.92 1pdu h SER 366 N 0.00 0.74 0.07 4.97 0.02 -1.16 -2.63 113.55 115.56 1pdu h SER 366 Ca -0.00 -0.45 -0.08 0.00 -0.84 0.00 0.00 61.79 60.41 1pdu h SER 366 Cb 0.82 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1pdu h SER 366 CO 0.05 1.22 -0.25 0.58 -1.14 0.00 0.00 176.83 177.29 1pdu h VAL 367 N 0.45 1.24 -0.85 2.27 2.07 -0.87 0.73 116.25 121.30 1pdu h VAL 367 Ca -0.03 -1.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.33 1pdu h VAL 367 Cb 1.28 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 32.41 1pdu h VAL 367 CO 0.13 0.35 0.44 0.44 0.02 0.00 0.00 177.57 178.95 1pdu h ASP 368 N 0.27 1.09 -0.35 0.57 3.32 -1.02 0.25 116.42 120.54 1pdu h ASP 368 Ca 0.04 -0.12 -0.11 0.00 0.02 0.00 0.00 57.03 56.86 1pdu h ASP 368 Cb 0.58 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1pdu h ASP 368 CO 0.04 0.90 -0.22 0.58 -1.72 0.00 0.00 179.24 178.82 1pdu h VAL 369 N 1.20 1.29 0.00 -1.35 2.07 -0.99 -2.22 116.25 116.25 1pdu h VAL 369 Ca 0.30 -1.36 -0.02 0.00 0.82 0.00 0.00 66.70 66.43 1pdu h VAL 369 Cb 0.07 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1pdu h VAL 369 CO -0.04 0.45 -0.11 0.40 0.02 0.00 0.00 177.57 178.29 1pdu h ILE 370 N 0.54 0.96 -0.50 4.57 2.04 -0.32 -0.46 117.51 124.35 1pdu h ILE 370 Ca 0.07 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 1pdu h ILE 370 Cb 0.78 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1pdu h ILE 370 CO 0.06 0.11 0.13 0.50 0.00 0.00 0.00 178.15 178.95 1pdu h LYS 371 N 0.00 0.74 -0.53 2.37 1.63 0.10 -2.05 116.57 118.83 1pdu h LYS 371 Ca -0.00 -0.14 -0.07 0.00 -0.85 0.00 0.00 60.65 59.59 1pdu h LYS 371 Cb 0.21 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.69 1pdu h LYS 371 CO 0.01 0.67 0.05 1.96 -3.45 0.00 0.00 179.45 178.69 1pdu h GLN 372 N 0.72 0.87 -0.44 1.90 4.20 -0.82 -2.26 115.11 119.28 1pdu h GLN 372 Ca 0.16 -0.22 -0.14 0.00 0.06 0.00 0.00 58.65 58.51 1pdu h GLN 372 Cb 0.25 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1pdu h GLN 372 CO -0.00 0.84 -0.29 0.35 -0.67 0.00 0.00 178.83 179.05 1pdu h PHE 373 N 0.82 1.13 -0.57 2.96 3.04 -1.20 -3.13 116.94 119.98 1pdu h PHE 373 Ca 0.16 -0.30 -0.11 0.00 3.98 0.00 0.00 57.97 61.70 1pdu h PHE 373 Cb 0.42 -0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.66 1pdu h PHE 373 CO 0.02 1.13 -0.07 0.00 -2.02 0.00 0.00 178.31 177.37 1pdu h ALA 374 N 0.84 0.79 0.00 2.41 0.00 -1.22 -2.81 119.26 119.28 1pdu h ALA 374 Ca 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1pdu h ALA 374 Cb 0.87 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1pdu h ALA 374 CO 0.08 0.67 0.00 0.39 0.00 0.00 0.00 179.25 180.39 1pdu n GLU 375 N -4.15 0.06 0.00 0.00 1.02 -0.86 -1.56 120.64 115.14 1pdu n GLU 375 Ca 0.02 0.31 0.12 0.00 -0.02 0.00 0.00 57.16 57.59 1pdu n GLU 375 Cb 0.39 -1.61 0.08 0.00 -0.02 0.00 0.00 31.44 30.27 1pdu n GLU 375 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1pdu n LYS 376 N -1.73 2.08 -2.19 3.49 5.02 -1.06 -4.78 118.16 118.99 1pdu n LYS 376 Ca 0.03 -1.73 -0.43 0.00 -2.02 0.00 0.00 58.31 54.16 1pdu n LYS 376 Cb 0.18 -1.46 -0.02 0.00 -0.02 0.00 0.00 35.03 33.71 1pdu n LYS 376 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1pdu s ILE 377 N -2.07 3.71 0.16 -0.18 1.01 -0.60 -4.85 121.20 118.39 1pdu s ILE 377 Ca 0.26 0.74 -0.34 0.00 0.00 0.00 0.00 60.65 61.31 1pdu s ILE 377 Cb 0.19 -3.93 -0.15 0.00 0.01 0.00 0.00 42.46 38.59 1pdu s ILE 377 CO 0.35 -0.57 1.37 -0.81 0.00 0.00 0.00 174.94 175.28 1pdu n PRO 378 N 8.16 1.61 0.00 2.79 -0.04 -1.26 -0.85 135.00 145.40 1pdu n PRO 378 Ca 0.19 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 64.23 1pdu n PRO 378 Cb 0.47 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1pdu n PRO 378 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pdu n GLY 379 N 2.52 1.81 0.16 0.55 0.00 -1.26 -4.93 105.19 104.04 1pdu n GLY 379 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 1pdu n GLY 379 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1pdu h TYR 380 N 0.00 0.53 0.00 1.61 3.20 -1.31 -2.67 116.97 118.33 1pdu h TYR 380 Ca 0.00 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.77 1pdu h TYR 380 Cb 0.00 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.14 1pdu h TYR 380 CO 0.00 0.67 0.00 1.19 -1.64 0.00 0.00 178.16 178.38 1pdu n PHE 381 N -4.58 0.00 1.14 -3.82 3.72 -1.26 -1.42 117.46 111.25 1pdu n PHE 381 Ca -0.04 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.49 1pdu n PHE 381 Cb 0.28 -0.27 0.34 0.00 -0.94 0.00 0.00 39.48 38.89 1pdu n PHE 381 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1pdu n ASP 382 N -1.27 0.75 -4.87 4.37 8.00 -1.01 -4.83 116.55 117.70 1pdu n ASP 382 Ca 0.09 -0.57 -0.31 0.00 0.71 0.00 0.00 54.79 54.70 1pdu n ASP 382 Cb 0.13 0.16 -0.04 0.00 -0.02 0.00 0.00 41.12 41.36 1pdu n ASP 382 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1pdu s LEU 383 N -2.72 3.88 0.67 0.64 1.43 -0.51 -5.03 118.68 117.04 1pdu s LEU 383 Ca 0.19 1.17 -0.17 0.00 -1.03 0.00 0.00 54.13 54.29 1pdu s LEU 383 Cb 0.19 -4.04 0.00 0.00 0.03 0.00 0.00 46.19 42.37 1pdu s LEU 383 CO 0.59 -0.35 1.26 -0.76 0.23 0.00 0.00 176.35 177.32 1pdu s LEU 384 N -3.64 3.50 0.52 1.79 1.43 -1.26 -4.78 118.68 116.24 1pdu s LEU 384 Ca 0.52 2.51 0.16 0.00 -1.03 0.00 0.00 54.13 56.29 1pdu s LEU 384 Cb -0.10 -4.61 1.27 0.00 0.03 0.00 0.00 46.19 42.78 1pdu s LEU 384 CO 0.28 -2.04 2.15 -0.65 0.23 0.00 0.00 176.35 176.31 1pdu h PRO 385 N 0.32 0.00 -0.44 1.29 0.11 -1.95 -1.07 132.00 130.26 1pdu h PRO 385 Ca -0.50 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.49 1pdu h PRO 385 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 1pdu h PRO 385 CO 0.52 0.01 -0.22 0.93 -0.21 0.00 0.00 178.00 179.03 1pdu h GLU 386 N 0.00 0.93 -0.12 1.05 5.08 -1.99 -1.88 114.58 117.64 1pdu h GLU 386 Ca -0.00 -0.41 -0.19 0.00 -1.00 0.00 0.00 59.36 57.76 1pdu h GLU 386 Cb 0.01 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1pdu h GLU 386 CO 0.00 1.07 -0.71 -0.44 -1.00 0.00 0.00 179.01 177.93 1pdu h ASP 387 N 0.76 0.64 -0.07 1.42 3.32 -1.71 -1.29 116.42 119.50 1pdu h ASP 387 Ca 0.10 -0.41 0.02 0.00 0.02 0.00 0.00 57.03 56.76 1pdu h ASP 387 Cb 0.79 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1pdu h ASP 387 CO 0.07 1.16 -0.06 1.56 -1.72 0.00 0.00 179.24 180.25 1pdu h GLN 388 N 0.38 -0.06 -0.11 3.56 4.20 -1.15 0.24 115.11 122.18 1pdu h GLN 388 Ca -0.03 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 