#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v1b s LEU 404 N 0.00 4.24 0.21 4.37 1.43 -1.26 -4.85 118.68 122.82 2v1b s LEU 404 Ca 0.00 2.86 -0.31 0.00 -1.03 0.00 0.00 54.13 55.65 2v1b s LEU 404 Cb 0.00 -3.81 -0.10 0.00 0.03 0.00 0.00 46.19 42.31 2v1b s LEU 404 CO 0.00 -0.92 1.51 0.00 0.23 0.00 0.00 176.35 177.18 2v1b s ALA 405 N -1.19 3.71 0.74 4.21 0.00 -1.26 -5.03 121.76 122.95 2v1b s ALA 405 Ca 0.56 1.37 -0.12 0.00 0.00 0.00 0.00 51.96 53.77 2v1b s ALA 405 Cb -0.43 -3.60 0.04 0.00 0.00 0.00 0.00 23.12 19.14 2v1b s ALA 405 CO 0.56 -0.78 1.11 0.95 0.00 0.00 0.00 175.76 177.60 2v1b s THR 406 N 0.56 3.20 0.30 0.00 -4.23 -1.26 -4.90 115.64 109.32 2v1b s THR 406 Ca 0.65 0.39 0.03 0.00 -1.18 0.00 0.00 61.69 61.58 2v1b s THR 406 Cb -0.43 -3.32 0.29 0.00 1.34 0.00 0.00 72.50 70.38 2v1b s THR 406 CO 0.38 -0.51 1.86 0.74 -0.54 0.00 0.00 174.62 176.55 2v1b h THR 407 N -0.82 0.93 -0.33 3.99 2.02 -1.99 -0.78 112.91 115.94 2v1b h THR 407 Ca -0.46 -0.32 0.06 0.00 0.77 0.00 0.00 66.41 66.46 2v1b h THR 407 Cb 1.27 -0.08 -0.05 0.00 -1.74 0.00 0.00 68.15 67.55 2v1b h THR 407 CO 0.63 0.17 0.01 0.25 0.37 0.00 0.00 175.52 176.94 2v1b h LEU 408 N 0.93 -0.12 -0.79 2.58 5.85 -1.99 -2.11 115.31 119.67 2v1b h LEU 408 Ca 0.46 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.25 2v1b h LEU 408 Cb 0.48 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.63 2v1b h LEU 408 CO -0.22 -0.02 0.00 -0.62 -0.34 0.00 0.00 178.44 177.23 2v1b n GLU 409 N -5.16 0.20 0.00 1.25 1.02 -0.36 -1.59 120.64 116.00 2v1b n GLU 409 Ca 0.01 0.45 0.13 0.00 -0.02 0.00 0.00 57.16 57.73 2v1b n GLU 409 Cb 0.17 -1.89 0.45 0.00 -0.02 0.00 0.00 31.44 30.14 2v1b n GLU 409 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2v1b n ARG 410 N -2.27 0.66 -1.69 3.49 1.74 -0.80 -1.36 116.66 116.43 2v1b n ARG 410 Ca 0.02 -0.33 -0.44 0.00 -0.77 0.00 0.00 57.85 56.33 2v1b n ARG 410 Cb 0.22 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 2v1b n ARG 410 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2v1b n ILE 411 N -0.88 0.84 -1.55 0.55 5.41 -0.62 -4.81 119.36 118.30 2v1b n ILE 411 Ca 0.12 -0.21 -0.31 0.00 1.00 0.00 0.00 62.75 63.35 2v1b n ILE 411 Cb 0.32 -1.61 -0.06 0.00 -0.71 0.00 0.00 39.64 37.58 2v1b n ILE 411 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2v1b n GLU 412 N 2.27 3.27 -3.95 0.38 1.02 -1.26 -4.72 120.64 117.64 2v1b n GLU 412 Ca 0.12 -2.46 -0.09 0.00 -0.02 0.00 0.00 57.16 54.70 2v1b n GLU 412 Cb 0.33 -2.38 -0.10 0.00 -0.02 0.00 0.00 31.44 29.27 2v1b n GLU 412 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2v1b s LYS 413 N -0.47 0.52 -0.53 3.49 -0.14 -1.26 -5.06 119.74 116.29 2v1b s LYS 413 Ca 0.60 -0.72 -0.24 0.00 -1.36 0.00 0.00 55.97 54.25 2v1b s LYS 413 Cb 0.28 0.20 0.04 0.00 -1.68 0.00 0.00 37.83 36.66 2v1b s LYS 413 CO -0.12 -0.12 0.94 -0.80 -0.76 0.00 0.00 175.35 174.49 2v1b s ASN 414 N -1.97 6.37 0.15 2.83 0.01 -1.26 -4.48 114.94 116.59 2v1b s ASN 414 Ca -0.07 -0.25 -0.16 0.00 -0.71 0.00 0.00 52.86 51.66 2v1b s ASN 414 Cb -0.03 -2.44 0.03 0.00 0.41 0.00 0.00 41.25 39.22 2v1b s ASN 414 CO -0.04 -1.19 0.43 0.72 -1.51 0.00 0.00 177.10 175.52 2v1b s PHE 415 N 3.90 -0.16 0.11 2.20 -0.12 -1.26 -2.21 117.98 120.45 2v1b s PHE 415 Ca 0.32 -0.17 0.03 0.00 -0.05 0.00 0.00 56.93 57.06 2v1b s PHE 415 Cb -0.12 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.51 2v1b s PHE 415 CO 0.21 -0.77 -0.08 0.14 -0.05 0.00 0.00 175.22 174.67 2v1b s VAL 416 N -3.83 0.85 -0.04 -2.49 -7.23 -0.58 -1.61 120.40 105.47 2v1b s VAL 416 Ca 0.05 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.30 2v1b s VAL 416 Cb 0.01 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 35.24 2v1b s VAL 416 CO -0.09 -0.82 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.12 2v1b s ILE 417 N -3.46 1.16 0.26 -0.62 1.01 -0.51 -1.27 121.20 117.77 2v1b s ILE 417 Ca 0.13 -0.55 0.11 0.00 0.00 0.00 0.00 60.65 60.34 2v1b s ILE 417 Cb 0.04 -1.02 -0.05 0.00 0.01 0.00 0.00 42.46 41.44 2v1b s ILE 417 CO -0.03 0.35 -0.14 0.42 0.00 0.00 0.00 174.94 175.53 2v1b s THR 418 N 0.24 2.77 -0.34 2.92 -4.23 -0.46 -0.77 115.64 115.78 2v1b s THR 418 Ca -0.06 -2.20 -0.00 0.00 -1.18 0.00 0.00 61.69 58.24 2v1b s THR 418 Cb -0.12 -2.45 0.08 0.00 1.34 0.00 0.00 72.50 71.36 2v1b s THR 418 CO 0.02 -0.35 0.07 -0.62 -0.54 0.00 0.00 174.62 173.20 2v1b s ASP 419 N -3.44 4.94 0.00 3.99 -1.08 -0.91 -2.22 116.67 117.95 2v1b s ASP 419 Ca 0.29 -1.77 0.15 0.00 -0.52 0.00 0.00 52.55 50.70 2v1b s ASP 419 Cb -0.06 -1.72 0.66 0.00 -1.46 0.00 0.00 42.92 40.35 2v1b s ASP 419 CO 0.16 -0.38 1.45 -0.81 0.52 0.00 0.00 175.17 176.11 2v1b n PRO 420 N 4.50 0.06 0.17 4.34 -0.04 -1.26 -2.08 135.00 140.69 2v1b n PRO 420 Ca -0.05 0.22 0.02 0.00 -0.04 0.00 0.00 63.50 63.65 2v1b n PRO 420 Cb 0.42 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.67 2v1b n PRO 420 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2v1b h ARG 421 N 0.00 0.00 -6.81 0.54 3.08 -1.94 -3.43 114.38 105.82 2v1b h ARG 421 Ca 0.00 