#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7c n HIS 389 N 0.00 -0.43 -4.15 1.24 8.25 -1.26 -5.08 115.22 113.79 1l7c n HIS 389 Ca 0.00 0.15 -0.17 0.00 -0.26 0.00 0.00 57.72 57.44 1l7c n HIS 389 Cb 0.00 -1.61 -0.12 0.00 1.12 0.00 0.00 29.99 29.38 1l7c n HIS 389 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1l7c s VAL 390 N -3.01 0.99 0.30 1.59 -7.23 -1.26 -5.17 120.40 106.61 1l7c s VAL 390 Ca 0.09 -1.32 0.09 0.00 -1.81 0.00 0.00 61.98 59.03 1l7c s VAL 390 Cb -0.04 -1.03 -0.04 0.00 0.56 0.00 0.00 36.38 35.82 1l7c s VAL 390 CO 0.11 -0.30 0.05 -0.94 -0.31 0.00 0.00 175.10 173.70 1l7c s SER 391 N -1.82 4.55 0.33 4.85 1.04 -1.26 -5.00 113.70 116.38 1l7c s SER 391 Ca -0.02 -0.73 0.03 0.00 0.48 0.00 0.00 55.95 55.70 1l7c s SER 391 Cb -0.09 -0.77 0.62 0.00 0.10 0.00 0.00 66.02 65.89 1l7c s SER 391 CO 0.02 -0.13 1.95 0.44 0.98 0.00 0.00 173.24 176.49 1l7c h ASP 392 N 1.76 0.79 -0.94 7.02 3.32 -2.00 -1.52 116.42 124.84 1l7c h ASP 392 Ca -0.44 -0.00 0.28 0.00 0.02 0.00 0.00 57.03 56.89 1l7c h ASP 392 Cb 1.25 -0.17 -0.15 0.00 0.22 0.00 0.00 39.33 40.47 1l7c h ASP 392 CO 0.62 0.52 0.32 -1.28 -1.72 0.00 0.00 179.24 177.70 1l7c h SER 393 N 0.90 0.08 0.04 6.45 0.87 -1.98 0.47 113.55 120.39 1l7c h SER 393 Ca 0.33 0.22 -0.05 0.00 -1.23 0.00 0.00 61.79 61.06 1l7c h SER 393 Cb 0.16 0.27 0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1l7c h SER 393 CO -0.11 -0.22 -0.23 0.15 -0.53 0.00 0.00 176.83 175.89 1l7c h PHE 394 N 0.18 0.16 0.10 2.24 3.57 -1.69 -3.26 116.94 118.23 1l7c h PHE 394 Ca 0.64 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 62.02 1l7c h PHE 394 Cb 1.40 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.14 1l7c h PHE 394 CO -0.21 1.07 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.82 1l7c h LEU 395 N -0.80 -0.11 -0.24 0.59 3.38 -0.86 -3.29 115.31 113.98 1l7c h LEU 395 Ca -0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1l7c h LEU 395 Cb 1.16 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1l7c h LEU 395 CO 0.04 -0.06 0.00 1.05 0.09 0.00 0.00 178.44 179.56 1l7c h GLU 396 N -0.15 0.00 -6.86 1.13 4.11 -0.29 -3.46 114.58 109.07 1l7c h GLU 396 Ca -0.01 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.87 1l7c h GLU 396 Cb 0.12 0.00 0.10 0.00 0.50 0.00 0.00 28.75 29.47 1l7c h GLU 396 CO 0.02 0.00 0.74 -2.37 0.07 0.00 0.00 179.01 177.47 1l7c n THR 397 N -3.09 1.75 -0.01 -1.06 5.66 -1.23 -4.89 114.28 111.41 1l7c n THR 397 Ca 0.03 -0.44 0.00 0.00 -3.05 0.00 0.00 64.05 60.60 1l7c n THR 397 Cb 0.49 -1.88 0.01 0.00 -1.55 0.00 0.00 70.33 67.41 1l7c n THR 397 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1l7c n ASN 398 N 0.95 1.95 -0.21 1.09 3.02 -1.26 -4.80 115.26 115.99 1l7c n ASN 398 Ca 0.04 -1.90 0.02 0.00 -0.03 0.00 0.00 54.58 52.71 1l7c n ASN 398 Cb 0.38 -0.01 0.12 0.00 -0.61 0.00 0.00 39.78 39.65 1l7c n ASN 398 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1l7c h VAL 399 N 0.13 0.54 -0.90 2.41 2.07 -1.99 0.15 116.25 118.66 1l7c h VAL 399 Ca 0.00 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1l7c h VAL 399 Cb 0.46 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 1l7c h VAL 399 CO 0.00 0.04 0.54 -0.65 0.02 0.00 0.00 177.57 177.52 1l7c h PRO 400 N 0.19 1.23 0.71 1.57 0.11 -1.96 0.63 132.00 134.49 1l7c h PRO 400 Ca 0.34 -0.11 -0.03 0.00 0.11 0.00 0.00 66.00 66.30 1l7c h PRO 400 Cb 0.55 -0.26 0.01 0.00 0.11 0.00 0.00 31.00 31.41 1l7c h PRO 400 CO -0.48 0.86 -0.34 1.25 -0.21 0.00 0.00 178.00 179.08 1l7c h LEU 401 N 1.25 -0.80 -0.54 2.35 5.85 -1.42 0.90 115.31 122.89 1l7c h LEU 401 Ca 0.32 0.03 0.11 0.00 0.84 0.00 0.00 57.88 59.18 1l7c h LEU 401 Cb -0.05 0.21 -0.11 0.00 0.37 0.00 0.00 40.66 41.09 1l7c h LEU 401 CO -0.06 -0.54 -0.19 -0.07 -0.34 0.00 0.00 178.44 177.24 1l7c h LEU 402 N -1.02 -0.68 -1.07 2.25 3.38 -0.67 0.27 115.31 117.78 1l7c h LEU 402 Ca -0.10 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1l7c h LEU 402 Cb 0.73 0.40 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 1l7c h LEU 402 CO 0.16 -0.23 0.42 0.58 0.09 0.00 0.00 178.44 179.46 1l7c h VAL 403 N -0.06 1.23 0.15 1.22 2.07 -0.84 -0.07 116.25 119.95 1l7c h VAL 403 Ca 0.26 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 1l7c h VAL 403 Cb 0.46 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1l7c h VAL 403 CO -0.59 0.26 -0.07 0.25 0.02 0.00 0.00 177.57 177.43 1l7c h LEU 404 N 1.08 -0.17 -1.70 2.57 5.85 0.14 -1.95 115.31 121.13 1l7c h LEU 404 Ca 0.27 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.04 1l7c h LEU 404 Cb 0.03 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1l7c h LEU 404 CO -0.04 -0.11 0.31 0.40 -0.34 0.00 0.00 178.44 178.66 1l7c h ILE 405 N -0.22 0.96 -0.12 4.05 2.04 0.00 -1.95 117.51 122.27 1l7c h ILE 405 Ca -0.02 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 1l7c h ILE 405 Cb 0.17 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1l7c h ILE 405 CO 0.03 0.07 0.00 -0.08 0.00 0.00 0.00 178.15 178.17 1l7c h GLU 406 N 0.38 0.21 0.20 2.37 4.57 -0.39 -0.42 114.58 121.51 1l7c h GLU 406 Ca 0.20 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 1l7c h GLU 406 Cb 0.31 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1l7c h GLU 406 CO -0.05 0.45 -0.15 0.00 -1.18 0.00 0.00 179.01 178.08 1l7c h ALA 407 N 0.75 -0.94 -1.13 2.92 0.00 -0.75 -2.07 119.26 118.03 1l7c h ALA 407 Ca 0.03 -0.07 0.37 0.00 0.00 0.00 0.00 54.91 55.25 1l7c h ALA 407 Cb 0.36 0.33 -0.14 0.00 0.00 0.00 0.00 17.79 18.33 1l7c h ALA 407 CO 0.01 -0.94 0.69 0.00 0.00 0.00 0.00 179.25 179.01 1l7c h ALA 408 N -1.59 2.33 -0.50 0.00 0.00 -1.44 1.08 119.26 119.14 1l7c h ALA 408 Ca -0.03 0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1l7c h ALA 408 Cb 0.28 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1l7c h ALA 408 CO 0.01 -0.94 0.33 -0.22 0.00 0.00 0.00 179.25 178.43 1l7c h LYS 409 N 0.20 0.34 -1.28 0.00 3.64 -0.37 -2.50 116.57 116.61 1l7c h LYS 409 Ca 0.76 -0.02 -0.59 0.00 -1.27 0.00 0.00 60.65 59.53 1l7c h LYS 409 Cb 2.07 -0.08 -0.41 0.00 -0.41 0.00 0.00 32.23 33.41 1l7c h LYS 409 CO -0.50 0.23 -0.55 0.27 -2.27 0.00 0.00 179.45 176.62 1l7c n ASN 410 N -4.47 5.13 -1.63 4.20 0.23 0.37 -4.80 115.26 114.29 1l7c n ASN 410 Ca 0.07 -3.74 -0.01 0.00 -0.53 0.00 0.00 54.58 50.37 1l7c n ASN 410 Cb 0.31 -0.49 -0.00 0.00 -2.08 0.00 0.00 39.78 37.51 1l7c n ASN 410 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1l7c n GLY 411 N -0.58 -0.13 3.25 4.83 0.00 -0.95 -4.80 105.19 106.81 1l7c n GLY 411 Ca 0.43 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.03 