1pdu h GLN 388 Cb 1.29 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.08 1pdu h GLN 388 CO 0.13 -0.04 0.06 1.49 -0.67 0.00 0.00 178.83 179.80 1pdu h GLU 389 N -0.07 0.15 0.02 1.46 4.81 -1.30 0.15 114.58 119.81 1pdu h GLU 389 Ca 0.05 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1pdu h GLU 389 Cb 0.13 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1pdu h GLU 389 CO -0.11 0.15 -0.01 1.25 -0.73 0.00 0.00 179.01 179.56 1pdu h LEU 390 N 0.10 -0.02 -0.59 1.64 5.85 -0.99 -0.19 115.31 121.10 1pdu h LEU 390 Ca 0.04 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.77 1pdu h LEU 390 Cb 0.04 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1pdu h LEU 390 CO -0.01 -0.02 0.38 -0.07 -0.34 0.00 0.00 178.44 178.39 1pdu h LEU 391 N -0.03 0.64 -0.03 2.25 3.38 -0.37 -1.54 115.31 119.61 1pdu h LEU 391 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1pdu h LEU 391 Cb 0.02 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1pdu h LEU 391 CO 0.00 0.46 0.00 0.15 0.09 0.00 0.00 178.44 179.15 1pdu h PHE 392 N 0.77 0.06 -0.87 1.13 3.57 -0.42 -2.46 116.94 118.72 1pdu h PHE 392 Ca 0.23 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.72 1pdu h PHE 392 Cb -0.05 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 1pdu h PHE 392 CO -0.04 0.31 0.57 1.96 -2.23 0.00 0.00 178.31 178.88 1pdu h GLN 393 N -0.20 1.15 0.00 1.11 4.20 -1.00 0.18 115.11 120.55 1pdu h GLN 393 Ca 0.01 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 1pdu h GLN 393 Cb 0.28 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 1pdu h GLN 393 CO 0.00 0.77 -0.05 0.77 -0.67 0.00 0.00 178.83 179.65 1pdu h SER 394 N 1.18 0.00 -0.00 1.46 0.02 -1.13 -3.28 113.55 111.80 1pdu h SER 394 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1pdu h SER 394 Cb -0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.42 1pdu h SER 394 CO -0.07 0.05 -0.04 0.00 -1.14 0.00 0.00 176.83 175.63 1pdu n ALA 395 N -2.13 2.39 -0.18 3.77 0.00 -0.92 -4.77 120.51 118.67 1pdu n ALA 395 Ca 0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 53.44 53.12 1pdu n ALA 395 Cb 0.31 -0.07 0.09 0.00 0.00 0.00 0.00 19.45 19.78 1pdu n ALA 395 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1pdu h SER 396 N 0.24 -0.13 -0.68 0.00 4.64 -1.04 0.36 113.55 116.95 1pdu h SER 396 Ca 0.00 0.12 -0.07 0.00 -0.47 0.00 0.00 61.79 61.37 1pdu h SER 396 Cb 0.07 0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 1pdu h SER 396 CO 0.00 -0.04 0.14 0.25 -0.87 0.00 0.00 176.83 176.31 1pdu h LEU 397 N 0.18 1.05 -0.36 5.97 5.85 -1.86 -0.59 115.31 125.54 1pdu h LEU 397 Ca 0.29 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 1pdu h LEU 397 Cb 0.44 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1pdu h LEU 397 CO -0.43 1.02 0.12 -0.33 -0.34 0.00 0.00 178.44 178.49 1pdu h GLU 398 N 1.03 0.55 -0.81 1.25 5.08 -1.41 0.27 114.58 120.53 1pdu h GLU 398 Ca 0.21 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1pdu h GLU 398 Cb 0.40 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 1pdu h GLU 398 CO 0.01 0.56 0.49 -0.07 -1.00 0.00 0.00 179.01 179.00 1pdu h LEU 399 N 0.43 0.98 -0.07 1.33 3.38 -0.19 0.35 115.31 121.51 1pdu h LEU 399 Ca 0.12 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1pdu h LEU 399 Cb 0.23 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1pdu h LEU 399 CO -0.01 0.75 0.04 0.15 0.09 0.00 0.00 178.44 179.47 1pdu h PHE 400 N 1.12 0.07 -0.47 1.13 3.57 -0.71 -0.64 116.94 121.01 1pdu h PHE 400 Ca 0.29 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.68 1pdu h PHE 400 Cb -0.04 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 1pdu h PHE 400 CO -0.00 0.04 -0.17 0.28 -2.23 0.00 0.00 178.31 176.23 1pdu h VAL 401 N 0.08 1.27 -0.23 1.41 2.07 -0.47 -1.68 116.25 118.71 1pdu h VAL 401 Ca 0.03 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.23 1pdu h VAL 401 Cb -0.00 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1pdu h VAL 401 CO -0.02 0.45 0.10 0.25 0.02 0.00 0.00 177.57 178.37 1pdu h LEU 402 N 0.80 0.31 -0.56 2.57 5.85 -0.09 0.44 115.31 124.64 1pdu h LEU 402 Ca 0.12 -0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 1pdu h LEU 402 Cb 0.72 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1pdu h LEU 402 CO 0.06 0.38 0.03 0.03 -0.34 0.00 0.00 178.44 178.60 1pdu h ARG 403 N 0.22 0.96 -0.00 1.25 3.08 -1.09 -0.86 114.38 117.95 1pdu h ARG 403 Ca 0.08 -0.29 0.01 0.00 0.07 0.00 0.00 59.98 59.84 1pdu h ARG 403 Cb 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1pdu h ARG 403 CO -0.01 0.95 -0.03 1.25 -1.07 0.00 0.00 179.97 181.06 1pdu h LEU 404 N 0.85 -0.09 -0.87 3.04 5.85 -1.12 -2.16 115.31 120.81 1pdu h LEU 404 Ca 0.16 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 1pdu h LEU 404 Cb 0.50 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1pdu h LEU 404 CO 0.02 -0.05 -0.03 0.00 -0.34 0.00 0.00 178.44 178.04 1pdu h ALA 405 N 0.94 1.05 -0.37 1.25 0.00 -0.77 -2.13 119.26 119.23 1pdu h ALA 405 Ca 0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1pdu h ALA 405 Cb 0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1pdu h ALA 405 CO -0.03 0.59 0.13 -0.92 0.00 0.00 0.00 179.25 179.01 1pdu h TYR 406 N 0.75 0.58 -0.04 0.00 3.20 -0.96 -3.19 116.97 117.30 1pdu h TYR 406 Ca 0.14 -0.05 -0.17 0.00 3.14 0.00 0.00 58.73 61.79 1pdu h TYR 406 Cb 0.50 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1pdu h TYR 406 CO 0.03 0.54 -0.72 -0.09 -1.64 0.00 0.00 178.16 176.28 1pdu h ARG 407 N 0.45 0.23 -6.85 1.82 2.43 -1.35 -3.45 114.38 107.66 1pdu h ARG 407 Ca 0.12 -0.19 -0.53 0.00 -0.81 0.00 0.00 59.98 58.57 1pdu h ARG 407 Cb 0.22 0.04 0.08 0.00 -0.42 0.00 0.00 29.97 29.90 1pdu h ARG 407 CO -0.01 0.85 0.79 0.00 -1.51 0.00 0.00 179.97 180.10 1pdu s ALA 408 N -3.53 3.63 0.09 2.80 0.00 -0.81 -4.98 121.76 118.96 1pdu s ALA 408 Ca -0.04 1.48 0.06 0.00 0.00 0.00 0.00 51.96 53.46 1pdu s ALA 408 Cb 0.11 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 1pdu s ALA 408 CO 0.81 -0.91 -0.05 1.03 0.00 0.00 0.00 175.76 176.64 1pdu s ARG 409 N -1.19 2.33 0.46 0.00 3.00 -1.26 -4.93 118.95 117.37 1pdu s ARG 409 Ca 0.57 -0.93 -0.24 0.00 0.00 0.00 0.00 55.73 55.13 1pdu s ARG 409 Cb -0.45 -2.42 -0.08 0.00 0.00 0.00 0.00 34.95 32.00 1pdu s ARG 409 CO 0.53 0.53 1.33 1.51 0.00 0.00 0.00 175.30 179.20 1pdu n ILE 410 N 0.68 2.93 -3.51 1.52 3.06 -1.26 -3.45 119.36 119.33 1pdu n ILE 410 