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.55 2v1b h ARG 421 Cb 0.22 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.29 2v1b h ARG 421 CO 0.00 0.47 0.48 -0.51 -1.07 0.00 0.00 179.97 179.34 2v1b s LEU 422 N -7.71 4.55 0.21 3.04 1.43 -0.88 -5.00 118.68 114.32 2v1b s LEU 422 Ca -0.02 2.28 -0.31 0.00 -1.03 0.00 0.00 54.13 55.06 2v1b s LEU 422 Cb 0.13 -3.63 -0.15 0.00 0.03 0.00 0.00 46.19 42.56 2v1b s LEU 422 CO 0.73 -0.16 1.06 -2.65 0.23 0.00 0.00 176.35 175.56 2v1b n PRO 423 N 1.17 1.11 -1.67 1.29 -0.02 -1.26 -2.44 135.00 133.17 2v1b n PRO 423 Ca -0.01 0.39 -0.20 0.00 -2.02 0.00 0.00 63.50 61.67 2v1b n PRO 423 Cb 0.45 -1.81 -0.07 0.00 -0.02 0.00 0.00 33.50 32.04 2v1b n PRO 423 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2v1b n ASP 424 N 1.75 -5.39 -3.71 2.55 2.03 -1.26 -4.34 116.55 108.18 2v1b n ASP 424 Ca 0.14 0.42 -0.32 0.00 0.52 0.00 0.00 54.79 55.54 2v1b n ASP 424 Cb 0.27 -4.58 0.04 0.00 -0.72 0.00 0.00 41.12 36.13 2v1b n ASP 424 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2v1b n ASN 425 N -1.23 -5.10 -4.84 1.67 5.15 -1.02 -4.51 115.26 105.38 2v1b n ASN 425 Ca -0.20 -1.03 -0.32 0.00 -0.60 0.00 0.00 54.58 52.43 2v1b n ASN 425 Cb 0.65 -3.28 -0.01 0.00 -0.53 0.00 0.00 39.78 36.61 2v1b n ASN 425 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2v1b s PRO 426 N -6.08 3.67 0.07 1.20 0.04 -1.26 -4.64 135.00 128.01 2v1b s PRO 426 Ca 0.46 0.94 -0.31 0.00 0.04 0.00 0.00 61.00 62.14 2v1b s PRO 426 Cb -0.17 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 32.21 2v1b s PRO 426 CO 0.87 -0.51 1.43 0.42 0.04 0.00 0.00 177.00 179.25 2v1b s ILE 427 N -2.78 3.39 -0.02 0.56 1.01 -0.12 -2.15 121.20 121.09 2v1b s ILE 427 Ca 0.59 0.93 0.06 0.00 0.00 0.00 0.00 60.65 62.22 2v1b s ILE 427 Cb -0.12 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.67 2v1b s ILE 427 CO 0.40 0.04 0.11 2.30 0.00 0.00 0.00 174.94 177.79 2v1b n ILE 428 N 4.26 0.08 -4.27 2.92 -5.35 0.05 -0.85 119.36 116.20 2v1b n ILE 428 Ca 0.13 -0.16 -0.17 0.00 -0.27 0.00 0.00 62.75 62.27 2v1b n ILE 428 Cb 0.42 0.12 -0.14 0.00 -1.74 0.00 0.00 39.64 38.30 2v1b n ILE 428 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2v1b s PHE 429 N -2.37 0.68 -0.09 4.28 0.08 -1.06 -4.98 117.98 114.52 2v1b s PHE 429 Ca -0.02 -0.15 -0.04 0.00 0.12 0.00 0.00 56.93 56.84 2v1b s PHE 429 Cb 0.04 -0.44 0.05 0.00 -0.57 0.00 0.00 43.02 42.10 2v1b s PHE 429 CO 0.25 -0.01 0.20 0.00 -0.10 0.00 0.00 175.22 175.56 2v1b s ALA 430 N -0.25 -0.37 0.70 5.36 0.00 -1.26 -1.43 121.76 124.51 2v1b s ALA 430 Ca 0.02 0.78 -0.13 0.00 0.00 0.00 0.00 51.96 52.63 2v1b s ALA 430 Cb -0.03 -0.69 0.02 0.00 0.00 0.00 0.00 23.12 22.41 2v1b s ALA 430 CO -0.00 -0.35 1.09 -1.54 0.00 0.00 0.00 175.76 174.96 2v1b s SER 431 N 1.69 4.99 0.42 0.00 1.04 -0.63 -4.85 113.70 116.36 2v1b s SER 431 Ca -0.04 1.87 0.12 0.00 0.48 0.00 0.00 55.95 58.38 2v1b s SER 431 Cb -0.11 -2.53 0.97 0.00 0.10 0.00 0.00 66.02 64.44 2v1b s SER 431 CO -0.07 -1.71 1.97 0.44 0.98 0.00 0.00 173.24 174.85 2v1b h ASP 432 N -0.44 0.43 -0.65 7.02 3.32 -1.50 -1.70 116.42 122.90 2v1b h ASP 432 Ca -0.45 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.54 2v1b h ASP 432 Cb 1.23 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 2v1b h ASP 432 CO 0.54 0.26 0.14 0.28 -1.72 0.00 0.00 179.24 178.74 2v1b h SER 433 N 0.48 1.01 -0.66 6.45 0.02 -1.83 -0.46 113.55 118.57 2v1b h SER 433 Ca 0.30 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 2v1b h SER 433 Cb 0.52 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 2v1b h SER 433 CO -0.09 0.99 0.35 0.15 -1.14 0.00 0.00 176.83 177.08 2v1b h PHE 434 N 0.98 0.92 -0.52 3.45 3.57 -1.57 -1.01 116.94 122.76 2v1b h PHE 434 Ca 0.20 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 2v1b h PHE 434 Cb 0.39 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2v1b h PHE 434 CO 0.03 0.67 0.20 -0.07 -2.23 0.00 0.00 178.31 176.91 2v1b h LEU 435 N 0.90 0.72 -0.77 0.59 3.38 -1.06 -1.65 115.31 117.43 2v1b h LEU 435 Ca 0.23 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2v1b h LEU 435 Cb 0.07 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2v1b h LEU 435 CO -0.03 0.69 0.43 1.56 0.09 0.00 0.00 178.44 181.18 2v1b h GLN 436 N 0.69 1.07 -0.08 1.13 4.20 -0.74 -0.52 115.11 120.86 2v1b h GLN 436 Ca 0.17 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2v1b h GLN 436 Cb 0.21 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.77 2v1b h GLN 436 CO -0.01 0.79 0.03 1.25 -0.67 0.00 0.00 178.83 180.22 2v1b h LEU 437 N 1.06 0.12 0.00 1.46 5.85 -0.99 -3.30 115.31 119.51 2v1b h LEU 437 Ca 0.27 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2v1b h LEU 437 Cb 0.03 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2v1b h LEU 437 CO -0.04 0.26 -0.71 0.35 -0.34 0.00 0.00 178.44 177.96 2v1b n THR 438 N -4.93 0.30 -0.97 1.05 -2.24 -0.64 -4.87 114.28 101.98 2v1b n THR 438 Ca -0.06 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2v1b n THR 438 Cb 0.12 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 