1l7c n GLY 411 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1l7c n ASN 412 N -0.12 4.34 -0.31 1.61 2.85 -1.15 -4.76 115.26 117.72 1l7c n ASN 412 Ca -0.01 -2.87 0.20 0.00 -0.11 0.00 0.00 54.58 51.79 1l7c n ASN 412 Cb 0.23 -1.69 0.47 0.00 1.24 0.00 0.00 39.78 40.04 1l7c n ASN 412 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1l7c h GLU 413 N 7.14 0.45 0.36 1.20 4.39 -1.88 -1.43 114.58 124.81 1l7c h GLU 413 Ca 0.48 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 60.13 1l7c h GLU 413 Cb 0.78 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1l7c h GLU 413 CO 1.62 0.30 -0.18 -0.22 -1.16 0.00 0.00 179.01 179.38 1l7c h LYS 414 N 0.46 -0.47 -0.23 2.33 3.64 -2.00 -2.78 116.57 117.52 1l7c h LYS 414 Ca 0.57 0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.98 1l7c h LYS 414 Cb 1.34 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.25 1l7c h LYS 414 CO -0.30 -0.31 0.14 1.05 -2.27 0.00 0.00 179.45 177.76 1l7c h GLU 415 N -0.49 0.31 -0.52 1.90 4.11 -1.93 -2.02 114.58 115.93 1l7c h GLU 415 Ca -0.05 -0.02 0.08 0.00 0.07 0.00 0.00 59.36 59.44 1l7c h GLU 415 Cb 0.38 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 1l7c h GLU 415 CO 0.08 0.22 0.15 0.28 0.07 0.00 0.00 179.01 179.80 1l7c h VAL 416 N 0.31 0.76 0.00 -1.06 2.07 -1.24 0.91 116.25 118.00 1l7c h VAL 416 Ca 0.08 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 1l7c h VAL 416 Cb -0.01 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1l7c h VAL 416 CO -0.02 0.06 -0.02 0.50 0.02 0.00 0.00 177.57 178.11 1l7c h LYS 417 N 0.30 0.00 0.04 1.57 1.63 -1.08 0.16 116.57 119.19 1l7c h LYS 417 Ca 0.26 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.06 1l7c h LYS 417 Cb 0.32 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.95 1l7c h LYS 417 CO -0.30 0.02 -0.02 0.93 -3.45 0.00 0.00 179.45 176.63 1l7c h GLU 418 N 0.00 -0.06 -0.23 1.90 5.08 -0.14 -3.21 114.58 117.93 1l7c h GLU 418 Ca -0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1l7c h GLU 418 Cb 0.59 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1l7c h GLU 418 CO 0.00 0.58 -0.25 1.88 -1.00 0.00 0.00 179.01 180.23 1l7c h TYR 419 N -0.81 0.47 -0.91 4.33 0.99 0.81 -2.59 116.97 119.27 1l7c h TYR 419 Ca -0.01 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.63 1l7c h TYR 419 Cb 0.67 -0.12 -0.04 0.00 1.00 0.00 0.00 36.73 38.23 1l7c h TYR 419 CO 0.16 0.64 0.58 0.00 -0.00 0.00 0.00 178.16 179.54 1l7c h ALA 420 N 1.36 1.32 -0.44 3.88 0.00 -0.79 0.18 119.26 124.77 1l7c h ALA 420 Ca 0.06 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1l7c h ALA 420 Cb 0.64 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1l7c h ALA 420 CO 0.05 0.62 -0.26 0.37 0.00 0.00 0.00 179.25 180.03 1l7c h GLN 421 N 1.24 0.93 -0.23 0.00 4.15 -1.48 -1.15 115.11 118.56 1l7c h GLN 421 Ca 0.33 -0.41 -0.09 0.00 0.77 0.00 0.00 58.65 59.25 1l7c h GLN 421 Cb -0.11 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.55 1l7c h GLN 421 CO -0.07 1.07 -0.20 0.28 -1.93 0.00 0.00 178.83 177.98 1l7c h VAL 422 N 0.80 1.32 0.10 2.39 2.07 -1.04 -0.28 116.25 121.61 1l7c h VAL 422 Ca 0.10 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 66.27 1l7c h VAL 422 Cb 0.83 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 32.23 1l7c h VAL 422 CO 0.07 0.42 -0.50 0.15 0.02 0.00 0.00 177.57 177.73 1l7c h PHE 423 N 0.25 -1.45 -0.34 1.57 3.57 -0.58 0.18 116.94 120.15 1l7c h PHE 423 Ca 0.04 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.65 1l7c h PHE 423 Cb 0.75 0.62 -0.07 0.00 2.79 0.00 0.00 35.95 40.04 1l7c h PHE 423 CO 0.07 -0.56 -0.12 -0.09 -2.23 0.00 0.00 178.31 175.39 1l7c h ARG 424 N -0.70 -0.05 -0.92 1.11 2.43 -1.15 0.14 114.38 115.24 1l7c h ARG 424 Ca -0.00 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.26 1l7c h ARG 424 Cb 0.71 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.20 1l7c h ARG 424 CO -0.28 -0.03 0.59 0.93 -1.51 0.00 0.00 179.97 179.67 1l7c h GLU 425 N -0.05 0.91 -0.39 0.20 5.08 -0.67 -0.26 114.58 119.39 1l7c h GLU 425 Ca 0.17 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.39 1l7c h GLU 425 Cb 0.30 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1l7c h GLU 425 CO -0.37 0.60 -0.06 1.25 -1.00 0.00 0.00 179.01 179.42 1l7c h HIS 426 N 0.94 0.82 -0.68 4.33 2.76 0.11 -2.41 115.15 121.02 1l7c h HIS 426 Ca 0.42 -0.17 -0.05 0.00 -2.20 0.00 0.00 60.37 58.37 1l7c h HIS 426 Cb 0.38 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.11 1l7c h HIS 426 CO -0.00 0.86 0.23 0.00 -1.30 0.00 0.00 177.93 177.71 1l7c h ALA 427 N 0.85 0.89 -0.64 5.26 0.00 0.26 -0.94 119.26 124.94 1l7c h ALA 427 Ca 0.10 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1l7c h ALA 427 Cb 0.57 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1l7c h ALA 427 CO 0.03 0.56 0.22 -0.91 0.00 0.00 0.00 179.25 179.15 1l7c h ASN 428 N 0.99 0.92 -0.60 0.00 2.35 -0.99 0.11 115.58 118.37 1l7c h ASN 428 Ca 0.22 -0.20 -0.07 0.00 -0.55 0.00 0.00 56.30 55.71 1l7c h ASN 428 Cb 0.28 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 1l7c h ASN 428 CO -0.01 0.87 0.12 0.50 -1.65 0.00 0.00 177.43 177.26 1l7c h LYS 429 N 0.92 0.97 -0.72 0.81 1.63 -1.25 0.18 116.57 119.11 1l7c h LYS 429 Ca 0.21 -0.25 0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1l7c h LYS 429 Cb 0.26 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.74 1l7c h LYS 429 CO -0.01 0.91 0.48 1.25 -3.45 0.00 0.00 179.45 178.63 1l7c h LEU 430 N 0.88 0.82 -0.66 5.20 5.85 -0.60 0.27 115.31 127.07 1l7c h LEU 430 Ca 0.18 -0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.75 1l7c h LEU 430 Cb 0.39 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1l7c h LEU 430 CO 0.01 0.59 -0.45 0.40 -0.34 0.00 0.00 178.44 178.65 1l7c h ILE 431 N 0.97 1.31 -0.22 4.05 2.04 -0.26 -1.14 117.51 124.27 1l7c h ILE 431 Ca 0.27 -1.64 -0.09 0.00 1.00 0.00 0.00 64.86 64.41 1l7c h ILE 431 Cb -0.10 1.64 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1l7c h ILE 431 CO -0.06 0.51 -0.20 -0.33 0.00 0.00 0.00 178.15 178.07 1l7c h GLU 432 N 0.42 0.51 -0.25 2.37 5.08 -0.08 0.33 114.58 122.97 1l7c h GLU 432 Ca 0.03 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1l7c h GLU 432 Cb 0.95 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 1l7c h GLU 432 CO 0.08 0.84 0.10 0.28 -1.00 0.00 0.00 179.01 179.32 1l7c h VAL 433 N 0.20 0.97 -0.67 3.13 2.07 -0.43 -1.15 116.25 120.36 1l7c h VAL 433 Ca 0.04 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.54 1l7c h VAL 433 Cb 0.74 0.72 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 