Ca -0.12 -0.50 -0.17 0.00 -2.50 0.00 0.00 62.75 59.46 1pdu n ILE 410 Cb 0.52 -1.67 0.01 0.00 0.54 0.00 0.00 39.64 39.04 1pdu n ILE 410 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 1pdu n ASP 411 N -0.20 -6.00 -4.08 9.51 8.00 -1.26 -4.99 116.55 117.52 1pdu n ASP 411 Ca 0.07 -0.65 -0.16 0.00 0.71 0.00 0.00 54.79 54.76 1pdu n ASP 411 Cb 0.41 -3.26 -0.12 0.00 -0.02 0.00 0.00 41.12 38.13 1pdu n ASP 411 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1pdu s ASP 412 N -3.07 1.15 -0.12 -2.24 -1.08 -1.22 -5.05 116.67 105.04 1pdu s ASP 412 Ca 0.08 -0.48 0.06 0.00 -0.52 0.00 0.00 52.55 51.68 1pdu s ASP 412 Cb -0.03 -0.02 -0.24 0.00 -1.46 0.00 0.00 42.92 41.17 1pdu s ASP 412 CO 0.84 -0.09 0.38 0.35 0.52 0.00 0.00 175.17 177.16 1pdu n THR 413 N 1.73 1.63 -2.20 1.71 -2.24 -1.26 -4.89 114.28 108.75 1pdu n THR 413 Ca -0.20 -0.73 -0.26 0.00 -2.27 0.00 0.00 64.05 60.59 1pdu n THR 413 Cb 0.55 -1.24 0.09 0.00 -2.10 0.00 0.00 70.33 67.63 1pdu n THR 413 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1pdu s LYS 414 N -2.56 1.93 -0.16 -0.78 -2.85 -1.26 0.02 119.74 114.08 1pdu s LYS 414 Ca -0.15 -0.36 -0.06 0.00 -1.00 0.00 0.00 55.97 54.39 1pdu s LYS 414 Cb 0.07 -2.14 0.07 0.00 -2.06 0.00 0.00 37.83 33.78 1pdu s LYS 414 CO 0.78 -1.43 0.35 -1.17 0.10 0.00 0.00 175.35 173.98 1pdu s LEU 415 N -5.33 -0.35 -0.15 2.77 2.96 -0.03 -4.60 118.68 113.96 1pdu s LEU 415 Ca 0.63 0.79 -0.06 0.00 -0.22 0.00 0.00 54.13 55.27 1pdu s LEU 415 Cb -0.09 1.06 -0.04 0.00 0.50 0.00 0.00 46.19 47.62 1pdu s LEU 415 CO 0.46 -0.22 0.05 -0.63 -1.32 0.00 0.00 176.35 174.68 1pdu s ILE 416 N 2.25 4.70 0.02 6.68 1.01 -1.26 -1.83 121.20 132.77 1pdu s ILE 416 Ca -0.02 -0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.57 1pdu s ILE 416 Cb -0.11 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 1pdu s ILE 416 CO -0.11 0.52 0.03 -0.36 0.00 0.00 0.00 174.94 175.02 1pdu s PHE 417 N -0.13 3.12 -1.99 3.97 0.40 0.03 -4.82 117.98 118.57 1pdu s PHE 417 Ca 0.06 0.09 0.00 0.00 -0.60 0.00 0.00 56.93 56.48 1pdu s PHE 417 Cb -0.12 -1.65 0.00 0.00 0.51 0.00 0.00 43.02 41.75 1pdu s PHE 417 CO 0.01 0.49 0.50 0.00 0.70 0.00 0.00 175.22 176.92 1pdu n ASN 419 N -1.00 3.32 0.00 0.00 6.94 -1.26 -4.37 115.26 118.89 1pdu n ASN 419 Ca 0.00 -1.97 0.00 0.00 -0.02 0.00 0.00 54.58 52.59 1pdu n ASN 419 Cb 0.00 -0.34 0.00 0.00 -2.36 0.00 0.00 39.78 37.08 1pdu n ASN 419 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pdu n GLY 420 N 1.49 2.69 3.74 4.83 0.00 0.24 -4.85 105.19 113.34 1pdu n GLY 420 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1pdu n GLY 420 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pdu s THR 421 N -2.12 2.96 -0.05 2.61 2.01 -1.23 0.11 115.64 119.94 1pdu s THR 421 Ca 0.00 0.82 0.06 0.00 0.31 0.00 0.00 61.69 62.88 1pdu s THR 421 Cb 0.00 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 68.98 1pdu s THR 421 CO 0.00 0.13 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.13 1pdu s VAL 422 N -0.08 1.95 0.19 3.82 1.01 -0.86 -0.79 120.40 125.64 1pdu s VAL 422 Ca 0.57 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 1pdu s VAL 422 Cb -0.39 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1pdu s VAL 422 CO 0.42 0.55 0.14 -0.76 0.00 0.00 0.00 175.10 175.44 1pdu s LEU 423 N -0.25 1.19 0.46 3.92 1.43 -0.76 -3.56 118.68 121.11 1pdu s LEU 423 Ca -0.00 -1.34 -0.20 0.00 -1.03 0.00 0.00 54.13 51.56 1pdu s LEU 423 Cb -0.12 0.45 -0.10 0.00 0.03 0.00 0.00 46.19 46.45 1pdu s LEU 423 CO 0.02 -0.84 0.99 -1.00 0.23 0.00 0.00 176.35 175.75 1pdu s HIS 424 N -4.14 3.20 0.47 0.29 3.76 -1.26 -0.85 115.29 116.76 1pdu s HIS 424 Ca 0.36 1.58 0.13 0.00 -0.15 0.00 0.00 55.06 56.98 1pdu s HIS 424 Cb 0.07 -2.92 1.07 0.00 1.11 0.00 0.00 32.58 31.90 1pdu s HIS 424 CO 0.10 -0.41 2.07 0.00 -0.85 0.00 0.00 174.74 175.65 1pdu h ARG 425 N 1.65 0.14 0.00 1.40 3.08 -0.66 -1.65 114.38 118.35 1pdu h ARG 425 Ca -0.49 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.49 1pdu h ARG 425 Cb 1.20 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.21 1pdu h ARG 425 CO 0.60 0.16 -0.25 1.79 -1.07 0.00 0.00 179.97 181.19 1pdu h THR 426 N 0.14 0.75 0.00 2.04 1.35 -1.91 -1.57 112.91 113.72 1pdu h THR 426 Ca 0.04 -1.07 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 1pdu h THR 426 Cb 0.10 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 1pdu h THR 426 CO 0.00 0.25 0.00 1.56 -0.25 0.00 0.00 175.52 177.08 1pdu h GLN 427 N 0.00 0.00 0.01 4.72 4.20 -1.67 -3.24 115.11 119.13 1pdu h GLN 427 Ca -0.00 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.39 1pdu h GLN 427 Cb 0.64 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.37 1pdu h GLN 427 CO 0.03 0.00 -1.94 0.00 -0.67 0.00 0.00 178.83 176.26 1pdu h LEU 429 N 0.01 0.36 -0.66 0.00 5.85 -1.34 0.95 115.31 120.49 1pdu h LEU 429 Ca -0.38 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 1pdu h LEU 429 Cb 2.07 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 43.00 1pdu h LEU 429 CO 0.06 0.22 0.34 0.03 -0.34 0.00 0.00 178.44 178.75 1pdu h ARG 430 N 0.41 0.93 0.04 1.25 -0.00 -1.69 -0.39 114.38 114.92 1pdu h ARG 430 Ca 0.27 -0.12 -0.38 0.00 -0.50 0.00 0.00 59.98 59.25 1pdu h ARG 430 Cb 0.51 -0.18 -0.05 0.00 0.00 0.00 0.00 29.97 30.25 1pdu h ARG 430 CO -0.07 0.72 -2.28 -1.13 0.00 0.00 0.00 179.97 177.20 1pdu n SER 431 N -4.51 1.83 0.05 7.04 3.41 -0.29 -4.42 113.62 116.73 1pdu n SER 431 Ca 0.05 0.01 -0.10 0.00 -0.26 0.00 0.00 58.87 58.57 1pdu n SER 431 Cb 0.11 -0.43 0.03 0.00 -0.26 0.00 0.00 64.21 63.65 1pdu n SER 431 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1pdu h PHE 432 N 0.02 0.54 0.00 7.33 -1.00 0.76 -3.49 116.94 121.10 1pdu h PHE 432 Ca -0.51 -0.24 0.00 0.00 2.81 0.00 0.00 57.97 60.03 1pdu h PHE 432 Cb 1.98 -0.08 0.00 0.00 3.61 0.00 0.00 35.95 41.45 1pdu h PHE 432 CO 0.04 1.00 0.00 0.41 -1.61 0.00 0.00 178.31 178.15 1pdu n GLY 433 N 0.57 -1.56 0.32 -1.45 0.00 -0.16 -3.73 105.19 99.19 1pdu n GLY 433 Ca -0.04 -1.35 0.20 0.00 0.00 0.00 0.00 46.02 44.83 1pdu n GLY 433 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1pdu h GLU 434 N 0.00 0.00 -0.83 1.61 4.39 -1.96 -2.53 114.58 115.26 1pdu h GLU 434 Ca 0.00 0.00 0.20 0.00 0.34 0.00 0.00 59.36 59.90 1pdu h GLU 434 Cb 0.00 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 1pdu h GLU 434 CO 0.00 0.01 0.57 2.35 -1.16 0.00 0.00 179.01 180.78 1pdu h TRP 435 N 0.00 0.35 -0.54 4.33 7.01 -1.95 -1.19 115.95 123.97 1pdu h TRP 435 Ca -0.00 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.02 1pdu h TRP 435 Cb 0.08 -0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.00 1pdu h TRP 435 CO 0.00 0.10 0.35 1.25 -2.79 0.00 0.00 178.44 177.35 1pdu h LEU 436 N 0.27 0.59 -1.23 0.65 5.85 -1.65 -1.11 115.31 118.68 1pdu h LEU 436 Ca 0.42 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 59.21 1pdu h LEU 436 Cb 1.22 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.05 1pdu h LEU 436 CO -0.11 0.42 0.56 0.78 -0.34 0.00 0.00 178.44 179.74 1pdu h ASN 437 N 0.70 0.81 0.18 1.25 2.35 -1.42 0.18 115.58 119.62 1pdu h ASN 437 Ca 0.21 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.86 1pdu h ASN 437 Cb -0.04 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 1pdu h ASN 437 CO -0.06 0.51 -0.38 0.44 -1.65 0.00 0.00 177.43 176.28 1pdu h ASP 438 N 0.91 0.29 -0.25 5.81 3.32 -1.22 -0.51 116.42 124.78 1pdu h ASP 438 Ca 0.38 -0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.26 1pdu h ASP 438 Cb 0.28 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1pdu h ASP 438 CO -0.14 0.65 -0.05 0.40 -1.72 0.00 0.00 179.24 178.38 1pdu h ILE 439 N 0.24 1.28 -0.46 0.35 2.04 0.39 -1.28 117.51 120.06 1pdu h ILE 439 Ca 0.03 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.82 1pdu h ILE 439 Cb 0.79 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 1pdu h ILE 439 CO 0.06 0.33 0.19 0.24 0.00 0.00 0.00 178.15 178.96 1pdu h MET 440 N 0.23 0.66 -0.69 2.37 2.86 -0.53 0.11 114.93 119.94 1pdu h MET 440 Ca 0.06 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 1pdu h MET 440 Cb 0.51 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 1pdu h MET 440 CO 0.02 0.54 0.26 1.49 1.06 0.00 0.00 176.91 180.28 1pdu h GLU 441 N 0.66 1.05 -0.42 1.72 4.81 -0.80 -1.24 114.58 120.36 1pdu h GLU 441 Ca 0.16 -0.20 -0.11 0.00 -0.13 0.00 0.00 59.36 59.08 1pdu h GLU 441 Cb 0.13 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1pdu h GLU 441 CO -0.02 0.88 -0.17 0.35 -0.73 0.00 0.00 179.01 179.33 1pdu h PHE 442 N 1.00 0.90 0.04 0.92 3.57 -0.12 -2.50 116.94 120.74 1pdu h PHE 442 Ca 0.23 -0.19 0.02 0.00 3.53 0.00 0.00 57.97 61.57 1pdu h PHE 442 Cb 0.24 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1pdu h PHE 442 CO 0.02 0.91 -0.20 1.03 -2.23 0.00 0.00 178.31 177.84 1pdu h SER 443 N 0.71 -0.57 -0.66 0.41 0.87 -0.17 -0.84 113.55 113.31 1pdu h SER 443 Ca 0.11 0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.76 1pdu h SER 443 Cb 0.67 0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.83 1pdu h SER 443 CO 0.05 -0.27 0.43 0.03 -0.53 0.00 0.00 176.83 176.54 1pdu h ARG 444 N -0.34 0.82 -0.29 2.24 3.08 -1.16 -1.74 114.38 117.00 1pdu h ARG 444 Ca 0.05 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1pdu h ARG 444 Cb 0.40 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1pdu h ARG 444 CO -0.16 0.54 0.19 1.03 -1.07 0.00 0.00 179.97 180.51 1pdu h SER 445 N 0.85 0.33 -0.25 7.04 0.87 -0.86 -0.87 113.55 120.65 1pdu h SER 445 Ca 0.25 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.83 1pdu h SER 445 Cb -0.04 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 1pdu h SER 445 CO -0.06 0.24 0.06 -0.07 -0.53 0.00 0.00 176.83 176.47 1pdu h LEU 446 N 0.39 0.03 -1.36 2.23 3.38 -0.31 -2.63 115.31 117.03 1pdu h LEU 446 Ca 0.11 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1pdu h LEU 446 Cb -0.04 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1pdu h LEU 446 CO -0.02 0.05 -0.24 0.45 0.09 0.00 0.00 178.44 178.77 1pdu h HIS 447 N 0.16 0.00 -0.40 1.13 3.86 -1.24 -1.88 115.15 116.78 1pdu h HIS 447 Ca 0.12 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.19 1pdu h HIS 447 Cb 0.11 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 1pdu h HIS 447 CO -0.15 0.24 -0.27 -0.91 0.86 0.00 0.00 177.93 177.69 1pdu h ASN 448 N 0.00 0.89 1.26 2.45 2.35 -0.80 -2.39 115.58 119.35 1pdu h ASN 448 Ca -0.00 -0.35 -0.04 0.00 -0.55 0.00 0.00 56.30 55.36 1pdu h ASN 448 Cb 0.63 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 1pdu h ASN 448 CO 0.03 1.10 -0.19 0.25 -1.65 0.00 0.00 177.43 176.97 1pdu h LEU 449 N 0.73 0.00 -1.95 1.61 5.85 -1.24 -3.49 115.31 116.82 1pdu h LEU 449 Ca 0.09 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.81 1pdu h LEU 449 Cb 0.82 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.75 1pdu h LEU 449 CO 0.07 0.19 -1.45 -0.62 -0.34 0.00 0.00 178.44 176.29 1pdu n GLU 450 N -3.25 -4.75 -4.11 1.25 1.02 -0.74 -5.02 120.64 105.05 1pdu n GLU 450 Ca 0.01 3.54 -0.33 0.00 -0.02 0.00 0.00 57.16 60.36 1pdu n GLU 450 Cb 0.49 -4.97 -0.16 0.00 -0.02 0.00 0.00 31.44 26.78 1pdu n GLU 450 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1pdu s ILE 451 N -0.64 2.13 0.84 -3.67 1.01 -1.26 -5.04 121.20 114.56 1pdu s ILE 451 Ca -0.22 -0.92 -0.12 0.00 0.00 0.00 0.00 60.65 59.39 1pdu s ILE 451 Cb 0.01 -1.90 0.10 0.00 0.01 0.00 0.00 42.46 40.68 1pdu s ILE 451 CO 0.59 0.53 1.12 1.51 0.00 0.00 0.00 174.94 178.69 1pdu s ASP 452 N 1.30 4.12 0.35 3.58 1.47 -1.26 -4.77 116.67 121.45 1pdu s ASP 452 Ca 0.05 1.14 0.06 0.00 1.18 0.00 0.00 52.55 54.98 1pdu s ASP 452 Cb -0.13 -1.81 0.72 0.00 -0.34 0.00 0.00 42.92 41.36 1pdu s ASP 452 CO -0.12 -2.19 1.92 -0.29 0.68 0.00 0.00 175.17 175.17 1pdu h ILE 453 N -1.24 0.97 -0.45 2.11 2.10 -2.00 -0.14 117.51 118.85 1pdu h ILE 453 Ca -0.48 -0.27 -0.09 0.00 1.08 0.00 0.00 64.86 65.10 1pdu h ILE 453 Cb 1.30 0.10 -0.02 0.00 -1.09 0.00 0.00 36.82 37.11 1pdu h ILE 453 CO 0.61 0.15 -0.06 0.28 -1.08 0.00 0.00 178.15 178.04 1pdu h SER 454 N 0.80 0.84 -0.22 2.19 0.02 -1.94 -1.10 113.55 114.13 1pdu h SER 454 Ca 0.38 -0.34 -0.15 0.00 -0.84 0.00 0.00 61.79 60.84 1pdu h SER 454 Cb 0.41 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1pdu h SER 454 CO -0.15 0.98 -0.41 0.00 -1.14 0.00 0.00 176.83 176.11 1pdu h ALA 455 N 0.89 0.69 -0.45 3.77 0.00 -1.76 -2.90 119.26 119.50 1pdu h ALA 455 Ca 0.12 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1pdu h ALA 455 Cb 0.58 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1pdu h ALA 455 CO 0.03 0.67 0.10 0.35 0.00 0.00 0.00 179.25 180.40 1pdu h PHE 456 N 0.62 0.76 -0.85 0.00 3.57 -0.87 -0.65 116.94 119.52 1pdu h PHE 456 Ca 0.05 -0.09 0.08 0.00 3.53 0.00 0.00 57.97 61.53 1pdu h PHE 456 Cb 0.96 -0.21 -0.07 0.00 2.79 0.00 0.00 35.95 39.43 1pdu h PHE 456 CO 0.05 0.70 0.51 0.00 -2.23 0.00 0.00 