2v1b n THR 438 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2v1b n GLU 439 N -2.05 -0.39 -3.23 -0.78 1.02 -0.21 -0.97 120.64 114.02 2v1b n GLU 439 Ca 0.03 0.10 -0.28 0.00 -0.02 0.00 0.00 57.16 56.99 2v1b n GLU 439 Cb 0.43 -3.39 -0.03 0.00 -0.02 0.00 0.00 31.44 28.43 2v1b n GLU 439 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2v1b s TYR 440 N -2.12 3.49 0.60 -0.32 1.51 -1.23 -4.79 117.35 114.48 2v1b s TYR 440 Ca 0.00 0.67 -0.09 0.00 -1.01 0.00 0.00 57.07 56.64 2v1b s TYR 440 Cb 0.00 -2.13 -0.02 0.00 -0.11 0.00 0.00 41.96 39.70 2v1b s TYR 440 CO 0.00 0.10 0.97 -1.54 -1.11 0.00 0.00 175.55 173.97 2v1b s SER 441 N -3.34 5.99 0.24 2.29 1.04 -1.26 -4.69 113.70 113.97 2v1b s SER 441 Ca 0.45 1.14 -0.07 0.00 0.48 0.00 0.00 55.95 57.95 2v1b s SER 441 Cb -0.10 -2.20 0.22 0.00 0.10 0.00 0.00 66.02 64.04 2v1b s SER 441 CO 0.32 -0.92 1.88 -0.09 0.98 0.00 0.00 173.24 175.40 2v1b h ARG 442 N -0.23 1.28 0.00 4.02 2.43 -1.97 -2.13 114.38 117.78 2v1b h ARG 442 Ca -0.45 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 58.57 2v1b h ARG 442 Cb 1.22 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 30.50 2v1b h ARG 442 CO 0.62 0.91 -0.10 1.05 -1.51 0.00 0.00 179.97 180.95 2v1b h GLU 443 N 1.30 0.00 0.00 0.20 4.11 -1.94 -1.90 114.58 116.35 2v1b h GLU 443 Ca 0.33 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.74 2v1b h GLU 443 Cb -0.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 2v1b h GLU 443 CO -0.06 0.10 -0.12 0.93 0.07 0.00 0.00 179.01 179.93 2v1b h GLU 444 N 0.00 0.00 0.00 1.06 5.08 -1.77 -3.36 114.58 115.59 2v1b h GLU 444 Ca -0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2v1b h GLU 444 Cb 0.18 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 2v1b h GLU 444 CO 0.01 0.12 -1.64 0.44 -1.00 0.00 0.00 179.01 176.94 2v1b n ILE 445 N -3.20 0.64 -1.72 3.13 -6.64 -0.83 -4.92 119.36 105.82 2v1b n ILE 445 Ca 0.01 -0.37 -0.42 0.00 -1.77 0.00 0.00 62.75 60.20 2v1b n ILE 445 Cb 0.44 -0.78 -0.01 0.00 -1.44 0.00 0.00 39.64 37.86 2v1b n ILE 445 CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 2v1b n LEU 446 N -2.40 3.98 0.00 7.28 4.77 -0.78 -2.05 117.00 127.80 2v1b n LEU 446 Ca -0.16 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.01 2v1b n LEU 446 Cb 0.79 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.34 2v1b n LEU 446 CO 0.19 -0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.69 2v1b n GLY 447 N 1.28 0.80 3.67 -0.72 0.00 -0.03 -4.98 105.19 105.21 2v1b n GLY 447 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 2v1b n GLY 447 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2v1b s ARG 448 N -0.12 2.46 0.33 1.61 0.52 -0.87 -4.79 118.95 118.08 2v1b s ARG 448 Ca 0.00 -0.92 -0.26 0.00 -0.52 0.00 0.00 55.73 54.03 2v1b s ARG 448 Cb 0.00 -2.47 -0.10 0.00 0.52 0.00 0.00 34.95 32.90 2v1b s ARG 448 CO 0.00 0.52 0.99 1.21 0.02 0.00 0.00 175.30 178.03 2v1b s ASN 449 N -2.42 7.24 0.23 0.23 3.84 -1.26 -0.95 114.94 121.85 2v1b s ASN 449 Ca 0.25 1.94 0.18 0.00 0.21 0.00 0.00 52.86 55.45 2v1b s ASN 449 Cb -0.11 -2.59 0.89 0.00 -0.55 0.00 0.00 41.25 38.89 2v1b s ASN 449 CO 0.18 -0.14 1.55 0.00 -2.79 0.00 0.00 177.10 175.89 2v1b n ARG 451 N -2.07 0.09 0.17 0.00 1.85 -1.26 -2.06 116.66 113.38 2v1b n ARG 451 Ca -0.00 0.58 0.12 0.00 -1.00 0.00 0.00 57.85 57.55 2v1b n ARG 451 Cb 0.08 -1.82 0.62 0.00 -1.05 0.00 0.00 32.46 30.29 2v1b n ARG 451 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 2v1b h PHE 452 N 0.00 0.00 0.00 2.89 -0.00 -1.95 -1.74 116.94 116.14 2v1b h PHE 452 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 2v1b h PHE 452 Cb 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.00 2v1b h PHE 452 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.31 179.59 2v1b n LEU 453 N -2.32 0.26 -4.89 2.10 4.77 -0.87 -4.87 117.00 111.17 2v1b n LEU 453 Ca -0.01 0.53 -0.28 0.00 -0.03 0.00 0.00 56.01 56.21 2v1b n LEU 453 Cb 0.07 -0.46 -0.00 0.00 -2.33 0.00 0.00 43.42 40.70 2v1b n LEU 453 CO 0.12 -0.11 0.50 -1.10 -1.33 0.00 0.00 177.39 175.47 2v1b s GLN 454 N -3.04 3.58 0.00 3.23 -0.21 -0.66 -0.28 119.66 122.28 2v1b s GLN 454 Ca 0.12 0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.85 2v1b s GLN 454 Cb 0.16 -2.31 0.00 0.00 1.00 0.00 0.00 33.01 31.85 2v1b s GLN 454 CO 0.51 -0.26 0.00 0.41 -2.12 0.00 0.00 175.29 173.83 2v1b n GLY 455 N -2.25 2.11 0.37 3.09 0.00 -1.26 -4.85 105.19 102.40 2v1b n GLY 455 Ca 0.02 -0.95 0.12 0.00 0.00 0.00 0.00 46.02 45.22 2v1b n GLY 455 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2v1b h PRO 456 N 0.00 0.58 -0.14 1.61 0.11 -1.98 -1.54 132.00 130.64 2v1b h PRO 456 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2v1b h PRO 456 Cb 0.00 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 30.98 2v1b h PRO 456 CO 0.00 0.38 0.00 0.39 -0.21 0.00 0.00 178.00 178.56 2v1b n GLU 457 N -4.52 1.96 -2.17 1.05 1.02 -1.26 -4.89 120.64 111.83 2v1b n GLU 457 Ca 0.15 -1.42 -0.42 0.00 -0.02 0.00 0.00 57.16 55.45 2v1b n GLU 