1l7c h VAL 433 CO 0.05 0.04 0.37 0.00 0.02 0.00 0.00 177.57 178.06 1l7c h ALA 434 N 1.14 0.90 -0.85 1.67 0.00 -1.09 -1.78 119.26 119.25 1l7c h ALA 434 Ca 0.10 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1l7c h ALA 434 Cb 0.05 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1l7c h ALA 434 CO -0.09 0.05 0.52 -0.91 0.00 0.00 0.00 179.25 178.82 1l7c h ASN 435 N 0.69 0.80 -0.34 0.00 2.35 0.17 -2.34 115.58 116.90 1l7c h ASN 435 Ca 0.30 0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 56.04 1l7c h ASN 435 Cb 0.19 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1l7c h ASN 435 CO -0.19 0.50 0.05 -0.07 -1.65 0.00 0.00 177.43 176.08 1l7c h LEU 436 N 0.93 0.54 -1.10 1.61 3.38 -0.57 -2.76 115.31 117.34 1l7c h LEU 436 Ca 0.38 -0.26 0.18 0.00 0.09 0.00 0.00 57.88 58.27 1l7c h LEU 436 Cb 0.21 -0.14 -0.10 0.00 0.09 0.00 0.00 40.66 40.72 1l7c h LEU 436 CO -0.19 0.67 0.61 0.00 0.09 0.00 0.00 178.44 179.62 1l7c h ALA 437 N 0.90 1.75 0.46 1.53 0.00 -0.84 -2.72 119.26 120.34 1l7c h ALA 437 Ca 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1l7c h ALA 437 Cb 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1l7c h ALA 437 CO 0.01 -0.09 -0.22 0.00 0.00 0.00 0.00 179.25 178.94 1l7c h SER 439 N -0.97 -1.05 1.22 0.00 4.64 -1.24 0.41 113.55 116.56 1l7c h SER 439 Ca -0.06 0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1l7c h SER 439 Cb 0.58 0.63 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1l7c h SER 439 CO 0.10 -0.30 0.00 0.16 -0.87 0.00 0.00 176.83 175.92 1l7c h ILE 440 N -0.01 0.00 -4.01 0.95 3.07 -1.64 -3.46 117.51 112.42 1l7c h ILE 440 Ca 0.41 -0.42 -0.45 0.00 1.55 0.00 0.00 64.86 65.94 1l7c h ILE 440 Cb 0.65 1.33 -0.02 0.00 -0.27 0.00 0.00 36.82 38.51 1l7c h ILE 440 CO -0.95 0.00 0.35 -0.55 -1.05 0.00 0.00 178.15 175.94 1l7c s SER 441 N -4.59 7.02 -0.05 2.16 0.15 0.15 -4.98 113.70 113.56 1l7c s SER 441 Ca 0.08 1.76 0.18 0.00 0.70 0.00 0.00 55.95 58.66 1l7c s SER 441 Cb 0.11 -2.55 -0.27 0.00 -1.71 0.00 0.00 66.02 61.59 1l7c s SER 441 CO 0.53 -0.30 0.35 -3.20 1.20 0.00 0.00 173.24 171.81 1l7c n ASN 442 N -0.29 0.86 -4.57 5.45 4.05 -1.26 -4.93 115.26 114.56 1l7c n ASN 442 Ca 0.06 0.00 -0.40 0.00 0.45 0.00 0.00 54.58 54.68 1l7c n ASN 442 Cb 0.53 1.69 -0.03 0.00 1.23 0.00 0.00 39.78 43.20 1l7c n ASN 442 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 1l7c s ASN 443 N -4.23 5.41 0.07 1.20 3.84 -1.26 -4.91 114.94 115.06 1l7c s ASN 443 Ca -0.07 0.97 -0.33 0.00 0.21 0.00 0.00 52.86 53.64 1l7c s ASN 443 Cb 0.11 -2.52 -0.16 0.00 -0.55 0.00 0.00 41.25 38.12 1l7c s ASN 443 CO 0.74 -2.15 1.50 -0.08 -2.79 0.00 0.00 177.10 174.33 1l7c h GLU 444 N 14.81 -0.96 -0.80 0.43 4.57 -2.00 -1.38 114.58 129.24 1l7c h GLU 444 Ca -0.30 0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 57.90 1l7c h GLU 444 Cb 1.19 0.22 -0.04 0.00 -0.16 0.00 0.00 28.75 29.96 1l7c h GLU 444 CO 1.11 -0.64 0.33 0.93 -1.18 0.00 0.00 179.01 179.57 1l7c h GLU 445 N -1.00 1.18 -0.93 1.92 4.39 -2.00 -2.02 114.58 116.13 1l7c h GLU 445 Ca -0.08 -0.20 0.06 0.00 0.34 0.00 0.00 59.36 59.48 1l7c h GLU 445 Cb 0.83 -0.20 -0.06 0.00 -0.10 0.00 0.00 28.75 29.22 1l7c h GLU 445 CO 0.02 0.94 0.61 0.78 -1.16 0.00 0.00 179.01 180.20 1l7c h GLY 446 N 1.17 1.37 1.00 -3.84 0.00 -1.93 -1.30 103.07 99.53 1l7c h GLY 446 Ca 0.27 -0.44 -0.16 0.00 0.00 0.00 0.00 47.33 47.00 1l7c h GLY 446 CO -0.02 0.32 -0.52 -2.08 0.00 0.00 0.00 176.54 174.24 1l7c h VAL 447 N 1.09 1.32 -0.10 4.60 2.07 -0.90 -2.75 116.25 121.57 1l7c h VAL 447 Ca 0.40 -1.76 0.04 0.00 0.82 0.00 0.00 66.70 66.20 1l7c h VAL 447 Cb 0.16 1.93 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 1l7c h VAL 447 CO -0.15 0.55 -0.32 0.11 0.02 0.00 0.00 177.57 177.79 1l7c h LYS 448 N 0.36 -0.39 -0.70 1.57 1.57 -0.78 0.35 116.57 118.55 1l7c h LYS 448 Ca -0.01 0.03 0.15 0.00 -1.87 0.00 0.00 60.65 58.94 1l7c h LYS 448 Cb 1.14 0.09 -0.10 0.00 0.08 0.00 0.00 32.23 33.44 1l7c h LYS 448 CO 0.11 -0.26 0.17 1.25 -0.57 0.00 0.00 179.45 180.15 1l7c h LEU 449 N -0.41 0.02 -0.51 2.94 5.85 -1.25 -0.56 115.31 121.40 1l7c h LEU 449 Ca 0.09 0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1l7c h LEU 449 Cb 0.54 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1l7c h LEU 449 CO -0.33 -0.02 0.21 0.58 -0.34 0.00 0.00 178.44 178.54 1l7c h VAL 450 N 0.28 1.21 0.00 1.05 2.07 -0.87 0.25 116.25 120.25 1l7c h VAL 450 Ca 0.39 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1l7c h VAL 450 Cb 0.64 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1l7c h VAL 450 CO -0.48 0.25 0.00 0.54 0.02 0.00 0.00 177.57 177.90 1l7c n ARG 451 N -4.55 0.00 0.00 1.57 5.12 0.11 -0.10 116.66 118.81 1l7c n ARG 451 Ca 0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.94 1l7c n ARG 451 Cb 0.15 -1.00 0.00 0.00 -1.16 0.00 0.00 32.46 30.46 1l7c n ARG 451 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1l7c n SER 453 N -0.30 0.00 -0.05 0.55 2.88 0.08 -0.32 113.62 116.45 1l7c n SER 453 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 1l7c n SER 453 Cb 0.00 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 63.52 1l7c n SER 453 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1l7c h ALA 454 N 0.00 0.77 0.40 -1.46 0.00 -0.72 -2.82 119.26 115.42 1l7c h ALA 454 Ca 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1l7c h ALA 454 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1l7c h ALA 454 CO 0.00 0.65 -0.19 0.77 0.00 0.00 0.00 179.25 180.48 1l7c h SER 455 N 0.59 -0.45 -0.39 0.00 0.02 -0.91 -2.34 113.55 110.07 1l7c h SER 455 Ca 0.05 -0.07 0.11 0.00 -0.84 0.00 0.00 61.79 61.05 1l7c h SER 455 Cb 0.91 0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.55 1l7c h SER 455 CO 0.08 -0.21 0.38 1.56 -1.14 0.00 0.00 176.83 177.51 1l7c h GLN 456 N -0.69 0.00 -0.11 3.45 4.20 -1.82 0.35 115.11 120.50 1l7c h GLN 456 Ca -0.05 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.42 1l7c h GLN 456 Cb 0.49 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.28 1l7c h GLN 456 CO 0.09 0.00 -0.85 -0.07 -0.67 0.00 0.00 178.83 177.33 1l7c h LEU 457 N 0.00 0.89 -0.06 1.46 3.38 -1.18 -1.86 115.31 117.94 1l7c h LEU 457 Ca 0.18 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1l7c h LEU 457 Cb 0.95 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 1l7c h LEU 457 CO -0.00 1.41 0.04 -0.33 0.09 0.00 0.00 178.44 179.65 1l7c h GLU 458 N 0.48 0.08 -0.42 1.13 5.08 0.15 0.45 114.58 121.52 1l7c h GLU 458 Ca -0.07 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1l7c h GLU 458 Cb 1.48 