178.31 177.35 1pdu h ALA 457 N 0.96 1.19 -0.55 2.41 0.00 -1.17 0.11 119.26 122.22 1pdu h ALA 457 Ca 0.14 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1pdu h ALA 457 Cb 0.33 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1pdu h ALA 457 CO 0.00 0.20 -0.04 0.00 0.00 0.00 0.00 179.25 179.42 1pdu h LEU 459 N 0.88 0.97 -0.03 0.00 3.38 0.47 0.10 115.31 121.09 1pdu h LEU 459 Ca 0.15 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1pdu h LEU 459 Cb 0.59 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1pdu h LEU 459 CO 0.04 0.69 -0.01 0.00 0.09 0.00 0.00 178.44 179.24 1pdu h ALA 461 N 0.62 1.91 0.00 0.00 0.00 -0.84 0.35 119.26 121.30 1pdu h ALA 461 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pdu h ALA 461 Cb 0.42 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1pdu h ALA 461 CO 0.00 0.08 0.00 -0.07 0.00 0.00 0.00 179.25 179.26 1pdu h LEU 462 N 0.15 0.00 -0.23 0.00 3.38 -0.62 0.23 115.31 118.23 1pdu h LEU 462 Ca 0.04 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.81 1pdu h LEU 462 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1pdu h LEU 462 CO -0.01 0.00 -0.92 0.74 0.09 0.00 0.00 178.44 178.35 1pdu h THR 463 N 0.00 1.50 0.00 0.22 2.02 -0.12 -3.35 112.91 113.18 1pdu h THR 463 Ca 0.00 -2.68 -0.08 0.00 0.77 0.00 0.00 66.41 64.42 1pdu h THR 463 Cb 0.83 2.52 -0.01 0.00 -1.74 0.00 0.00 68.15 69.75 1pdu h THR 463 CO 0.00 0.78 -0.46 0.25 0.37 0.00 0.00 175.52 176.46 1pdu h LEU 464 N 0.11 0.00 -7.97 2.58 5.85 -1.21 -3.42 115.31 111.26 1pdu h LEU 464 Ca -0.05 -0.72 -0.69 0.00 0.84 0.00 0.00 57.88 57.26 1pdu h LEU 464 Cb 1.56 0.00 -0.17 0.00 0.37 0.00 0.00 40.66 42.42 1pdu h LEU 464 CO 0.14 1.13 0.91 -0.63 -0.34 0.00 0.00 178.44 179.64 1pdu s ILE 465 N -2.23 4.70 0.16 4.05 -1.09 0.79 -4.80 121.20 122.78 1pdu s ILE 465 Ca -0.21 -1.59 -0.12 0.00 -2.23 0.00 0.00 60.65 56.49 1pdu s ILE 465 Cb 0.00 -4.80 0.01 0.00 -1.58 0.00 0.00 42.46 36.09 1pdu s ILE 465 CO 0.59 -1.54 0.36 0.28 -1.23 0.00 0.00 174.94 173.40 1pdu s THR 466 N 2.76 0.06 0.26 2.92 -1.32 -1.26 -4.63 115.64 114.43 1pdu s THR 466 Ca 0.34 -1.07 -0.30 0.00 -1.21 0.00 0.00 61.69 59.44 1pdu s THR 466 Cb -0.04 -1.61 -0.11 0.00 -1.51 0.00 0.00 72.50 69.23 1pdu s THR 466 CO -0.09 -0.30 1.59 -1.83 -2.21 0.00 0.00 174.62 171.79 1pdu s GLU 467 N -3.90 4.15 0.01 7.08 1.03 -1.26 -4.99 118.70 120.82 1pdu s GLU 467 Ca 0.11 2.52 -0.03 0.00 0.03 0.00 0.00 54.97 57.60 1pdu s GLU 467 Cb 0.02 -3.06 -0.01 0.00 -0.80 0.00 0.00 34.13 30.28 1pdu s GLU 467 CO -0.04 -0.62 0.03 1.03 -1.33 0.00 0.00 175.26 174.34 1pdu s ARG 468 N -0.01 0.36 0.17 -4.83 1.81 -1.26 -5.14 118.95 110.05 1pdu s ARG 468 Ca 0.65 -0.51 -0.30 0.00 -1.72 0.00 0.00 55.73 53.86 1pdu s ARG 468 Cb -0.47 0.14 -0.07 0.00 -0.45 0.00 0.00 34.95 34.10 1pdu s ARG 468 CO 0.43 -0.07 1.02 -1.01 -0.68 0.00 0.00 175.30 174.99 1pdu s HIS 469 N -1.37 3.74 0.00 -0.53 3.76 -1.26 -3.66 115.29 115.97 1pdu s HIS 469 Ca -0.15 1.73 0.00 0.00 -0.15 0.00 0.00 55.06 56.49 1pdu s HIS 469 Cb -0.09 -3.15 0.00 0.00 1.11 0.00 0.00 32.58 30.46 1pdu s HIS 469 CO -0.00 -0.13 0.00 0.41 -0.85 0.00 0.00 174.74 174.17 1pdu n GLY 470 N 1.99 0.76 3.76 -2.22 0.00 -1.26 -5.07 105.19 103.15 1pdu n GLY 470 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1pdu n GLY 470 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pdu s LEU 471 N 0.00 4.51 0.10 0.99 1.43 -1.24 -4.95 118.68 119.52 1pdu s LEU 471 Ca 0.00 2.37 -0.13 0.00 -1.03 0.00 0.00 54.13 55.35 1pdu s LEU 471 Cb 0.00 -3.63 -0.17 0.00 0.03 0.00 0.00 46.19 42.42 1pdu s LEU 471 CO 0.00 -0.26 1.28 -0.09 0.23 0.00 0.00 176.35 177.51 1pdu h ARG 472 N 3.83 0.77 -2.15 1.70 9.65 -1.95 -3.37 114.38 122.86 1pdu h ARG 472 Ca -0.47 -0.67 -0.59 0.00 -1.10 0.00 0.00 59.98 57.15 1pdu h ARG 472 Cb 1.22 0.15 -0.41 0.00 -1.39 0.00 0.00 29.97 29.54 1pdu h ARG 472 CO 0.67 1.27 -0.73 0.39 2.80 0.00 0.00 179.97 184.37 1pdu n GLU 473 N -3.91 2.13 -0.31 0.20 1.02 -1.26 -4.94 120.64 113.57 1pdu n GLU 473 Ca -0.08 -4.32 0.08 0.00 -0.02 0.00 0.00 57.16 52.82 1pdu n GLU 473 Cb 0.78 -2.00 0.23 0.00 -0.02 0.00 0.00 31.44 30.44 1pdu n GLU 473 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1pdu h PRO 474 N 3.98 0.67 -0.73 3.49 0.13 -1.97 -0.82 132.00 136.76 1pdu h PRO 474 Ca 0.16 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.24 1pdu h PRO 474 Cb 0.71 -0.15 -0.04 0.00 0.13 0.00 0.00 31.00 31.65 1pdu h PRO 474 CO 0.74 0.44 0.42 0.87 -0.23 0.00 0.00 178.00 180.24 1pdu h LYS 475 N 0.69 0.99 -0.14 0.86 6.56 -1.96 0.45 116.57 124.02 1pdu h LYS 475 Ca 0.48 -0.09 -0.12 0.00 -1.06 0.00 0.00 60.65 59.86 1pdu h LYS 475 Cb 0.65 -0.21 -0.01 0.00 -0.57 0.00 0.00 32.23 32.09 1pdu h LYS 475 CO -0.35 0.71 -0.42 -0.22 -2.06 0.00 0.00 179.45 177.11 1pdu h LYS 476 N 1.01 0.32 -0.19 3.15 3.64 -1.59 -1.92 116.57 120.99 1pdu h LYS 476 Ca 0.26 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.41 1pdu h LYS 476 Cb -0.01 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1pdu h LYS 476 CO -0.05 0.69 -0.16 0.28 -2.27 0.00 0.00 179.45 177.94 1pdu h VAL 477 N 0.26 1.33 -0.17 2.00 2.07 -0.71 -2.95 116.25 118.07 1pdu h VAL 477 Ca 0.02 -1.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.21 1pdu h VAL 477 Cb 0.86 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1pdu h VAL 477 CO 0.07 0.39 -0.03 -0.08 0.02 0.00 0.00 177.57 177.94 1pdu h GLU 478 N 0.11 0.25 -0.42 1.57 4.81 -0.75 -0.74 114.58 119.42 1pdu h GLU 478 Ca 0.03 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 1pdu h GLU 478 Cb 0.69 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1pdu h GLU 478 CO 0.04 0.31 -0.17 1.96 -0.73 0.00 0.00 179.01 180.42 1pdu h GLN 479 N 0.25 0.86 -0.57 1.92 4.20 -1.30 0.85 115.11 121.33 1pdu h GLN 479 Ca 0.06 -0.36 -0.08 0.00 0.06 0.00 0.00 58.65 58.32 1pdu h GLN 479 Cb 0.22 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1pdu h GLN 479 CO 0.01 1.00 0.03 1.25 -0.67 0.00 0.00 178.83 180.45 1pdu h LEU 480 N 0.68 0.95 -0.46 1.46 5.85 -1.29 -1.09 115.31 121.41 1pdu h LEU 480 Ca 0.10 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.55 1pdu h LEU 480 Cb 0.73 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1pdu h LEU 480 CO 0.06 1.01 0.25 -0.61 -0.34 0.00 0.00 178.44 178.80 1pdu h GLN 481 N 0.86 0.49 -0.66 1.25 4.15 -0.84 -0.57 115.11 119.80 1pdu h GLN 481 Ca 0.16 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 1pdu h GLN 481 