457 Cb 0.45 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.39 2v1b n GLU 457 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2v1b s THR 458 N -1.83 3.50 -0.25 2.62 2.01 -0.58 -4.74 115.64 116.38 2v1b s THR 458 Ca 0.34 0.97 -0.29 0.00 0.31 0.00 0.00 61.69 63.03 2v1b s THR 458 Cb 0.20 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 69.08 2v1b s THR 458 CO 0.30 0.02 1.33 -0.62 -0.69 0.00 0.00 174.62 174.96 2v1b s ASP 459 N 1.69 6.73 0.37 3.53 -1.08 -1.26 -4.89 116.67 121.76 2v1b s ASP 459 Ca 0.65 1.42 0.19 0.00 -0.52 0.00 0.00 52.55 54.29 2v1b s ASP 459 Cb -0.34 -2.54 0.66 0.00 -1.46 0.00 0.00 42.92 39.24 2v1b s ASP 459 CO 0.28 -1.00 1.72 0.03 0.52 0.00 0.00 175.17 176.73 2v1b h ARG 460 N 9.11 0.00 -0.77 4.34 2.47 -1.97 -2.43 114.38 125.13 2v1b h ARG 460 Ca -0.27 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 58.48 2v1b h ARG 460 Cb 1.11 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.38 2v1b h ARG 460 CO 1.01 0.37 0.49 0.00 0.56 0.00 0.00 179.97 182.40 2v1b h ALA 461 N 1.63 1.01 -0.38 0.04 0.00 -2.00 -1.88 119.26 117.68 2v1b h ALA 461 Ca -0.00 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2v1b h ALA 461 Cb 0.92 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2v1b h ALA 461 CO 0.05 0.30 -0.16 1.15 0.00 0.00 0.00 179.25 180.59 2v1b h THR 462 N 0.96 1.26 -0.86 0.00 2.02 -1.84 -2.77 112.91 111.69 2v1b h THR 462 Ca 0.31 -1.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 2v1b h THR 462 Cb -0.00 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 2v1b h THR 462 CO -0.11 0.41 0.51 0.58 0.37 0.00 0.00 175.52 177.28 2v1b h VAL 463 N 0.63 1.24 -0.07 3.16 2.07 -1.23 -1.95 116.25 120.10 2v1b h VAL 463 Ca 0.10 -0.53 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 2v1b h VAL 463 Cb 0.63 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 2v1b h VAL 463 CO 0.04 0.25 -0.22 -0.09 0.02 0.00 0.00 177.57 177.57 2v1b h ARG 464 N 1.18 0.12 -0.69 1.57 2.43 -1.11 -1.34 114.38 116.53 2v1b h ARG 464 Ca 0.31 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.43 2v1b h ARG 464 Cb -0.04 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 2v1b h ARG 464 CO -0.06 0.35 0.37 0.87 -1.51 0.00 0.00 179.97 179.99 2v1b h LYS 465 N 0.11 0.96 -0.13 0.20 1.57 -1.09 -1.06 116.57 117.13 2v1b h LYS 465 Ca 0.02 -0.10 -0.18 0.00 -1.87 0.00 0.00 60.65 58.52 2v1b h LYS 465 Cb 0.47 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 32.59 2v1b h LYS 465 CO 0.03 0.71 -0.60 0.82 -0.57 0.00 0.00 179.45 179.84 2v1b h ILE 466 N 0.96 1.33 -0.51 1.86 2.04 -1.16 -2.46 117.51 119.57 2v1b h ILE 466 Ca 0.24 -1.87 0.07 0.00 1.00 0.00 0.00 64.86 64.31 2v1b h ILE 466 Cb 0.03 2.08 -0.06 0.00 -0.74 0.00 0.00 36.82 38.13 2v1b h ILE 466 CO -0.04 0.58 0.17 -0.09 0.00 0.00 0.00 178.15 178.77 2v1b h ARG 467 N 0.30 0.33 -0.57 2.37 9.65 -1.07 -1.60 114.38 123.79 2v1b h ARG 467 Ca -0.04 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 58.75 2v1b h ARG 467 Cb 1.24 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.72 2v1b h ARG 467 CO 0.13 0.22 0.06 -0.44 2.80 0.00 0.00 179.97 182.74 2v1b h ASP 468 N 0.34 0.89 -0.59 -3.80 5.19 -1.14 -1.38 116.42 115.93 2v1b h ASP 468 Ca 0.25 -0.21 -0.05 0.00 -0.62 0.00 0.00 57.03 56.41 2v1b h ASP 468 Cb 0.28 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.53 2v1b h ASP 468 CO -0.26 0.91 0.19 0.00 -3.12 0.00 0.00 179.24 176.96 2v1b h ALA 469 N 1.19 0.77 -0.34 3.45 0.00 -0.91 -1.48 119.26 121.94 2v1b h ALA 469 Ca 0.17 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2v1b h ALA 469 Cb 0.43 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2v1b h ALA 469 CO 0.01 0.43 -0.05 0.82 0.00 0.00 0.00 179.25 180.47 2v1b h ILE 470 N 0.83 1.27 -0.38 0.00 2.04 -1.07 0.91 117.51 121.11 2v1b h ILE 470 Ca 0.19 -1.07 -0.05 0.00 1.00 0.00 0.00 64.86 64.93 2v1b h ILE 470 Cb 0.27 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2v1b h ILE 470 CO -0.01 0.35 0.04 0.44 0.00 0.00 0.00 178.15 178.97 2v1b h ASP 471 N 0.43 0.54 -0.37 1.72 3.32 -1.04 -1.92 116.42 119.10 2v1b h ASP 471 Ca 0.09 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2v1b h ASP 471 Cb 0.53 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2v1b h ASP 471 CO 0.03 0.58 0.00 0.59 -1.72 0.00 0.00 179.24 178.72 2v1b n ASN 472 N -4.29 2.80 -3.71 6.45 3.02 -0.58 -4.98 115.26 113.97 2v1b n ASN 472 Ca 0.02 -1.91 -0.22 0.00 -0.03 0.00 0.00 54.58 52.44 2v1b n ASN 472 Cb 0.23 -0.24 0.03 0.00 -0.61 0.00 0.00 39.78 39.19 2v1b n ASN 472 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2v1b n GLN 473 N 1.05 -4.49 -4.36 3.52 6.02 0.18 -4.98 117.38 114.33 2v1b n GLN 473 Ca 0.18 0.60 -0.18 0.00 -0.01 0.00 0.00 57.00 57.59 2v1b n GLN 473 Cb 0.49 -5.08 -0.10 0.00 1.02 0.00 0.00 30.24 26.57 2v1b n GLN 473 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2v1b s THR 474 N -3.68 0.76 0.56 5.09 -1.32 -0.41 -4.85 115.64 111.79 2v1b s THR 474 Ca 0.04 -2.00 -0.14 0.00 -1.21 0.00 0.00 61.69 58.38 2v1b s THR 474 Cb -0.01 -2.67 -0.06 0.00 -1.51 0.00 0.00 72.50 68.25 2v1b s THR 474 CO 0.82 -0.02 1.00 -1.83 -2.21 0.00 0.00 174.62 172.39 2v1b s GLU 475 N -3.99 3.79 -0.01 7.08 -1.05 -1.26 -4.51 118.70 118.75 2v1b s GLU 475 Ca 0.37 0.86 -0.19 0.00 -0.15 0.00 0.00 54.97 55.86 2v1b s GLU 475 Cb 0.08 -2.11 0.03 0.00 -0.44 0.00 0.00 34.13 31.69 2v1b s GLU 475 CO 0.14 -0.40 0.40 0.54 0.95 0.00 0.00 175.26 176.89 2v1b s VAL 476 N -2.87 0.05 -0.07 1.83 0.11 -1.06 -4.96 120.40 113.42 2v1b s VAL 476 Ca 0.57 -0.37 -0.01 0.00 -2.93 0.00 0.00 61.98 59.24 2v1b s VAL 476 Cb -0.10 -0.75 0.03 0.00 -1.53 0.00 0.00 36.38 34.02 2v1b s VAL 476 CO 0.41 -0.21 -0.01 -0.89 -3.33 0.00 0.00 175.10 171.07 2v1b s THR 477 N -1.47 0.48 0.19 5.04 2.01 -1.26 -1.08 115.64 119.54 2v1b s THR 477 Ca -0.12 0.04 -0.02 0.00 0.31 0.00 0.00 61.69 61.90 2v1b s THR 477 Cb -0.03 -0.60 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 2v1b s THR 477 CO 0.05 0.27 0.13 0.68 -0.69 0.00 0.00 174.62 175.06 2v1b s VAL 478 N 1.78 0.02 -0.07 3.82 -7.23 -0.55 -5.00 120.40 113.18 2v1b s VAL 478 Ca 0.02 -1.94 0.05 0.00 -1.81 0.00 0.00 61.98 58.31 2v1b s VAL 478 Cb -0.13 -2.37 -0.01 0.00 0.56 0.00 0.00 36.38 34.43 2v1b s VAL 478 CO -0.05 -0.10 -0.22 -1.10 -0.31 0.00 0.00 175.10 173.31 2v1b s GLN 479 N -4.13 2.67 0.08 4.82 -0.21 -1.26 -0.65 119.66 120.99 2v1b s GLN 479 Ca 0.35 -0.85 -0.15 0.00 0.02 0.00 0.00 55.36 54.72 2v1b s GLN 479 Cb 0.07 -2.25 0.03 0.00 1.00 0.00 0.00 33.01 31.85 2v1b s GLN 479 CO 0.09 0.38 0.36 -0.48 -2.12 0.00 0.00 175.29 173.52 2v1b s LEU 480 N -0.14 0.60 0.02 2.90 2.34 -0.67 -4.97 118.68 118.77 2v1b s LEU 480 Ca -0.04 -0.24 -0.29 0.00 0.06 0.00 0.00 54.13 53.62 2v1b s LEU 480 Cb -0.14 1.63 -0.04 0.00 -0.56 0.00 0.00 46.19 47.08 2v1b s LEU 480 CO 0.04 -0.74 0.94 -0.63 -1.06 0.00 0.00 176.35 174.90 2v1b s ILE 481 N -3.19 4.79 0.34 1.48 1.01 -1.26 -1.05 121.20 123.32 2v1b s ILE 481 Ca -0.01 1.99 0.04 0.00 0.00 0.00 0.00 60.65 62.68 2v1b s ILE 481 Cb 0.01 -4.29 -0.07 0.00 0.01 0.00 0.00 42.46 38.13 2v1b s ILE 481 CO -0.07 0.21 0.05 0.20 0.00 0.00 0.00 174.94 175.33 2v1b s ASN 482 N 0.71 2.58 -0.01 3.58 0.02 -0.14 -4.46 114.94 117.21 2v1b s ASN 482 Ca 0.49 -1.38 0.04 0.00 -1.02 0.00 0.00 52.86 50.99 2v1b s ASN 482 Cb -0.21 -0.12 -0.01 0.00 0.02 0.00 0.00 41.25 40.93 2v1b s ASN 482 CO 0.27 -0.59 -0.12 -0.31 0.02 0.00 0.00 177.10 176.37 2v1b s TYR 483 N -3.22 1.13 0.87 2.20 1.51 0.62 -1.06 117.35 119.40 2v1b s TYR 483 Ca 0.36 -0.23 -0.13 0.00 -1.01 0.00 0.00 57.07 56.07 2v1b s TYR 483 Cb 0.09 -0.74 0.14 0.00 -0.11 0.00 0.00 41.96 41.34 2v1b s TYR 483 CO 0.16 -0.04 1.22 0.95 -1.11 0.00 0.00 175.55 176.73 2v1b s THR 484 N -0.22 2.04 0.39 -0.71 -4.23 -0.15 -4.74 115.64 108.02 2v1b s THR 484 Ca 0.03 -0.07 0.10 0.00 -1.18 0.00 0.00 61.69 60.58 2v1b s THR 484 Cb -0.06 -2.97 0.31 0.00 1.34 0.00 0.00 72.50 71.12 2v1b s THR 484 CO -0.00 0.00 1.96 0.50 -0.54 0.00 0.00 174.62 176.53 2v1b h LYS 485 N -1.27 0.58 -0.04 3.99 3.64 -1.36 -0.30 116.57 121.80 2v1b h LYS 485 Ca -0.44 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2v1b h LYS 485 Cb 1.28 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2v1b h LYS 485 CO 0.50 0.38 0.00 -1.13 -2.27 0.00 0.00 179.45 176.93 2v1b n SER 486 N -4.48 1.67 0.00 4.20 3.41 -1.26 -4.92 113.62 112.23 2v1b n SER 486 Ca 0.11 -1.57 0.00 0.00 -0.26 0.00 0.00 58.87 57.15 2v1b n SER 486 Cb 0.32 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 2v1b n SER 486 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2v1b n GLY 487 N 1.19 0.86 3.73 5.00 0.00 -0.12 -5.06 105.19 110.79 2v1b n GLY 487 Ca 0.18 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2v1b n GLY 487 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2v1b s LYS 488 N -0.66 4.60 0.29 1.61 2.20 -1.26 -4.72 119.74 121.80 2v1b s LYS 488 Ca 0.00 1.60 -0.21 0.00 -0.36 0.00 0.00 55.97 57.00 2v1b s LYS 488 Cb 0.00 -3.34 -0.09 0.00 -1.51 0.00 0.00 37.83 32.89 2v1b s LYS 488 CO 0.00 0.05 0.82 0.15 -0.36 0.00 0.00 175.35 176.01 2v1b s LYS 489 N 0.15 4.31 0.03 4.03 1.02 -1.26 -0.98 119.74 127.04 2v1b s LYS 489 Ca 0.50 1.01 -0.09 0.00 0.02 0.00 0.00 55.97 57.41 2v1b s LYS 489 Cb -0.26 -2.70 0.00 0.00 -0.52 0.00 0.00 37.83 34.35 2v1b s LYS 489 CO 0.31 0.27 0.19 -0.59 -0.92 0.00 0.00 175.35 174.61 2v1b s PHE 490 N -1.70 0.04 0.09 3.18 -0.71 -0.22 -4.98 117.98 113.68 2v1b s PHE 490 Ca 0.49 -0.21 -0.26 0.00 -1.04 0.00 0.00 56.93 55.92 2v1b s PHE 490 Cb -0.15 -0.03 -0.06 0.00 -1.21 0.00 0.00 43.02 41.56 2v1b s PHE 490 CO 0.20 -0.39 0.79 -1.58 -1.34 0.00 0.00 175.22 172.90 2v1b s TRP 491 N -2.19 3.80 -0.26 3.49 0.52 -0.52 -0.97 118.94 122.80 2v1b s TRP 491 Ca -0.08 1.56 0.02 0.00 0.02 0.00 0.00 56.10 57.62 2v1b s TRP 491 Cb -0.03 -2.83 0.07 0.00 -1.15 0.00 0.00 33.47 29.53 2v1b s TRP 491 CO -0.02 0.35 -0.07 1.21 0.02 0.00 0.00 176.95 178.44 2v1b s ASN 492 N -0.40 4.30 -0.47 2.95 3.84 -0.21 -0.90 114.94 124.03 2v1b s ASN 492 Ca 0.38 -1.43 -0.26 0.00 0.21 0.00 0.00 52.86 51.77 2v1b s ASN 492 Cb -0.22 -1.43 0.03 