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.69 1l7c h GLU 458 CO 0.17 0.07 0.27 0.00 -1.00 0.00 0.00 179.01 178.52 1l7c h ALA 459 N 1.00 0.53 -0.37 3.43 0.00 -1.20 -3.07 119.26 119.58 1l7c h ALA 459 Ca 0.02 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1l7c h ALA 459 Cb 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1l7c h ALA 459 CO -0.00 -0.02 -0.30 -0.07 0.00 0.00 0.00 179.25 178.85 1l7c h LEU 460 N 0.56 0.84 -0.13 0.00 3.38 -1.16 -3.36 115.31 115.44 1l7c h LEU 460 Ca 0.16 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1l7c h LEU 460 Cb -0.05 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1l7c h LEU 460 CO -0.04 1.08 -0.08 0.00 0.09 0.00 0.00 178.44 179.49 1l7c h PRO 462 N -0.01 0.24 -1.01 0.00 0.11 -1.72 0.17 132.00 129.79 1l7c h PRO 462 Ca 0.02 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.18 1l7c h PRO 462 Cb 0.06 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 31.05 1l7c h PRO 462 CO -0.13 0.16 0.65 1.96 -0.21 0.00 0.00 178.00 180.44 1l7c h GLN 463 N 0.25 1.15 -0.10 1.05 4.20 -1.17 -0.30 115.11 120.19 1l7c h GLN 463 Ca 0.48 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 59.10 1l7c h GLN 463 Cb 0.90 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 28.41 1l7c h GLN 463 CO -0.58 0.76 -0.03 0.28 -0.67 0.00 0.00 178.83 178.59 1l7c h VAL 464 N 1.19 1.30 0.46 -0.54 2.07 0.16 -0.37 116.25 120.52 1l7c h VAL 464 Ca 0.43 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1l7c h VAL 464 Cb 0.16 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1l7c h VAL 464 CO -0.17 0.28 -0.22 0.40 0.02 0.00 0.00 177.57 177.87 1l7c h ILE 465 N -0.13 0.54 -0.74 4.57 2.04 -0.95 -1.94 117.51 120.89 1l7c h ILE 465 Ca 0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.99 1l7c h ILE 465 Cb 0.46 0.54 -0.08 0.00 -0.74 0.00 0.00 36.82 37.00 1l7c h ILE 465 CO 0.01 0.00 0.37 0.78 0.00 0.00 0.00 178.15 179.31 1l7c h ASN 466 N -0.62 0.48 -0.06 1.72 -0.26 -1.10 0.17 115.58 115.91 1l7c h ASN 466 Ca -0.06 0.07 0.02 0.00 -0.56 0.00 0.00 56.30 55.76 1l7c h ASN 466 Cb 0.48 -0.01 -0.00 0.00 -1.06 0.00 0.00 38.32 37.72 1l7c h ASN 466 CO 0.10 0.26 0.07 0.00 -1.06 0.00 0.00 177.43 176.80 1l7c h ALA 467 N 1.46 1.64 0.06 -0.83 0.00 -0.68 -0.63 119.26 120.28 1l7c h ALA 467 Ca 0.37 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 1l7c h ALA 467 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1l7c h ALA 467 CO -0.29 -0.10 -0.03 0.00 0.00 0.00 0.00 179.25 178.83 1l7c h ALA 468 N 1.92 -0.08 -0.32 0.00 0.00 0.09 -3.00 119.26 117.87 1l7c h ALA 468 Ca 0.03 -0.30 0.09 0.00 0.00 0.00 0.00 54.91 54.73 1l7c h ALA 468 Cb 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1l7c h ALA 468 CO -0.00 -0.16 0.31 -0.07 0.00 0.00 0.00 179.25 179.33 1l7c h LEU 469 N -0.85 0.00 -0.70 0.00 3.38 -0.53 1.21 115.31 117.81 1l7c h LEU 469 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1l7c h LEU 469 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1l7c h LEU 469 CO 0.01 0.00 -0.25 0.00 0.09 0.00 0.00 178.44 178.30 1l7c h ALA 470 N 1.68 0.93 0.12 1.53 0.00 -1.12 -2.63 119.26 119.76 1l7c h ALA 470 Ca 0.15 -0.23 -0.36 0.00 0.00 0.00 0.00 54.91 54.47 1l7c h ALA 470 Cb 0.77 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1l7c h ALA 470 CO -0.00 0.31 -2.01 -0.11 0.00 0.00 0.00 179.25 177.44 1l7c n LEU 471 N -3.29 2.59 -0.15 0.00 7.94 0.38 -3.32 117.00 121.16 1l7c n LEU 471 Ca 0.01 0.20 -0.05 0.00 -1.11 0.00 0.00 56.01 55.06 1l7c n LEU 471 Cb 0.51 -1.06 0.04 0.00 0.53 0.00 0.00 43.42 43.44 1l7c n LEU 471 CO 0.35 0.84 1.02 0.00 -1.11 0.00 0.00 177.39 178.49 1l7c h ALA 472 N 0.10 0.60 -0.43 1.96 0.00 -0.63 0.64 119.26 121.51 1l7c h ALA 472 Ca -0.43 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 1l7c h ALA 472 Cb 2.03 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.72 1l7c h ALA 472 CO 0.08 -0.10 0.01 0.00 0.00 0.00 0.00 179.25 179.24 1l7c h ALA 473 N 1.25 1.20 -2.11 0.00 0.00 -1.63 -3.34 119.26 114.63 1l7c h ALA 473 Ca 0.20 -0.24 -0.53 0.00 0.00 0.00 0.00 54.91 54.34 1l7c h ALA 473 Cb 0.10 -0.18 -0.41 0.00 0.00 0.00 0.00 17.79 17.30 1l7c h ALA 473 CO -0.14 0.53 -0.96 1.63 0.00 0.00 0.00 179.25 180.31 1l7c n LYS 474 N -4.24 1.81 0.03 0.00 5.02 -0.81 -4.93 118.16 115.04 1l7c n LYS 474 Ca 0.02 -3.95 0.21 0.00 -2.02 0.00 0.00 58.31 52.57 1l7c n LYS 474 Cb 0.28 -1.87 0.55 0.00 -0.02 0.00 0.00 35.03 33.97 1l7c n LYS 474 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1l7c h PRO 475 N 3.17 0.00 0.10 1.97 0.11 0.16 0.54 132.00 138.04 1l7c h PRO 475 Ca 0.11 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.96 1l7c h PRO 475 Cb 0.78 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 1l7c h PRO 475 CO 0.63 0.00 -1.22 1.96 -0.21 0.00 0.00 178.00 179.16 1l7c h GLN 476 N 0.00 0.20 -5.47 1.05 1.08 -1.91 -3.46 115.11 106.61 1l7c h GLN 476 Ca 0.26 -0.34 -0.51 0.00 -1.45 0.00 0.00 58.65 56.61 1l7c h GLN 476 Cb 1.86 0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 29.38 1l7c h GLN 476 CO -0.00 1.15 1.64 0.45 -0.95 0.00 0.00 178.83 181.12 1l7c n SER 477 N -3.47 1.61 -0.34 1.46 2.88 0.19 -4.81 113.62 111.14 1l7c n SER 477 Ca -0.07 -0.12 0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1l7c n SER 477 Cb 1.01 -1.31 0.30 0.00 -0.75 0.00 0.00 64.21 63.46 1l7c n SER 477 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1l7c h LYS 478 N 15.85 0.83 0.22 -1.46 3.64 -1.88 -0.13 116.57 133.64 1l7c h LYS 478 Ca -0.18 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1l7c h LYS 478 Cb 1.29 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1l7c h LYS 478 CO 1.21 0.55 -0.20 1.25 -2.27 0.00 0.00 179.45 179.99 1l7c h LEU 479 N 0.86 -0.54 -1.47 5.20 5.85 -1.96 -2.12 115.31 121.12 1l7c h LEU 479 Ca 0.51 0.05 0.15 0.00 0.84 0.00 0.00 57.88 59.43 1l7c h LEU 479 Cb 0.66 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.82 1l7c h LEU 479 CO -0.28 -0.31 0.53 0.00 -0.34 0.00 0.00 178.44 178.05 1l7c h ALA 480 N 0.27 2.02 0.18 1.25 0.00 -1.39 -2.12 119.26 119.46 1l7c h ALA 480 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1l7c h ALA 480 Cb 0.42 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1l7c h ALA 480 CO -0.04 -0.24 -0.08 1.96 0.00 0.00 0.00 179.25 180.85 1l7c h GLN 481 N 0.51 -0.23 -0.37 0.00 4.20 -0.91 -3.22 115.11 115.10 1l7c h GLN 481 Ca 0.40 0.02 0.08 0.00 0.06 0.00 0.00 58.65 59.21 1l7c h GLN 481 Cb 0.82 0.05 -0.08 0.00 0.30 0.00 0.00 27.48 28.57 1l7c h GLN 481 CO -0.15 0.12 -0.15 0.93 -0.67 0.00 0.00 178.83 178.92 1l7c h GLU 482 N -0.62 -0.07 -1.05 1.46 5.08 -0.82 -2.37 114.58 116.20 1l7c h GLU 482 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1l7c h GLU 482 Cb 0.46 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1l7c h GLU 482 CO 0.04 -0.05 0.00 0.09 -1.00 0.00 0.00 179.01 178.09 1l7c n ASN 483 N -5.34 0.00 0.00 1.42 3.02 -0.85 -1.07 115.26 112.44 1l7c n ASN 483 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1l7c n ASN 483 Cb 0.25 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.42 1l7c n ASN 483 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1l7c n ASP 485 N 0.65 0.00 -0.18 6.41 8.00 -0.89 -0.64 116.55 129.91 1l7c n ASP 485 Ca 0.00 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.48 1l7c n ASP 485 Cb 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.18 1l7c n ASP 485 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1l7c h LEU 486 N 0.00 0.24 -1.11 0.64 3.38 -1.37 0.29 115.31 117.37 1l7c h LEU 486 Ca 0.00 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1l7c h LEU 486 Cb 0.00 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1l7c h LEU 486 CO 0.00 0.16 -0.12 -0.26 0.09 0.00 0.00 178.44 178.31 1l7c h PHE 487 N 0.41 0.51 -0.58 1.13 0.05 -1.12 -1.96 116.94 115.38 1l7c h PHE 487 Ca 0.26 -0.08 -0.01 0.00 3.82 0.00 0.00 57.97 61.96 1l7c h PHE 487 Cb 0.27 -0.14 -0.03 0.00 2.00 0.00 0.00 35.95 38.05 1l7c h PHE 487 CO -0.15 0.59 0.32 -0.22 -0.18 0.00 0.00 178.31 178.67 1l7c h LYS 488 N 0.44 0.81 0.49 1.51 3.64 -0.82 -0.16 116.57 122.48 1l7c h LYS 488 Ca 0.08 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1l7c h LYS 488 Cb 0.48 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1l7c h LYS 488 CO 0.03 0.62 -0.23 0.93 -2.27 0.00 0.00 179.45 178.52 1l7c h GLU 489 N 0.79 -0.63 -0.85 1.90 5.08 -0.18 0.19 114.58 120.88 1l7c h GLU 489 Ca 0.21 0.04 0.17 0.00 -1.00 0.00 0.00 59.36 58.78 1l7c h GLU 489 Cb 0.04 0.14 -0.10 0.00 0.50 0.00 0.00 28.75 29.33 1l7c h GLU 489 CO -0.03 -0.37 0.40 1.96 -1.00 0.00 0.00 179.01 179.96 1l7c h GLN 490 N -0.76 0.50 -0.22 2.33 4.20 -1.25 -0.53 115.11 119.38 1l7c h GLN 490 Ca -0.07 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 1l7c h GLN 490 Cb 0.55 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1l7c h GLN 490 CO 0.11 0.33 -0.11 2.35 -0.67 0.00 0.00 178.83 180.84 1l7c h TRP 491 N 0.52 0.54 -0.09 2.96 2.91 -0.78 -2.79 115.95 119.21 1l7c h TRP 491 Ca 0.49 -0.13 -0.09 0.00 1.13 0.00 0.00 58.89 60.29 1l7c h TRP 491 Cb 0.79 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 29.30 1l7c h TRP 491 CO -0.12 0.74 -0.34 0.93 -1.03 0.00 0.00 178.44 178.62 1l7c h GLU 492 N 0.18 0.19 -0.34 2.65 5.08 -0.13 -1.32 114.58 120.87 1l7c h GLU 492 Ca 0.05 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 1l7c h GLU 492 Cb 0.60 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1l7c h GLU 492 CO 0.03 0.51 -0.11 0.87 -1.00 0.00 0.00 179.01 179.32 1l7c h LYS 493 N 0.16 0.68 -0.31 2.33 1.57 -1.11 -2.27 116.57 117.62 1l7c h LYS 493 Ca 0.02 -0.27 -0.15 0.00 -1.87 0.00 0.00 60.65 58.38 1l7c h LYS 493 Cb 0.69 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 1l7c h LYS 493 CO 0.05 0.86 -0.40 1.96 -0.57 0.00 0.00 179.45 181.34 1l7c h GLN 494 N 0.46 0.75 -0.99 3.15 1.08 -1.29 -0.45 115.11 117.83 1l7c h GLN 494 Ca 0.08 -0.39 0.03 0.00 -1.45 0.00 0.00 58.65 56.92 1l7c h GLN 494 Cb 0.62 0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 28.01 1l7c h GLN 494 CO 0.04 1.02 0.65 0.28 -0.95 0.00 0.00 178.83 179.86 1l7c h VAL 495 N 0.61 1.19 -0.14 -0.54 2.07 -1.21 0.35 116.25 118.58 1l7c h VAL 495 Ca 0.05 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 1l7c h VAL 495 Cb 0.95 -0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1l7c h VAL 495 CO 0.09 0.23 -0.09 -0.09 0.02 0.00 0.00 177.57 177.73 1l7c h ARG 496 N 1.27 0.31 -0.59 1.57 9.65 -1.15 -0.28 114.38 125.16 1l7c h ARG 496 Ca 0.38 -0.14 0.05 0.00 -1.10 0.00 0.00 59.98 59.17 1l7c h ARG 496 Cb -0.04 -0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.49 1l7c h ARG 496 CO -0.11 0.66 0.32 0.28 2.80 0.00 0.00 179.97 183.92 1l7c h VAL 497 N -0.04 0.98 -0.24 0.20 2.07 -0.56 -1.98 116.25 116.67 1l7c h VAL 497 Ca 0.03 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1l7c h VAL 497 Cb 0.58 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1l7c h VAL 497 CO 0.02 0.11 0.10 0.25 0.02 0.00 0.00 177.57 178.08 1l7c h LEU 498 N 0.61 0.33 0.32 2.57 5.85 -0.17 -0.22 115.31 124.60 1l7c h LEU 498 Ca 0.26 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1l7c h LEU 498 Cb 0.14 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1l7c h LEU 498 CO -0.16 0.40 -0.48 0.74 -0.34 0.00 0.00 178.44 178.60 1l7c h THR 499 N 0.24 0.00 -0.69 1.05 2.02 -0.74 0.19 112.91 114.99 1l7c h THR 499 Ca 0.08 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.30 1l7c h THR 499 Cb 0.17 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.54 1l7c h THR 499 CO -0.01 0.00 0.46 0.44 0.37 0.00 0.00 175.52 176.78 1l7c h ASP 500 N -0.84 0.69 0.03 4.18 3.32 -1.37 0.05 116.42 122.49 1l7c h ASP 500 Ca -0.04 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 1l7c h ASP 500 Cb 0.77 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1l7c h ASP 500 CO -0.14 0.47 -0.01 0.00 -1.72 0.00 0.00 179.24 177.84 1l7c h ALA 501 N 1.60 -0.04 -0.46 3.45 0.00 -0.49 0.29 119.26 123.61 1l7c h ALA 501 Ca 0.28 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1l7c h ALA 501 Cb 0.11 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1l7c h ALA 501 CO -0.08 -0.36 0.26 0.28 0.00 0.00 0.00 179.25 179.35 1l7c h VAL 502 N -0.36 1.03 -1.00 0.00 2.07 -0.34 -2.17 116.25 115.48 1l7c h VAL 502 Ca -0.00 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.37 1l7c h VAL 502 Cb 0.34 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.51 1l7c h VAL 502 CO 0.01 0.10 0.65 0.44 0.02 0.00 0.00 177.57 178.78 1l7c h ASP 503 N 0.53 1.09 0.05 0.57 3.32 -0.88 -1.51 116.42 119.59 1l7c h ASP 503 Ca 0.19 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1l7c h ASP 503 Cb 0.04 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.34 1l7c h ASP 503 CO -0.10 0.75 0.00 0.44 -1.72 0.00 0.00 179.24 178.61 1l7c h ASP 504 N 1.27 0.00 -0.05 6.45 3.32 -0.26 -1.84 116.42 125.30 1l7c h ASP 504 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 1l7c h ASP 504 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1l7c h ASP 504 CO -0.12 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.70 1l7c n ILE 505 N -2.94 0.18 -0.04 0.35 -5.35 -0.64 -4.64 119.36 106.27 1l7c n ILE 505 Ca -0.03 -0.59 -0.14 0.00 -0.27 0.00 0.00 62.75 61.73 1l7c n ILE 505 Cb 0.08 1.05 -0.11 0.00 -1.74 0.00 0.00 39.64 38.91 1l7c n ILE 505 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1l7c h THR 506 N 1.56 1.56 -2.36 7.28 2.02 -0.55 -3.46 112.91 118.97 1l7c h THR 506 Ca 0.00 -1.74 0.17 0.00 0.77 0.00 0.00 66.41 65.61 1l7c h THR 506 Cb 0.40 2.71 -0.09 0.00 -1.74 0.00 0.00 68.15 69.43 1l7c h THR 506 CO 0.00 0.46 0.48 -0.94 0.37 0.00 0.00 175.52 175.88 1l7c s SER 507 N -6.02 -0.20 0.14 4.18 1.04 -1.25 -5.04 113.70 106.56 1l7c s SER 507 Ca -0.17 -0.38 -0.15 0.00 0.48 0.00 0.00 55.95 55.73 1l7c s SER 507 Cb -0.00 0.49 0.01 0.00 0.10 0.00 0.00 66.02 66.61 1l7c s SER 507 CO 0.70 -0.89 1.69 0.40 0.98 0.00 0.00 173.24 176.11 1l7c h ILE 508 N 2.00 1.20 -0.91 -1.02 1.08 -1.91 -1.50 117.51 116.45 1l7c h ILE 508 Ca -0.24 -0.62 -0.01 0.00 -0.39 0.00 0.00 64.86 63.60 1l7c h ILE 508 Cb 1.23 0.80 -0.04 0.00 -3.07 0.00 0.00 36.82 35.74 1l7c h ILE 508 CO 0.26 0.23 0.53 -0.78 -0.69 0.00 0.00 178.15 177.70 1l7c h ASP 509 N 0.55 1.10 0.08 1.72 -0.00 -1.97 0.18 116.42 118.09 1l7c h ASP 509 Ca 0.14 -0.08 -0.00 0.00 -0.00 0.00 0.00 57.03 57.10 1l7c h ASP 509 Cb 0.19 -0.28 -0.00 0.00 -0.00 0.00 0.00 39.33 39.24 1l7c h ASP 509 CO -0.01 0.86 -0.06 0.44 -0.00 0.00 0.00 179.24 180.47 1l7c h ASP 510 N 1.25 -0.14 -0.90 2.28 5.19 -1.79 0.21 116.42 122.52 1l7c h ASP 510 Ca 0.32 0.01 0.06 0.00 -0.62 0.00 0.00 57.03 56.80 1l7c h ASP 510 Cb -0.03 0.05 -0.06 0.00 0.18 0.00 0.00 39.33 39.47 1l7c h ASP 510 CO -0.06 -0.09 0.57 0.15 -3.12 0.00 0.00 179.24 176.69 1l7c h PHE 511 N -0.14 1.05 0.00 4.55 3.57 -0.67 0.13 116.94 125.43 1l7c h PHE 511 Ca -0.00 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.40 1l7c h PHE 511 Cb 0.12 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.50 1l7c h PHE 511 CO -0.09 0.54 -0.59 -0.07 -2.23 0.00 0.00 178.31 175.88 1l7c h LEU 512 N 1.04 0.00 -0.20 0.59 3.38 -0.31 -1.21 115.31 118.61 1l7c h LEU 512 Ca 0.39 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.24 1l7c h LEU 512 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1l7c h LEU 512 CO -0.17 0.59 -0.33 0.00 0.09 0.00 0.00 178.44 178.62 1l7c h ALA 513 N 1.41 0.30 -0.68 1.53 0.00 0.69 -1.54 119.26 120.98 1l7c h ALA 513 Ca -0.01 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.41 1l7c h ALA 513 Cb 1.10 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1l7c h ALA 513 CO 0.08 0.35 0.12 0.28 0.00 0.00 0.00 179.25 180.07 1l7c h VAL 514 N 0.24 1.26 -0.31 0.00 2.07 -0.96 -2.29 116.25 116.26 1l7c h VAL 514 Ca 0.01 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1l7c h VAL 514 Cb 0.92 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1l7c h VAL 514 CO 0.07 0.39 0.11 0.28 0.02 0.00 0.00 177.57 178.45 1l7c h SER 515 N 1.05 0.39 -0.21 0.57 0.02 -1.06 -1.18 113.55 113.13 1l7c h SER 515 Ca 0.21 -0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 60.97 1l7c h SER 515 Cb 0.43 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 1l7c h SER 515 CO 0.01 0.37 -0.40 -0.33 -1.14 0.00 0.00 176.83 175.34 1l7c h GLU 516 N 0.44 0.75 -0.02 3.45 5.08 -0.73 -2.22 114.58 121.33 1l7c h GLU 516 Ca 0.11 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 1l7c h GLU 516 Cb 0.11 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1l7c h GLU 516 CO -0.01 1.02 -0.04 -0.91 -1.00 0.00 0.00 179.01 178.07 1l7c h ASN 517 N 0.62 0.07 -0.54 1.42 2.35 -0.93 -2.09 115.58 116.47 1l7c h ASN 517 Ca 0.05 -0.58 0.03 0.00 -0.55 0.00 0.00 56.30 55.24 1l7c h ASN 517 Cb 0.95 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 39.27 1l7c h ASN 517 CO 0.09 0.64 0.33 0.45 -1.65 0.00 0.00 177.43 177.28 1l7c h HIS 518 N -0.50 0.61 0.47 1.19 3.86 -1.33 -0.14 115.15 119.31 1l7c h HIS 518 Ca 0.00 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1l7c h HIS 518 Cb 0.63 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.90 1l7c h HIS 518 CO 0.13 0.35 -0.22 0.82 0.86 0.00 0.00 177.93 179.86 1l7c h ILE 519 N 0.65 0.54 -0.69 2.45 1.08 -1.44 0.40 117.51 120.50 1l7c h ILE 519 Ca 0.22 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.64 1l7c h ILE 519 Cb 0.02 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 34.31 1l7c h ILE 519 CO -0.10 0.01 0.45 0.25 -0.69 0.00 0.00 178.15 178.07 1l7c h LEU 520 N -0.66 0.80 -0.59 1.44 5.85 -1.28 0.15 115.31 121.02 1l7c h LEU 520 Ca -0.06 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 1l7c h LEU 520 Cb 0.50 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 1l7c h LEU 520 CO 0.11 0.59 0.30 -0.33 -0.34 0.00 0.00 178.44 178.76 1l7c h GLU 521 N 0.93 0.84 -0.13 1.25 5.08 -0.82 -0.17 114.58 121.57 1l7c h GLU 521 Ca 0.25 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 1l7c h GLU 521 Cb -0.09 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1l7c h GLU 521 CO -0.05 0.67 -0.15 -0.44 -1.00 0.00 0.00 179.01 178.04 1l7c h ASP 522 N 0.80 0.20 -0.34 1.42 3.32 0.30 -1.22 116.42 120.90 1l7c h ASP 522 Ca 0.20 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.13 1l7c h ASP 522 Cb 0.10 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1l7c h ASP 522 CO -0.03 0.37 -0.12 0.58 -1.72 0.00 0.00 179.24 178.32 1l7c h VAL 523 N 0.20 1.28 -0.69 -1.35 2.07 0.33 0.47 116.25 118.57 1l7c h VAL 523 Ca 0.04 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.30 1l7c h VAL 523 Cb 0.40 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1l7c h VAL 523 CO 0.02 0.40 0.23 0.78 0.02 0.00 0.00 177.57 179.03 1l7c h ASN 524 N 0.47 0.96 -0.44 0.57 2.35 -0.55 -1.05 115.58 117.90 1l7c h ASN 524 Ca 0.08 -0.16 -0.05 0.00 -0.55 0.00 0.00 56.30 55.62 1l7c h ASN 524 Cb 0.64 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 1l7c h ASN 524 CO 0.04 0.89 0.07 0.11 -1.65 0.00 0.00 177.43 176.88 1l7c h LYS 525 N 1.01 0.74 0.46 0.81 1.57 -0.98 -1.66 116.57 118.52 1l7c h LYS 525 Ca 0.23 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1l7c h LYS 525 Cb 0.25 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 1l7c h LYS 525 CO -0.01 0.77 -0.39 0.00 -0.57 0.00 0.00 179.45 179.25 1l7c h VAL 527 N -0.84 0.55 -0.26 0.00 2.07 -1.16 0.27 116.25 116.88 1l7c h VAL 527 Ca -0.05 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.33 1l7c h VAL 527 Cb 0.73 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1l7c h VAL 527 CO -0.02 0.06 0.01 0.40 0.02 0.00 0.00 177.57 178.03 1l7c h ILE 528 N 0.31 1.25 -0.95 4.57 2.04 -0.85 -2.04 117.51 121.84 1l7c h ILE 528 Ca 0.42 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 65.39 1l7c h ILE 528 Cb 0.69 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 