Cb 0.50 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.05 1pdu h GLN 481 CO 0.02 0.32 0.36 0.52 -1.93 0.00 0.00 178.83 178.13 1pdu h MET 482 N 0.50 0.90 -0.54 1.69 2.86 -0.45 0.14 114.93 120.04 1pdu h MET 482 Ca 0.19 -0.09 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 1pdu h MET 482 Cb 0.05 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 1pdu h MET 482 CO -0.11 0.66 0.08 0.87 1.06 0.00 0.00 176.91 179.48 1pdu h LYS 483 N 0.91 0.89 -0.56 1.72 1.57 -0.27 0.20 116.57 121.02 1pdu h LYS 483 Ca 0.23 -0.24 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 1pdu h LYS 483 Cb 0.02 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 1pdu h LYS 483 CO -0.04 0.87 -0.05 0.82 -0.57 0.00 0.00 179.45 180.48 1pdu h ILE 484 N 0.78 1.27 -0.45 1.86 2.04 -0.44 -1.49 117.51 121.07 1pdu h ILE 484 Ca 0.16 -1.20 -0.02 0.00 1.00 0.00 0.00 64.86 64.80 1pdu h ILE 484 Cb 0.41 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 1pdu h ILE 484 CO 0.01 0.43 0.21 0.40 0.00 0.00 0.00 178.15 179.20 1pdu h ILE 485 N 0.92 1.19 -0.22 -0.67 2.04 -0.45 -1.33 117.51 118.98 1pdu h ILE 485 Ca 0.15 -0.55 0.05 0.00 1.00 0.00 0.00 64.86 65.51 1pdu h ILE 485 Cb 0.62 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 1pdu h ILE 485 CO 0.04 0.21 -0.08 1.23 0.00 0.00 0.00 178.15 179.55 1pdu h GLY 486 N 0.58 0.12 1.20 5.37 0.00 -0.29 0.34 103.07 110.40 1pdu h GLY 486 Ca 0.15 0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.58 1pdu h GLY 486 CO -0.02 -0.11 0.46 1.76 0.00 0.00 0.00 176.54 178.63 1pdu h SER 487 N -0.04 0.93 -0.51 0.19 0.02 -1.04 0.22 113.55 113.33 1pdu h SER 487 Ca 0.11 -0.06 -0.11 0.00 -0.84 0.00 0.00 61.79 60.90 1pdu h SER 487 Cb 0.21 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1pdu h SER 487 CO -0.25 0.73 -0.11 0.25 -1.14 0.00 0.00 176.83 176.31 1pdu h LEU 488 N 1.07 0.97 0.31 5.07 5.85 -0.36 -1.98 115.31 126.24 1pdu h LEU 488 Ca 0.28 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1pdu h LEU 488 Cb -0.03 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.74 1pdu h LEU 488 CO -0.05 1.10 -0.19 -0.09 -0.34 0.00 0.00 178.44 178.87 1pdu h ARG 489 N 0.83 -0.46 -0.36 1.25 9.65 0.50 -1.13 114.38 124.65 1pdu h ARG 489 Ca 0.13 0.03 0.06 0.00 -1.10 0.00 0.00 59.98 59.10 1pdu h ARG 489 Cb 0.67 0.10 -0.05 0.00 -1.39 0.00 0.00 29.97 29.30 1pdu h ARG 489 CO 0.05 -0.31 0.03 -0.44 2.80 0.00 0.00 179.97 182.10 1pdu h ASP 490 N -0.48 -0.09 -0.65 -3.80 3.32 -0.93 -1.32 116.42 112.48 1pdu h ASP 490 Ca -0.03 0.08 0.04 0.00 0.02 0.00 0.00 57.03 57.13 1pdu h ASP 490 Cb 0.39 0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.02 1pdu h ASP 490 CO 0.04 -0.01 0.40 -0.74 -1.72 0.00 0.00 179.24 177.21 1pdu h HIS 491 N 0.13 0.74 -0.50 4.55 2.76 -1.20 -2.85 115.15 118.79 1pdu h HIS 491 Ca 0.18 0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.26 1pdu h HIS 491 Cb 0.23 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 28.94 1pdu h HIS 491 CO -0.23 0.41 -0.11 0.28 -1.30 0.00 0.00 177.93 176.98 1pdu h VAL 492 N 0.77 1.27 -0.85 5.26 2.07 -0.74 -2.37 116.25 121.67 1pdu h VAL 492 Ca 0.27 -1.24 0.07 0.00 0.82 0.00 0.00 66.70 66.62 1pdu h VAL 492 Cb 0.06 1.05 -0.06 0.00 -1.52 0.00 0.00 31.29 30.81 1pdu h VAL 492 CO -0.12 0.43 0.52 0.74 0.02 0.00 0.00 177.57 179.16 1pdu h THR 493 N 0.81 1.01 -0.02 2.57 2.02 -1.03 -2.77 112.91 115.49 1pdu h THR 493 Ca 0.13 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.99 1pdu h THR 493 Cb 0.66 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1pdu h THR 493 CO 0.05 0.17 -0.06 -1.22 0.37 0.00 0.00 175.52 174.83 1pdu n TYR 494 N -4.65 0.00 -2.81 3.16 4.02 -1.11 -4.83 117.16 110.94 1pdu n TYR 494 Ca 0.13 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.59 1pdu n TYR 494 Cb 0.20 -0.01 -0.04 0.00 -0.02 0.00 0.00 39.34 39.47 1pdu n TYR 494 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1pdu s ASN 495 N -2.07 6.31 0.13 7.72 3.84 -0.90 -4.96 114.94 125.02 1pdu s ASN 495 Ca 0.30 -0.42 -0.32 0.00 0.21 0.00 0.00 52.86 52.62 1pdu s ASN 495 Cb 0.20 -2.44 -0.10 0.00 -0.55 0.00 0.00 41.25 38.35 1pdu s ASN 495 CO 0.35 -1.30 1.54 0.00 -2.79 0.00 0.00 177.10 174.90 1pdu h ALA 496 N 9.39 -0.75 -0.95 1.71 0.00 -1.88 -1.39 119.26 125.38 1pdu h ALA 496 Ca -0.27 0.01 0.26 0.00 0.00 0.00 0.00 54.91 54.92 1pdu h ALA 496 Cb 1.07 1.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.97 1pdu h ALA 496 CO 1.11 -1.04 0.66 1.05 0.00 0.00 0.00 179.25 181.04 1pdu h GLU 497 N -0.34 0.14 -0.13 0.00 -0.00 -1.96 -2.00 114.58 110.28 1pdu h GLU 497 Ca 0.08 -0.01 -0.10 0.00 -0.00 0.00 0.00 59.36 59.34 1pdu h GLU 497 Cb 0.57 -0.03 0.00 0.00 -0.00 0.00 0.00 28.75 29.29 1pdu h GLU 497 CO -0.64 0.09 -0.29 0.00 -0.00 0.00 0.00 179.01 178.17 1pdu h ALA 498 N 1.56 0.22 0.00 1.06 0.00 -1.57 -3.09 119.26 117.43 1pdu h ALA 498 Ca 0.48 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1pdu h ALA 498 Cb 1.64 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1pdu h ALA 498 CO -0.08 0.24 0.00 1.04 0.00 0.00 0.00 179.25 180.44 1pdu n GLN 499 N -4.40 0.08 -0.00 0.00 1.13 -0.76 -1.82 117.38 111.61 1pdu n GLN 499 Ca -0.07 0.21 0.14 0.00 -1.94 0.00 0.00 57.00 55.34 1pdu n GLN 499 Cb 0.47 -1.50 0.79 0.00 0.11 0.00 0.00 30.24 30.11 1pdu n GLN 499 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1pdu n LYS 500 N -1.25 1.08 -4.26 -1.09 5.02 -1.17 -4.86 118.16 111.63 1pdu n LYS 500 Ca 0.03 -0.12 -0.20 0.00 -2.02 0.00 0.00 58.31 56.00 1pdu n LYS 500 Cb 0.04 -1.44 -0.12 0.00 -0.02 0.00 0.00 35.03 33.50 1pdu n LYS 500 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1pdu s LYS 501 N -1.99 1.07 -0.15 1.97 1.02 -0.76 -5.09 119.74 115.82 1pdu s LYS 501 Ca 0.41 -1.21 -0.34 0.00 0.02 0.00 0.00 55.97 54.85 1pdu s LYS 501 Cb 0.19 -1.11 -0.11 0.00 -0.52 0.00 0.00 37.83 36.28 1pdu s LYS 501 CO 0.32 0.23 1.97 0.00 -0.92 0.00 0.00 175.35 176.96 1pdu n GLN 502 N 0.73 1.98 -3.04 1.68 10.64 -1.26 -3.27 117.38 124.84 1pdu n GLN 502 Ca -0.17 0.69 -0.03 0.00 -1.83 0.00 0.00 57.00 55.66 1pdu n GLN 502 Cb 0.56 -2.69 0.00 0.00 -0.86 0.00 0.00 30.24 27.25 1pdu n GLN 502 CO 0.00 0.00 0.00 1.58 -1.83 0.00 0.00 177.06 176.81 1pdu n HIS 503 N 7.77 -0.15 -0.21 2.61 -0.00 -1.26 -4.76 115.22 119.22 1pdu n HIS 503 Ca 0.26 0.04 0.02 0.00 -0.00 0.00 0.00 57.72 58.05 1pdu n HIS 503 Cb 0.30 -0.22 0.12 0.00 -0.00 0.00 0.00 29.99 30.19 1pdu n HIS 503 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.34 