0.00 -0.55 0.00 0.00 41.25 39.08 2v1b s ASN 492 CO 0.25 -0.23 0.95 -0.22 -2.79 0.00 0.00 177.10 175.05 2v1b s LEU 493 N 1.18 3.98 -0.10 3.21 0.20 -0.34 -1.67 118.68 125.14 2v1b s LEU 493 Ca -0.05 0.09 0.03 0.00 0.69 0.00 0.00 54.13 54.89 2v1b s LEU 493 Cb -0.19 -3.18 -0.01 0.00 -0.43 0.00 0.00 46.19 42.38 2v1b s LEU 493 CO -0.06 -1.09 -0.20 0.12 -0.29 0.00 0.00 176.35 174.83 2v1b s PHE 494 N 3.85 2.64 -0.10 5.38 5.36 0.18 -0.85 117.98 134.43 2v1b s PHE 494 Ca 0.37 -0.85 0.03 0.00 -0.96 0.00 0.00 56.93 55.52 2v1b s PHE 494 Cb -0.10 -1.74 0.01 0.00 -0.34 0.00 0.00 43.02 40.84 2v1b s PHE 494 CO 0.26 -0.31 -0.19 -1.58 -1.46 0.00 0.00 175.22 171.94 2v1b s HIS 495 N 0.26 2.22 -0.08 10.12 5.65 -0.50 -1.48 115.29 131.49 2v1b s HIS 495 Ca -0.14 -0.99 -0.00 0.00 0.25 0.00 0.00 55.06 54.18 2v1b s HIS 495 Cb -0.17 -1.54 -0.03 0.00 -1.18 0.00 0.00 32.58 29.66 2v1b s HIS 495 CO 0.07 -0.45 -0.04 -1.17 -0.65 0.00 0.00 174.74 172.50 2v1b s LEU 496 N 0.68 3.32 -0.08 8.88 0.20 -0.24 -1.44 118.68 130.00 2v1b s LEU 496 Ca -0.12 0.03 -0.14 0.00 0.69 0.00 0.00 54.13 54.58 2v1b s LEU 496 Cb -0.16 -1.74 0.03 0.00 -0.43 0.00 0.00 46.19 43.89 2v1b s LEU 496 CO 0.03 0.35 0.35 0.00 -0.29 0.00 0.00 176.35 176.79 2v1b s GLN 497 N -0.73 0.57 0.60 1.98 -2.07 -0.29 -2.55 119.66 117.17 2v1b s GLN 497 Ca 0.11 0.16 -0.16 0.00 -1.82 0.00 0.00 55.36 53.66 2v1b s GLN 497 Cb -0.11 0.26 -0.03 0.00 -1.09 0.00 0.00 33.01 32.03 2v1b s GLN 497 CO 0.02 -0.13 1.06 -1.25 -1.32 0.00 0.00 175.29 173.67 2v1b s PRO 498 N -0.59 3.30 -0.20 9.60 0.04 -1.26 -1.42 135.00 144.47 2v1b s PRO 498 Ca -0.07 1.19 -0.04 0.00 0.04 0.00 0.00 61.00 62.12 2v1b s PRO 498 Cb -0.04 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 2v1b s PRO 498 CO 0.03 -0.82 -0.03 1.41 0.04 0.00 0.00 177.00 177.63 2v1b s MET 499 N -4.11 3.51 0.06 4.56 1.75 0.09 -4.87 119.30 120.29 2v1b s MET 499 Ca 0.63 -0.57 0.04 0.00 -1.25 0.00 0.00 55.69 54.54 2v1b s MET 499 Cb -0.16 -3.02 -0.04 0.00 2.84 0.00 0.00 34.83 34.45 2v1b s MET 499 CO 0.38 -0.04 0.01 1.03 -0.65 0.00 0.00 175.02 175.74 2v1b s ARG 500 N 1.11 2.67 0.00 4.11 0.52 -1.26 -0.91 118.95 125.19 2v1b s ARG 500 Ca 0.02 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2v1b s ARG 500 Cb -0.15 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.72 2v1b s ARG 500 CO 0.00 0.57 0.00 -0.40 0.02 0.00 0.00 175.30 175.49 2v1b n ASP 501 N 0.78 0.00 0.00 0.23 5.68 -0.36 -4.87 116.55 118.00 2v1b n ASP 501 Ca -0.11 -0.89 0.10 0.00 -0.50 0.00 0.00 54.79 53.38 2v1b n ASP 501 Cb 0.52 0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.94 2v1b n ASP 501 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2v1b n GLN 502 N -0.89 0.07 -0.15 0.11 10.64 -1.26 -1.43 117.38 124.47 2v1b n GLN 502 Ca 0.00 0.15 0.09 0.00 -1.83 0.00 0.00 57.00 55.41 2v1b n GLN 502 Cb 0.00 -1.50 0.17 0.00 -0.86 0.00 0.00 30.24 28.05 2v1b n GLN 502 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2v1b n LYS 503 N -1.44 2.20 -0.84 2.61 4.01 -1.26 -4.99 118.16 118.45 2v1b n LYS 503 Ca 0.06 -2.03 0.00 0.00 -0.51 0.00 0.00 58.31 55.83 2v1b n LYS 503 Cb 0.21 -1.41 0.00 0.00 -0.51 0.00 0.00 35.03 33.32 2v1b n LYS 503 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2v1b n GLY 504 N 1.14 0.79 3.80 0.72 0.00 -0.51 -5.05 105.19 106.07 2v1b n GLY 504 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 2v1b n GLY 504 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2v1b s ASP 505 N -2.63 7.20 -0.00 1.61 1.01 -1.26 -4.68 116.67 117.92 2v1b s ASP 505 Ca 0.00 1.68 -0.30 0.00 0.71 0.00 0.00 52.55 54.64 2v1b s ASP 505 Cb 0.00 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.36 2v1b s ASP 505 CO 0.00 -0.07 1.26 -0.69 0.21 0.00 0.00 175.17 175.88 2v1b s VAL 506 N -1.66 4.00 -0.14 -1.27 1.01 -1.26 -1.23 120.40 119.86 2v1b s VAL 506 Ca 0.49 1.39 0.04 0.00 0.00 0.00 0.00 61.98 63.90 2v1b s VAL 506 Cb -0.17 -3.89 -0.11 0.00 0.00 0.00 0.00 36.38 32.21 2v1b s VAL 506 CO 0.22 0.03 -0.08 1.67 0.00 0.00 0.00 175.10 176.94 2v1b n GLN 507 N 4.85 0.87 -4.17 2.72 7.27 -0.09 -4.93 117.38 123.89 2v1b n GLN 507 Ca 0.11 0.06 -0.11 0.00 0.07 0.00 0.00 57.00 57.13 2v1b n GLN 507 Cb 0.45 -1.30 -0.10 0.00 2.41 0.00 0.00 30.24 31.70 2v1b n GLN 507 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 2v1b s TYR 508 N -2.29 0.99 -0.05 3.69 2.02 -1.18 -4.43 117.35 116.09 2v1b s TYR 508 Ca -0.16 -1.27 0.03 0.00 -0.37 0.00 0.00 57.07 55.30 2v1b s TYR 508 Cb 0.05 -0.53 -0.03 0.00 -0.40 0.00 0.00 41.96 41.05 2v1b s TYR 508 CO 0.38 -0.54 -0.12 -0.06 -1.57 0.00 0.00 175.55 173.64 2v1b s PHE 509 N -4.06 2.76 -0.14 2.71 0.40 -0.94 -0.73 117.98 117.98 2v1b s PHE 509 Ca 0.29 -0.11 -0.02 0.00 -0.60 0.00 0.00 56.93 56.49 2v1b s PHE 509 Cb 0.07 -1.65 -0.03 0.00 0.51 0.00 0.00 43.02 41.93 2v1b s PHE 509 CO 0.05 0.23 -0.05 0.42 0.70 0.00 0.00 175.22 176.57 2v1b s ILE 510 N -0.76 3.75 -0.07 0.64 1.01 -0.51 -1.35 121.20 123.92 2v1b s ILE 510 Ca 0.12 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.38 2v1b s ILE 510 Cb -0.11 -2.62 0.00 0.00 0.01 0.00 0.00 42.46 39.75 2v1b s ILE 510 CO 0.01 0.52 -0.17 -0.83 0.00 0.00 0.00 174.94 174.46 2v1b s GLY 511 N 0.15 0.98 -0.09 6.18 0.00 -0.40 -1.14 107.32 113.01 2v1b s GLY 511 Ca -0.02 -0.66 0.04 0.00 0.00 0.00 0.00 44.72 44.08 2v1b s GLY 511 CO 0.03 -0.17 -0.23 0.14 0.00 0.00 0.00 173.10 172.88 2v1b s VAL 512 N 0.36 2.18 -0.09 1.40 1.01 -0.52 -1.53 120.40 123.22 2v1b s VAL 512 Ca -0.12 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 60.91 2v1b s VAL 512 Cb -0.15 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 2v1b s VAL 512 CO 0.05 0.56 -0.23 -1.10 0.00 0.00 0.00 175.10 174.38 2v1b s GLN 513 N 0.15 2.90 -0.21 2.72 1.11 -0.94 -1.40 119.66 123.99 2v1b s GLN 513 Ca -0.13 -0.86 0.01 0.00 0.01 0.00 0.00 55.36 54.39 2v1b s GLN 513 Cb -0.16 -2.29 0.03 0.00 -1.01 0.00 0.00 33.01 29.58 2v1b s GLN 513 CO 0.07 0.27 -0.16 -1.17 0.01 0.00 0.00 175.29 174.30 2v1b s LEU 514 N 0.14 2.58 0.20 2.90 2.96 -0.03 -4.55 118.68 122.87 2v1b s LEU 514 Ca -0.12 -0.87 -0.19 0.00 -0.22 0.00 0.00 54.13 52.73 2v1b s LEU 514 Cb -0.16 -1.51 -0.08 0.00 0.50 0.00 0.00 46.19 44.94 2v1b s LEU 514 CO 0.07 -0.06 0.68 1.51 -1.32 0.00 0.00 176.35 177.22 2v1b s ASP 515 N 1.24 7.02 0.30 3.68 -4.77 -1.26 -1.20 116.67 121.68 2v1b s ASP 515 Ca 0.01 1.34 -0.03 0.00 -3.30 0.00 0.00 52.55 50.57 2v1b s ASP 515 Cb -0.15 -2.39 -0.01 0.00 -1.09 0.00 0.00 42.92 39.28 2v1b s ASP 515 CO -0.10 0.07 0.38 -0.83 0.70 0.00 0.00 175.17 175.39 2v1b s GLY 516 N -1.62 1.40 0.00 2.12 0.00 -0.08 -4.98 107.32 104.16 2v1b s GLY 516 Ca 0.41 -1.50 0.23 0.00 0.00 0.00 0.00 44.72 43.86 2v1b s GLY 516 CO 0.21 -1.06 1.19 -1.30 0.00 0.00 0.00 173.10 172.13 2v1b n THR 517 N -0.48 0.00 -3.81 0.90 -2.24 -1.26 -1.45 114.28 105.95 2v1b n THR 517 Ca 0.01 -0.09 -0.10 0.00 -2.27 0.00 0.00 64.05 61.61 2v1b n THR 517 Cb 0.63 0.79 -0.06 0.00 -2.10 0.00 0.00 70.33 69.59 2v1b n THR 517 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2v1b s GLU 518 N -2.77 1.12 0.03 -0.78 -1.05 -1.26 -4.77 118.70 109.21 2v1b s GLU 518 Ca 0.14 -0.94 -0.30 0.00 -0.15 0.00 0.00 54.97 53.72 2v1b s GLU 518 Cb 0.17 0.42 -0.07 0.00 -0.44 0.00 0.00 34.13 34.22 2v1b s GLU 518 CO 0.69 -0.42 1.56 -1.58 0.95 0.00 0.00 175.26 176.46 2v1b s HIS 519 N -3.88 2.52 0.20 4.83 5.65 -1.26 -4.85 115.29 118.50 2v1b s HIS 519 Ca 0.09 0.48 0.00 0.00 0.25 0.00 0.00 55.06 55.89 2v1b s HIS 519 Cb 0.02 -3.85 -0.04 0.00 -1.18 0.00 0.00 32.58 27.54 2v1b s HIS 519 CO -0.06 -3.35 0.38 0.14 -0.65 0.00 0.00 174.74 171.20 2v1b s VAL 520 N 2.74 5.23 0.25 0.89 -7.23 -1.26 -5.09 120.40 115.92 2v1b s VAL 520 Ca 0.70 -0.48 -0.04 0.00 -1.81 0.00 0.00 61.98 60.35 2v1b s VAL 520 Cb -0.36 -3.75 -0.02 0.00 0.56 0.00 0.00 36.38 32.81 2v1b s VAL 520 CO 0.30 -0.20 0.31 0.00 -0.31 0.00 0.00 175.10 175.20 2v1b s ARG 521 N -3.43 1.48 4.03 4.82 1.70 -1.26 -4.68 118.95 121.61 2v1b s ARG 521 Ca 0.37 -1.56 0.00 0.00 -0.47 0.00 0.00 55.73 54.07 2v1b s ARG 521 Cb -0.11 0.37 0.00 0.00 -0.57 0.00 0.00 34.95 34.64 2v1b s ARG 521 CO 0.29 -0.56 0.00 -0.25 -1.08 0.00 0.00 175.30 173.70 2v1b n ASP 522 N -0.61 0.00 -0.24 -2.89 8.00 -1.26 -2.35 116.55 117.20 2v1b n ASP 522 Ca 0.01 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.44 2v1b n ASP 522 Cb 0.64 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.78 2v1b n ASP 522 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2v1b h ALA 523 N -0.50 0.89 -0.72 2.24 0.00 -1.99 -1.30 119.26 117.88 2v1b h ALA 523 Ca 0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2v1b h ALA 523 Cb 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2v1b h ALA 523 CO 0.00 0.62 0.25 0.00 0.00 0.00 0.00 179.25 180.12 2v1b h ALA 524 N 1.07 1.09 -0.12 0.00 0.00 -1.90 -0.41 119.26 118.98 2v1b h ALA 524 Ca 0.21 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2v1b h ALA 524 Cb 0.38 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2v1b h ALA 524 CO 0.00 0.63 0.03 1.49 0.00 0.00 0.00 179.25 181.41 2v1b h GLU 525 N 1.06 0.19 -0.31 0.00 4.81 -1.13 -1.32 114.58 117.88 2v1b h GLU 525 Ca 0.24 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.44 2v1b h GLU 525 Cb 0.25 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2v1b h GLU 525 CO -0.01 0.36 0.16 -0.09 -0.73 0.00 0.00 179.01 178.70 2v1b h ARG 526 N -0.01 0.33 -0.26 1.92 9.65 -0.99 0.11 114.38 125.13 2v1b h ARG 526 Ca 0.04 -0.02 -0.09 0.00 -1.10 0.00 0.00 59.98 58.81 2v1b h ARG 526 Cb 0.25 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.75 2v1b h ARG 526 CO 0.00 0.22 -0.22 0.93 2.80 0.00 0.00 179.97 183.70 2v1b h GLU 527 N 0.34 0.48 -0.29 0.20 5.08 -1.05 -0.84 114.58 118.50 2v1b h GLU 527 Ca 0.12 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2v1b h GLU 527 Cb 0.03 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2v1b h GLU 527 CO -0.08 0.67 0.12 0.78 -1.00 0.00 0.00 179.01 179.50 2v1b h GLY 528 N 0.99 0.46 1.33 -3.84 0.00 -0.75 -2.22 103.07 99.04 2v1b h GLY 528 Ca 0.07 -0.25 -0.13 0.00 0.00 0.00 0.00 47.33 47.02 2v1b h GLY 528 CO 0.04 0.23 -0.32 -2.08 0.00 0.00 0.00 176.54 174.42 2v1b h VAL 529 N 0.31 1.28 -0.53 4.60 2.07 -0.76 -1.17 116.25 122.06 2v1b h VAL 529 Ca 0.10 -1.47 0.08 0.00 0.82 0.00 0.00 66.70 66.23 2v1b h VAL 529 Cb 0.17 1.