175.42 1pdu h TYR 504 N 1.55 0.08 -0.34 1.57 5.03 -1.81 -2.15 116.97 120.90 1pdu h TYR 504 Ca -0.06 0.04 0.07 0.00 2.58 0.00 0.00 58.73 61.37 1pdu h TYR 504 Cb 0.12 0.06 -0.08 0.00 1.55 0.00 0.00 36.73 38.37 1pdu h TYR 504 CO 0.02 -0.12 -0.30 0.35 -1.32 0.00 0.00 178.16 176.79 1pdu h PHE 505 N 0.18 -0.82 -0.96 -3.82 3.57 -1.92 0.10 116.94 113.28 1pdu h PHE 505 Ca 0.34 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.92 1pdu h PHE 505 Cb 0.55 0.41 -0.05 0.00 2.79 0.00 0.00 35.95 39.65 1pdu h PHE 505 CO -0.32 -0.37 0.63 1.03 -2.23 0.00 0.00 178.31 177.06 1pdu h SER 506 N -0.26 1.05 0.36 0.41 0.87 -1.75 -0.79 113.55 113.44 1pdu h SER 506 Ca 0.16 -0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.63 1pdu h SER 506 Cb 0.52 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 1pdu h SER 506 CO -0.49 0.73 -0.36 0.03 -0.53 0.00 0.00 176.83 176.21 1pdu h ARG 507 N 1.22 0.01 0.62 2.24 3.08 -0.86 -1.44 114.38 119.25 1pdu h ARG 507 Ca 0.37 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.39 1pdu h ARG 507 Cb -0.02 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.03 1pdu h ARG 507 CO -0.11 0.37 -0.30 1.25 -1.07 0.00 0.00 179.97 180.11 1pdu h LEU 508 N 0.01 -0.71 -2.13 3.04 5.85 0.60 -3.10 115.31 118.87 1pdu h LEU 508 Ca -0.00 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1pdu h LEU 508 Cb 0.65 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.85 1pdu h LEU 508 CO 0.05 -0.37 0.08 -0.07 -0.34 0.00 0.00 178.44 177.79 1pdu h LEU 509 N -1.11 0.00 0.00 2.25 3.38 -1.38 -0.82 115.31 117.63 1pdu h LEU 509 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1pdu h LEU 509 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1pdu h LEU 509 CO 0.14 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.28 1pdu n GLY 510 N -1.49 -0.63 0.17 0.83 0.00 -0.55 -1.62 105.19 101.90 1pdu n GLY 510 Ca -0.01 -0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.06 1pdu n GLY 510 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pdu h LYS 511 N 0.00 0.00 -0.52 1.61 1.79 -1.17 -3.35 116.57 114.94 1pdu h LYS 511 Ca 0.00 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.39 1pdu h LYS 511 Cb 0.10 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 1pdu h LYS 511 CO 0.00 0.15 0.02 -0.07 -1.08 0.00 0.00 179.45 178.47 1pdu h LEU 512 N 0.00 0.87 -1.08 2.94 3.38 -1.48 -1.79 115.31 118.15 1pdu h LEU 512 Ca -0.02 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 1pdu h LEU 512 Cb 1.14 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1pdu h LEU 512 CO 0.02 0.95 0.24 -0.65 0.09 0.00 0.00 178.44 179.09 1pdu h PRO 513 N 0.76 0.90 -0.22 1.13 0.11 -1.74 -0.13 132.00 132.80 1pdu h PRO 513 Ca 0.15 -0.14 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 1pdu h PRO 513 Cb 0.49 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 1pdu h PRO 513 CO 0.02 0.74 0.09 0.93 -0.21 0.00 0.00 178.00 179.57 1pdu h GLU 514 N 0.88 0.32 -0.85 1.05 5.08 -1.66 -1.32 114.58 118.08 1pdu h GLU 514 Ca 0.21 -0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.58 1pdu h GLU 514 Cb 0.18 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 1pdu h GLU 514 CO -0.02 0.36 0.52 1.25 -1.00 0.00 0.00 179.01 180.12 1pdu h LEU 515 N 0.21 0.80 -0.18 1.33 5.85 -0.83 0.41 115.31 122.89 1pdu h LEU 515 Ca 0.07 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.83 1pdu h LEU 515 Cb 0.15 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1pdu h LEU 515 CO -0.01 0.50 0.09 -0.09 -0.34 0.00 0.00 178.44 178.59 1pdu h ARG 516 N 0.93 0.19 -0.53 1.25 9.65 -0.46 0.21 114.38 125.61 1pdu h ARG 516 Ca 0.38 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 59.19 1pdu h ARG 516 Cb 0.22 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 1pdu h ARG 516 CO -0.19 0.12 0.09 0.77 2.80 0.00 0.00 179.97 183.57 1pdu h SER 517 N 0.19 0.84 -0.84 -3.80 0.02 -0.43 -1.18 113.55 108.34 1pdu h SER 517 Ca 0.07 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 60.79 1pdu h SER 517 Cb 0.02 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.29 1pdu h SER 517 CO -0.05 0.88 0.54 0.25 -1.14 0.00 0.00 176.83 177.31 1pdu h LEU 518 N 0.76 0.92 -0.59 5.07 5.85 0.14 -2.53 115.31 124.93 1pdu h LEU 518 Ca 0.16 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1pdu h LEU 518 Cb 0.39 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1pdu h LEU 518 CO 0.01 0.64 0.19 -1.28 -0.34 0.00 0.00 178.44 177.66 1pdu h SER 519 N 1.08 0.84 -0.93 1.25 0.87 -0.16 -2.79 113.55 113.71 1pdu h SER 519 Ca 0.33 -0.20 0.07 0.00 -1.23 0.00 0.00 61.79 60.76 1pdu h SER 519 Cb -0.03 -0.22 -0.06 0.00 -0.44 0.00 0.00 62.40 61.64 1pdu h SER 519 CO -0.10 0.82 0.60 0.58 -0.53 0.00 0.00 176.83 178.20 1pdu h VAL 520 N 0.82 1.05 0.00 2.23 2.07 -0.81 0.20 116.25 121.82 1pdu h VAL 520 Ca 0.19 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 1pdu h VAL 520 Cb 0.27 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 1pdu h VAL 520 CO -0.01 0.19 -0.21 -0.61 0.02 0.00 0.00 177.57 176.96 1pdu h GLN 521 N 1.04 0.00 -0.24 1.57 4.15 -1.22 -2.28 115.11 118.13 1pdu h GLN 521 Ca 0.41 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.66 1pdu h GLN 521 Cb 0.23 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.92 1pdu h GLN 521 CO -0.16 0.21 -0.51 0.78 -1.93 0.00 0.00 178.83 177.22 1pdu h GLY 522 N 0.81 0.85 0.87 2.39 0.00 -0.42 -2.86 103.07 104.70 1pdu h GLY 522 Ca -0.00 -1.02 0.05 0.00 0.00 0.00 0.00 47.33 46.36 1pdu h GLY 522 CO 0.03 0.91 0.62 1.41 0.00 0.00 0.00 176.54 179.51 1pdu h LEU 523 N 0.52 1.01 -0.38 3.11 3.38 -0.81 0.18 115.31 122.32 1pdu h LEU 523 Ca 0.01 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1pdu h LEU 523 Cb 1.12 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1pdu h LEU 523 CO 0.11 0.67 0.24 1.56 0.09 0.00 0.00 178.44 181.11 1pdu h GLN 524 N 1.16 0.47 -0.37 1.13 4.20 -1.39 0.65 115.11 120.97 1pdu h GLN 524 Ca 0.40 -0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.93 1pdu h GLN 524 Cb 0.09 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1pdu h GLN 524 CO -0.14 0.31 -0.35 -0.09 -0.67 0.00 0.00 178.83 177.90 1pdu h ARG 525 N 0.49 0.85 -0.16 1.46 1.12 -1.09 -0.74 114.38 116.32 1pdu h ARG 525 Ca 0.15 -0.42 -0.13 0.00 -1.11 0.00 0.00 59.98 58.47 1pdu h ARG 525 Cb -0.03 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 29.92 1pdu h ARG 525 CO -0.05 1.06 -0.45 0.82 -3.11 0.00 0.00 