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 2v1b h VAL 529 CO -0.01 0.48 0.18 0.24 0.02 0.00 0.00 177.57 178.49 2v1b h MET 530 N 0.64 0.35 -0.04 1.57 2.07 -1.00 -1.06 114.93 117.45 2v1b h MET 530 Ca 0.07 -0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 57.67 2v1b h MET 530 Cb 0.85 -0.08 -0.00 0.00 -1.87 0.00 0.00 31.60 30.50 2v1b h MET 530 CO 0.07 0.23 -0.00 1.25 1.07 0.00 0.00 176.91 179.53 2v1b h LEU 531 N 0.36 0.07 -0.99 1.22 5.85 -1.01 -2.15 115.31 118.66 2v1b h LEU 531 Ca 0.26 -0.32 -0.11 0.00 0.84 0.00 0.00 57.88 58.56 2v1b h LEU 531 Cb 0.29 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2v1b h LEU 531 CO -0.27 0.37 -0.46 0.16 -0.34 0.00 0.00 178.44 177.90 2v1b h ILE 532 N -0.23 1.33 -0.16 4.05 3.07 -1.10 -0.85 117.51 123.62 2v1b h ILE 532 Ca 0.01 -1.61 -0.10 0.00 1.55 0.00 0.00 64.86 64.72 2v1b h ILE 532 Cb 0.33 1.81 0.00 0.00 -0.27 0.00 0.00 36.82 38.70 2v1b h ILE 532 CO 0.00 0.47 -0.28 0.50 -1.05 0.00 0.00 178.15 177.79 2v1b h LYS 533 N 0.09 0.46 -0.81 0.16 1.63 -1.18 -1.33 116.57 115.59 2v1b h LYS 533 Ca 0.00 -0.29 0.04 0.00 -0.85 0.00 0.00 60.65 59.56 2v1b h LYS 533 Cb 0.85 0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 32.46 2v1b h LYS 533 CO 0.06 0.89 0.51 -0.22 -3.45 0.00 0.00 179.45 177.24 2v1b h LYS 534 N 0.09 0.93 -0.44 1.90 1.63 -1.21 -1.82 116.57 117.65 2v1b h LYS 534 Ca 0.01 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.72 2v1b h LYS 534 Cb 0.86 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 32.26 2v1b h LYS 534 CO 0.06 0.62 0.16 1.15 -3.45 0.00 0.00 179.45 177.99 2v1b h THR 535 N 0.96 1.21 -0.99 1.00 2.02 -1.11 -1.97 112.91 114.03 2v1b h THR 535 Ca 0.34 -0.67 0.06 0.00 0.77 0.00 0.00 66.41 66.90 2v1b h THR 535 Cb 0.08 0.82 -0.06 0.00 -1.74 0.00 0.00 68.15 67.25 2v1b h THR 535 CO -0.14 0.24 0.64 0.00 0.37 0.00 0.00 175.52 176.64 2v1b h ALA 536 N 1.01 1.36 -0.72 6.16 0.00 -0.71 -1.01 119.26 125.35 2v1b h ALA 536 Ca 0.15 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2v1b h ALA 536 Cb 0.22 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2v1b h ALA 536 CO -0.01 0.46 0.19 0.93 0.00 0.00 0.00 179.25 180.82 2v1b h GLU 537 N 1.18 1.14 -0.74 0.00 5.08 -0.88 0.08 114.58 120.44 2v1b h GLU 537 Ca 0.42 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 2v1b h GLU 537 Cb 0.13 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 2v1b h GLU 537 CO -0.16 0.99 0.27 -0.97 -1.00 0.00 0.00 179.01 178.14 2v1b h ASN 538 N 1.08 1.04 0.17 1.42 -1.24 -0.62 -2.16 115.58 115.27 2v1b h ASN 538 Ca 0.23 -0.19 -0.16 0.00 0.71 0.00 0.00 56.30 56.90 2v1b h ASN 538 Cb 0.35 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.12 2v1b h ASN 538 CO -0.00 0.94 -0.58 0.40 -1.29 0.00 0.00 177.43 176.90 2v1b h ILE 539 N 1.07 1.35 -0.46 2.57 1.08 -0.92 -1.38 117.51 120.82 2v1b h ILE 539 Ca 0.24 -1.88 0.04 0.00 -0.39 0.00 0.00 64.86 62.87 2v1b h ILE 539 Cb 0.25 1.88 -0.04 0.00 -3.07 0.00 0.00 36.82 35.84 2v1b h ILE 539 CO -0.02 0.57 0.23 -0.78 -0.69 0.00 0.00 178.15 177.47 2v1b h ASP 540 N 0.32 0.33 -0.32 1.72 1.82 -0.75 0.19 116.42 119.73 2v1b h ASP 540 Ca -0.00 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.65 2v1b h ASP 540 Cb 1.11 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 41.07 2v1b h ASP 540 CO 0.10 0.23 0.16 -0.33 -1.61 0.00 0.00 179.24 177.79 2v1b h GLU 541 N 0.46 0.46 -0.70 0.28 4.39 -1.11 -2.65 114.58 115.72 2v1b h GLU 541 Ca 0.20 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.86 2v1b h GLU 541 Cb 0.11 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.63 2v1b h GLU 541 CO -0.14 0.43 0.44 0.00 -1.16 0.00 0.00 179.01 178.57 2v1b h ALA 542 N 1.01 0.91 0.00 3.43 0.00 -0.78 -3.03 119.26 120.81 2v1b h ALA 542 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2v1b h ALA 542 Cb 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2v1b h ALA 542 CO -0.01 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.46 2v1b h ALA 543 N 1.30 1.00 -0.52 0.00 0.00 -0.46 -3.24 119.26 117.33 2v1b h ALA 543 Ca 0.28 0.00 0.15 0.00 0.00 0.00 0.00 54.91 55.34 2v1b h ALA 543 Cb 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2v1b h ALA 543 CO -0.10 0.00 0.42 0.87 0.00 0.00 0.00 179.25 180.44 2v1b h LYS 544 N 0.00 0.00 -0.61 0.00 1.57 -1.34 -1.69 116.57 114.50 2v1b h LYS 544 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2v1b h LYS 544 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 2v1b h LYS 544 CO 0.00 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.27 2v1b n GLU 545 N -4.12 4.20 0.00 3.15 -0.58 -1.22 -5.15 120.64 116.91 2v1b n GLU 545 Ca 0.10 -3.01 0.15 0.00 -0.42 0.00 0.00 57.16 53.98 2v1b n GLU 545 Cb 0.64 -2.04 0.91 0.00 -0.57 0.00 0.00 31.44 30.38 2v1b n GLU 545 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93