179.97 178.25 1pdu h ILE 526 N 0.71 1.32 -0.38 1.20 2.04 -0.30 -1.96 117.51 120.13 1pdu h ILE 526 Ca 0.07 -1.63 -0.11 0.00 1.00 0.00 0.00 64.86 64.19 1pdu h ILE 526 Cb 0.91 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.67 1pdu h ILE 526 CO 0.08 0.50 -0.20 0.15 0.00 0.00 0.00 178.15 178.68 1pdu h PHE 527 N 0.31 0.82 -0.15 1.37 3.57 0.60 -0.89 116.94 122.59 1pdu h PHE 527 Ca 0.02 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.35 1pdu h PHE 527 Cb 0.91 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 1pdu h PHE 527 CO 0.03 0.87 0.09 -0.92 -2.23 0.00 0.00 178.31 176.15 1pdu h TYR 528 N 0.65 0.19 -0.86 0.41 5.03 -0.77 -1.91 116.97 119.71 1pdu h TYR 528 Ca 0.10 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.42 1pdu h TYR 528 Cb 0.69 -0.06 -0.04 0.00 1.55 0.00 0.00 36.73 38.86 1pdu h TYR 528 CO 0.03 0.14 0.57 -0.07 -1.32 0.00 0.00 178.16 177.51 1pdu h LEU 529 N 0.18 0.97 -0.67 2.82 3.38 -1.02 -1.50 115.31 119.47 1pdu h LEU 529 Ca 0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1pdu h LEU 529 Cb 0.01 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1pdu h LEU 529 CO -0.01 0.70 0.33 0.50 0.09 0.00 0.00 178.44 180.04 1pdu h LYS 530 N 1.15 0.96 -0.42 1.13 3.64 -0.75 -2.04 116.57 120.24 1pdu h LYS 530 Ca 0.32 -0.14 -0.14 0.00 -1.27 0.00 0.00 60.65 59.42 1pdu h LYS 530 Cb -0.11 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.53 1pdu h LYS 530 CO -0.07 0.76 -0.28 -0.07 -2.27 0.00 0.00 179.45 177.52 1pdu h LEU 531 N 0.93 0.93 -1.08 5.20 3.38 -0.90 -2.34 115.31 121.43 1pdu h LEU 531 Ca 0.23 -0.37 0.13 0.00 0.09 0.00 0.00 57.88 57.96 1pdu h LEU 531 Cb 0.11 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.52 1pdu h LEU 531 CO -0.03 1.14 0.62 -0.08 0.09 0.00 0.00 178.44 180.18 1pdu h GLU 532 N 0.76 0.88 -6.27 1.13 4.81 -0.98 -3.46 114.58 111.46 1pdu h GLU 532 Ca 0.09 -0.05 -0.45 0.00 -0.13 0.00 0.00 59.36 58.81 1pdu h GLU 532 Cb 0.84 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 30.03 1pdu h GLU 532 CO 0.07 0.59 -0.86 -3.47 -0.73 0.00 0.00 179.01 174.61 1pdu n ASP 533 N -4.61 -1.09 0.13 1.04 2.03 -0.79 -4.90 116.55 108.36 1pdu n ASP 533 Ca 0.19 -0.92 0.02 0.00 0.52 0.00 0.00 54.79 54.60 1pdu n ASP 533 Cb 0.39 -3.58 0.03 0.00 -0.72 0.00 0.00 41.12 37.25 1pdu n ASP 533 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1pdu h LEU 534 N -1.85 0.00 -7.58 -2.67 3.38 -1.87 -3.45 115.31 101.27 1pdu h LEU 534 Ca -0.62 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.23 1pdu h LEU 534 Cb 1.37 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.92 1pdu h LEU 534 CO 0.58 0.55 -0.31 0.68 0.09 0.00 0.00 178.44 180.04 1pdu s VAL 535 N -2.98 0.07 0.58 1.22 -7.23 -1.26 -4.98 120.40 105.82 1pdu s VAL 535 Ca 0.03 -0.59 -0.19 0.00 -1.81 0.00 0.00 61.98 59.42 1pdu s VAL 535 Cb 0.08 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.29 1pdu s VAL 535 CO 0.75 -0.32 1.19 -2.16 -0.31 0.00 0.00 175.10 174.25 1pdu s PRO 536 N -1.71 3.08 -0.03 4.82 0.04 -1.26 -4.99 135.00 134.96 1pdu s PRO 536 Ca -0.11 1.78 -0.22 0.00 0.04 0.00 0.00 61.00 62.49 1pdu s PRO 536 Cb -0.04 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 1pdu s PRO 536 CO 0.02 -1.11 0.66 0.00 0.04 0.00 0.00 177.00 176.61 1pdu s ALA 537 N -1.63 3.40 0.76 8.56 0.00 -1.26 -5.05 121.76 126.55 1pdu s ALA 537 Ca 0.76 0.10 -0.13 0.00 0.00 0.00 0.00 51.96 52.69 1pdu s ALA 537 Cb -0.29 -2.87 0.06 0.00 0.00 0.00 0.00 23.12 20.02 1pdu s ALA 537 CO 0.32 0.03 1.16 -2.14 0.00 0.00 0.00 175.76 175.12 1pdu s PRO 538 N 0.29 2.03 0.22 0.00 0.02 -1.26 -4.80 135.00 131.50 1pdu s PRO 538 Ca 0.35 1.55 -0.08 0.00 0.02 0.00 0.00 61.00 62.84 1pdu s PRO 538 Cb -0.18 -1.84 0.27 0.00 0.02 0.00 0.00 34.50 32.76 1pdu s PRO 538 CO 0.18 -1.87 1.83 0.00 -0.33 0.00 0.00 177.00 176.81 1pdu h ALA 539 N -0.72 0.99 -0.95 -1.55 0.00 -1.98 -1.17 119.26 113.89 1pdu h ALA 539 Ca -0.46 0.00 0.15 0.00 0.00 0.00 0.00 54.91 54.60 1pdu h ALA 539 Cb 1.27 -0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.80 1pdu h ALA 539 CO 0.49 0.14 0.56 1.25 0.00 0.00 0.00 179.25 181.69 1pdu h LEU 540 N 0.80 0.76 -0.58 0.00 5.85 -1.99 0.36 115.31 120.50 1pdu h LEU 540 Ca 0.32 0.07 -0.15 0.00 0.84 0.00 0.00 57.88 58.96 1pdu h LEU 540 Cb 0.17 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1pdu h LEU 540 CO -0.17 0.35 -0.58 0.40 -0.34 0.00 0.00 178.44 178.10 1pdu h ILE 541 N 0.81 1.35 -0.00 4.05 1.08 -1.60 -2.93 117.51 120.26 1pdu h ILE 541 Ca 0.50 -1.87 -0.11 0.00 -0.39 0.00 0.00 64.86 62.99 1pdu h ILE 541 Cb 0.64 1.87 -0.02 0.00 -3.07 0.00 0.00 36.82 36.25 1pdu h ILE 541 CO -0.33 0.57 -0.51 -0.33 -0.69 0.00 0.00 178.15 176.86 1pdu h GLU 542 N 0.31 0.01 -0.16 2.37 4.39 0.07 -2.85 114.58 118.72 1pdu h GLU 542 Ca 0.00 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 1pdu h GLU 542 Cb 1.10 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.74 1pdu h GLU 542 CO 0.10 0.52 -0.09 -0.91 -1.16 0.00 0.00 179.01 177.47 1pdu h ASN 543 N 0.01 0.23 0.16 1.42 2.35 -0.22 -1.86 115.58 117.67 1pdu h ASN 543 Ca -0.00 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1pdu h ASN 543 Cb 0.91 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 39.22 1pdu h ASN 543 CO 0.07 0.36 -0.04 0.24 -1.65 0.00 0.00 177.43 176.41 1pdu h MET 544 N 0.24 0.00 0.00 0.81 2.86 -1.47 -1.80 114.93 115.57 1pdu h MET 544 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1pdu h MET 544 Cb 0.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1pdu h MET 544 CO 0.02 0.04 -0.59 1.19 1.06 0.00 0.00 176.91 178.63 1pdu n PHE 545 N -3.61 0.02 0.25 -0.22 3.72 -0.71 -3.90 117.46 113.02 1pdu n PHE 545 Ca -0.02 0.01 0.10 0.00 -0.05 0.00 0.00 57.45 57.48 1pdu n PHE 545 Cb 0.14 -0.23 0.67 0.00 -0.94 0.00 0.00 39.48 39.11 1pdu n PHE 545 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1pdu h VAL 546 N 0.00 0.80 0.00 -4.37 2.07 -1.29 -2.98 116.25 110.48 1pdu h VAL 546 Ca 0.00 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1pdu h VAL 546 Cb 0.51 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1pdu h VAL 546 CO 0.00 0.12 0.00 1.07 0.02 0.00 0.00 177.57 178.78 1pdu n THR 547 N -3.97 0.67 -1.33 2.57 5.66 -1.25 -5.15 114.28 111.48 1pdu n THR 547 Ca -0.02 -0.14 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1pdu n THR 547 Cb 0.21 -1.06 0.00 0.00 -1.55 0.00 0.00 70.33 67.94 1pdu n THR 547 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09