1l7c h ILE 528 CO -0.48 0.28 0.61 0.00 0.00 0.00 0.00 178.15 178.56 1l7c h ALA 529 N 0.82 1.29 -0.05 1.87 0.00 0.13 -0.99 119.26 122.34 1l7c h ALA 529 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1l7c h ALA 529 Cb 0.41 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1l7c h ALA 529 CO 0.01 0.64 0.03 1.25 0.00 0.00 0.00 179.25 181.19 1l7c h LEU 530 N 1.29 0.06 -2.02 0.00 5.85 -0.33 0.36 115.31 120.52 1l7c h LEU 530 Ca 0.34 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 1l7c h LEU 530 Cb -0.12 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 1l7c h LEU 530 CO -0.07 0.06 -0.05 1.56 -0.34 0.00 0.00 178.44 179.59 1l7c h GLN 531 N 0.06 0.00 -0.56 1.25 4.20 -0.66 0.18 115.11 119.57 1l7c h GLN 531 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1l7c h GLN 531 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1l7c h GLN 531 CO -0.00 0.05 0.00 0.39 -0.67 0.00 0.00 178.83 178.60 1l7c n GLU 532 N -4.25 2.47 -3.80 1.46 1.02 -0.44 -4.91 120.64 112.20 1l7c n GLU 532 Ca -0.03 -1.96 -0.30 0.00 -0.02 0.00 0.00 57.16 54.86 1l7c n GLU 532 Cb 0.14 -1.51 -0.01 0.00 -0.02 0.00 0.00 31.44 30.04 1l7c n GLU 532 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1l7c n LYS 533 N 0.95 -3.69 -2.69 3.49 5.02 0.62 -4.84 118.16 117.03 1l7c n LYS 533 Ca 0.18 0.45 -0.43 0.00 -2.02 0.00 0.00 58.31 56.49 1l7c n LYS 533 Cb 0.52 -5.21 0.00 0.00 -0.02 0.00 0.00 35.03 30.33 1l7c n LYS 533 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1l7c n ASP 534 N -2.52 5.45 -0.33 4.39 4.64 0.11 -4.87 116.55 123.42 1l7c n ASP 534 Ca 0.03 -3.15 0.21 0.00 -1.38 0.00 0.00 54.79 50.51 1l7c n ASP 534 Cb 0.52 -1.44 0.41 0.00 -1.04 0.00 0.00 41.12 39.56 1l7c n ASP 534 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 1l7c h VAL 535 N 3.84 0.09 0.23 5.18 -1.51 -1.88 0.86 116.25 123.05 1l7c h VAL 535 Ca 0.32 -0.02 -0.01 0.00 -1.23 0.00 0.00 66.70 65.76 1l7c h VAL 535 Cb 0.69 0.01 -0.00 0.00 -2.13 0.00 0.00 31.29 29.87 1l7c h VAL 535 CO 1.44 0.01 -0.13 -0.78 -1.23 0.00 0.00 177.57 176.88 1l7c h ASP 536 N 0.07 -0.31 -0.22 4.19 3.58 -1.96 0.89 116.42 122.66 1l7c h ASP 536 Ca 0.69 0.02 0.05 0.00 0.42 0.00 0.00 57.03 58.21 1l7c h ASP 536 Cb 1.59 0.09 -0.06 0.00 1.72 0.00 0.00 39.33 42.67 1l7c h ASP 536 CO -0.80 -0.21 -0.15 1.23 -2.88 0.00 0.00 179.24 176.44 1l7c h GLY 537 N -0.33 0.01 0.47 -0.78 0.00 -1.25 -0.51 103.07 100.68 1l7c h GLY 537 Ca -0.03 0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.50 1l7c h GLY 537 CO 0.03 -0.15 -0.36 -2.00 0.00 0.00 0.00 176.54 174.07 1l7c h LEU 538 N -0.14 -1.01 -0.34 3.11 5.85 -1.09 0.25 115.31 121.94 1l7c h LEU 538 Ca 0.12 0.10 0.06 0.00 0.84 0.00 0.00 57.88 59.01 1l7c h LEU 538 Cb 0.32 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 1l7c h LEU 538 CO -0.30 -0.46 0.01 -0.78 -0.34 0.00 0.00 178.44 176.57 1l7c h ASP 539 N -0.64 -0.11 -0.33 1.25 1.82 -0.53 0.24 116.42 118.11 1l7c h ASP 539 Ca 0.01 0.07 -0.12 0.00 -0.39 0.00 0.00 57.03 56.61 1l7c h ASP 539 Cb 0.63 0.13 -0.01 0.00 0.68 0.00 0.00 39.33 40.76 1l7c h ASP 539 CO -0.15 -0.02 -0.25 0.03 -1.61 0.00 0.00 179.24 177.24 1l7c h ARG 540 N 0.11 0.75 -0.49 0.28 2.47 -0.96 -2.10 114.38 114.44 1l7c h ARG 540 Ca 0.16 -0.36 -0.08 0.00 -1.26 0.00 0.00 59.98 58.44 1l7c h ARG 540 Cb 0.22 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.52 1l7c h ARG 540 CO -0.27 0.98 -0.02 1.15 0.56 0.00 0.00 179.97 182.38 1l7c h THR 541 N 0.51 1.26 -0.09 2.04 2.02 -0.72 -0.20 112.91 117.74 1l7c h THR 541 Ca 0.06 -1.10 -0.07 0.00 0.77 0.00 0.00 66.41 66.07 1l7c h THR 541 Cb 0.81 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 1l7c h THR 541 CO 0.07 0.38 -0.27 0.00 0.37 0.00 0.00 175.52 176.07 1l7c h ALA 542 N 0.92 1.39 -0.32 6.16 0.00 -0.55 -1.87 119.26 125.00 1l7c h ALA 542 Ca 0.14 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 1l7c h ALA 542 Cb 0.54 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1l7c h ALA 542 CO 0.03 0.43 -0.37 0.78 0.00 0.00 0.00 179.25 180.13 1l7c h GLY 543 N 0.95 0.79 1.63 0.00 0.00 -0.78 -2.03 103.07 103.63 1l7c h GLY 543 Ca 0.02 -0.78 -0.08 0.00 0.00 0.00 0.00 47.33 46.49 1l7c h GLY 543 CO 0.04 0.70 -0.21 0.00 0.00 0.00 0.00 176.54 177.07 1l7c h ALA 544 N 0.98 1.19 -0.00 3.60 0.00 -0.48 -1.79 119.26 122.76 1l7c h ALA 544 Ca 0.06 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1l7c h ALA 544 Cb 0.90 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1l7c h ALA 544 CO 0.08 0.52 0.00 0.82 0.00 0.00 0.00 179.25 180.67 1l7c h ILE 545 N 0.40 1.25 -0.77 0.00 2.04 -1.14 -1.88 117.51 117.40 1l7c h ILE 545 Ca 0.06 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 1l7c h ILE 545 Cb 0.59 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 1l7c h ILE 545 CO 0.04 0.19 0.46 0.03 0.00 0.00 0.00 178.15 178.87 1l7c h ARG 546 N -0.31 1.05 -0.09 2.37 2.47 -1.24 0.11 114.38 118.75 1l7c h ARG 546 Ca 0.00 -0.10 -0.01 0.00 -1.26 0.00 0.00 59.98 58.61 1l7c h ARG 546 Cb 0.31 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 1l7c h ARG 546 CO 0.00 0.74 0.00 0.78 0.56 0.00 0.00 179.97 182.05 1l7c h GLY 547 N 1.09 0.16 1.07 0.04 0.00 -1.28 -0.80 103.07 103.36 1l7c h GLY 547 Ca 0.28 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.39 1l7c h GLY 547 CO -0.05 0.11 -0.01 -0.09 0.00 0.00 0.00 176.54 176.50 1l7c h ARG 548 N -0.13 1.03 -0.50 4.80 9.65 -1.04 -0.46 114.38 127.74 1l7c h ARG 548 Ca 0.02 -0.33 -0.08 0.00 -1.10 0.00 0.00 59.98 58.49 1l7c h ARG 548 Cb 0.34 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.81 1l7c h ARG 548 CO 0.00 1.02 -0.01 0.00 2.80 0.00 0.00 179.97 183.79 1l7c h ALA 549 N 0.97 1.06 -0.12 2.80 0.00 -0.78 0.11 119.26 123.30 1l7c h ALA 549 Ca 0.16 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1l7c h ALA 549 Cb 0.56 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1l7c h ALA 549 CO 0.03 0.59 -0.38 0.00 0.00 0.00 0.00 179.25 179.49 1l7c h ALA 550 N 1.22 1.13 -0.28 0.00 0.00 -0.90 0.17 119.26 120.59 1l7c h ALA 550 Ca 0.15 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 1l7c h ALA 550 Cb 0.47 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1l7c h ALA 550 CO 0.02 0.57 -0.26 -0.09 0.00 0.00 0.00 179.25 179.49 1l7c h ARG 551 N 0.22 0.68 -0.05 0.00 2.43 -0.28 -1.59 114.38 115.79 1l7c h ARG 551 Ca 0.02 -0.35 0.01 0.00 -0.81 0.00 0.00 59.98 58.85 1l7c h ARG 551 Cb 0.78 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 1l7c h ARG 551 CO 0.06 0.96 0.00 0.28 -1.51 0.00 0.00 179.97 179.76 1l7c h VAL 552 N 0.42 0.97 -0.76 0.20 2.07 -0.48 0.22 116.25 118.90 1l7c h VAL 552 Ca 0.05 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.64 1l7c h VAL 552 Cb 0.82 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 31.47 1l7c h VAL 552 CO 0.07 0.00 0.42 0.40 0.02 0.00 0.00 177.57 178.48 1l7c h ILE 553 N 0.02 0.92 -0.07 4.57 2.04 -0.88 -0.87 117.51 123.24 1l7c h ILE 553 Ca 0.02 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.56 1l7c h ILE 553 Cb 0.02 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1l7c h ILE 553 CO -0.03 0.13 -0.21 -0.74 0.00 0.00 0.00 178.15 177.30 1l7c h HIS 554 N 0.73 0.35 -0.75 1.37 2.76 -0.98 -2.49 115.15 116.15 1l7c h HIS 554 Ca 0.36 -0.14 -0.02 0.00 -2.20 0.00 0.00 60.37 58.37 1l7c h HIS 554 Cb 0.30 -0.06 -0.04 0.00 1.55 0.00 0.00 27.41 29.16 1l7c h HIS 554 CO -0.07 0.83 0.40 0.28 -1.30 0.00 0.00 177.93 178.07 1l7c h VAL 555 N -0.22 1.23 0.10 5.26 2.07 -0.76 -0.97 116.25 122.95 1l7c h VAL 555 Ca -0.01 -0.58 -0.17 0.00 0.82 0.00 0.00 66.70 66.76 1l7c h VAL 555 Cb 0.83 0.22 0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1l7c h VAL 555 CO 0.05 0.26 -0.72 0.58 0.02 0.00 0.00 177.57 177.76 1l7c h VAL 556 N 1.06 1.51 -0.82 2.57 2.07 -1.24 -1.05 116.25 120.35 1l7c h VAL 556 Ca 0.27 -2.40 0.02 0.00 0.82 0.00 0.00 66.70 65.41 1l7c h VAL 556 Cb 0.04 3.06 -0.05 0.00 -1.52 0.00 0.00 31.29 32.82 1l7c h VAL 556 CO -0.04 0.68 0.53 0.74 0.02 0.00 0.00 177.57 179.50 1l7c h THR 557 N -0.34 1.16 -0.38 2.57 2.02 -1.45 -1.54 112.91 114.95 1l7c h THR 557 Ca -0.12 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 1l7c h THR 557 Cb 1.52 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 1l7c h THR 557 CO 0.14 0.19 0.13 -1.28 0.37 0.00 0.00 175.52 175.06 1l7c h SER 558 N 1.05 0.54 0.00 4.18 0.87 -1.23 -2.93 113.55 116.03 1l7c h SER 558 Ca 0.32 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1l7c h SER 558 Cb -0.04 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 61.78 1l7c h SER 558 CO -0.10 0.59 0.00 1.21 -0.53 0.00 0.00 176.83 178.01 1l7c n GLU 559 N -4.63 0.00 0.00 2.24 4.07 -0.40 -3.87 120.64 118.05 1l7c n GLU 559 Ca -0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 1l7c n GLU 559 Cb 0.17 -1.39 0.00 0.00 -0.06 0.00 0.00 31.44 30.15 1l7c n GLU 559 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1l7c n ASP 561 N 1.17 0.00 0.05 4.31 8.00 -1.11 -3.94 116.55 125.02 1l7c n ASP 561 Ca 0.00 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.63 1l7c n ASP 561 Cb 0.00 -0.10 0.38 0.00 -0.02 0.00 0.00 41.12 41.38 1l7c n ASP 561 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1l7c n ASN 562 N 0.00 0.54 -4.97 -2.24 3.02 -1.25 -4.88 115.26 105.47 1l7c n ASN 562 Ca 0.00 0.32 -0.21 0.00 -0.03 0.00 0.00 54.58 54.66 1l7c n ASN 562 Cb 0.00 -0.33 -0.00 0.00 -0.61 0.00 0.00 39.78 38.84 1l7c n ASN 562 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1l7c s TYR 563 N -3.08 3.25 -0.04 3.10 4.12 -1.25 -5.05 117.35 118.39 1l7c s TYR 563 Ca 0.10 0.03 -0.30 0.00 0.02 0.00 0.00 57.07 56.93 1l7c s TYR 563 Cb 0.15 -2.02 -0.02 0.00 -1.52 0.00 0.00 41.96 38.54 1l7c s TYR 563 CO 0.63 -0.04 0.99 -2.00 0.02 0.00 0.00 175.55 175.14 1l7c s GLU 564 N -4.29 4.50 0.29 -0.62 2.56 -1.26 -4.97 118.70 114.92 1l7c s GLU 564 Ca 0.44 1.40 -0.29 0.00 0.00 0.00 0.00 54.97 56.52 1l7c s GLU 564 Cb -0.10 -3.49 -0.13 0.00 2.00 0.00 0.00 34.13 32.41 1l7c s GLU 564 CO 0.34 -0.15 1.18 -2.30 -0.56 0.00 0.00 175.26 173.77 1l7c n PRO 565 N 4.34 1.72 0.00 4.30 -0.02 -1.26 -4.82 135.00 139.26 1l7c n PRO 565 Ca 0.07 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1l7c n PRO 565 Cb 0.50 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1l7c n PRO 565 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l7c n GLY 566 N 1.26 2.36 0.16 -1.23 0.00 -1.26 -5.00 105.19 101.49 1l7c n GLY 566 Ca 0.08 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.27 1l7c n GLY 566 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1l7c h VAL 567 N 0.00 1.34 -0.00 1.61 2.07 -1.99 -2.57 116.25 116.71 1l7c h VAL 567 Ca 0.00 -1.47 0.01 0.00 0.82 0.00 0.00 66.70 66.06 1l7c h VAL 567 Cb 0.00 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1l7c h VAL 567 CO 0.00 0.44 -0.16 0.22 0.02 0.00 0.00 177.57 178.09 1l7c h TYR 568 N 0.14 -0.48 -0.29 1.57 3.20 -1.95 -1.35 116.97 117.81 1l7c h TYR 568 Ca 0.02 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.96 1l7c h TYR 568 Cb 0.83 0.21 -0.05 0.00 1.54 0.00 0.00 36.73 39.26 1l7c h TYR 568 CO 0.09 -0.17 -0.03 1.79 -1.64 0.00 0.00 178.16 178.20 1l7c h THR 569 N -0.20 0.76 -0.73 1.81 1.35 -1.88 -2.09 112.91 111.93 1l7c h THR 569 Ca 0.00 -0.02 0.08 0.00 -0.55 0.00 0.00 66.41 65.93 1l7c h THR 569 Cb 0.22 0.71 -0.05 0.00 -1.73 0.00 0.00 68.15 67.30 1l7c h THR 569 CO -0.11 0.01 0.48 -0.33 -0.25 0.00 0.00 175.52 175.32 1l7c h GLU 570 N 0.05 0.66 -0.16 4.72 4.39 -1.37 0.97 114.58 123.84 1l7c h GLU 570 Ca 0.14 -0.04 -0.14 0.00 0.34 0.00 0.00 59.36 59.66 1l7c h GLU 570 Cb 0.19 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 1l7c h GLU 570 CO -0.26 0.43 -0.48 -0.22 -1.16 0.00 0.00 179.01 177.33 1l7c h LYS 571 N 0.67 0.42 -0.34 2.33 1.63 -0.65 -0.67 116.57 119.97 1l7c h LYS 571 Ca 0.33 -0.24 -0.11 0.00 -0.85 0.00 0.00 60.65 59.78 1l7c h LYS 571 Cb 0.39 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 1l7c h LYS 571 CO -0.11 0.81 -0.21 0.28 -3.45 0.00 0.00 179.45 176.76 1l7c h VAL 572 N 0.34 1.29 -0.10 2.00 2.07 -0.32 -2.63 116.25 118.90 1l7c h VAL 572 Ca 0.02 -1.35 -0.08 0.00 0.82 0.00 0.00 66.70 66.11 1l7c h VAL 572 Cb 0.96 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1l7c h VAL 572 CO 0.08 0.44 -0.30 -0.07 0.02 0.00 0.00 177.57 177.74 1l7c h LEU 573 N 0.53 0.20 -0.39 2.57 3.38 -0.76 -1.30 115.31 119.54 1l7c h LEU 573 Ca 0.07 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1l7c h LEU 573 Cb 0.77 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1l7c h LEU 573 CO 0.06 0.50 0.19 -0.08 0.09 0.00 0.00 178.44 179.19 1l7c h GLU 574 N 0.17 0.56 -0.45 1.13 4.81 -1.01 -0.17 114.58 119.62 1l7c h GLU 574 Ca 0.02 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 1l7c h GLU 574 Cb 0.63 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1l7c h GLU 574 CO 0.05 0.49 -0.06 0.00 -0.73 0.00 0.00 179.01 178.76 1l7c h ALA 575 N 1.04 1.07 -0.10 2.92 0.00 -1.07 -1.17 119.26 121.94 1l7c h ALA 575 Ca 0.13 -0.29 -0.22 0.00 0.00 0.00 0.00 54.91 54.54 1l7c h ALA 575 Cb 0.12 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1l7c h ALA 575 CO -0.02 0.58 -0.81 1.79 0.00 0.00 0.00 179.25 180.79 1l7c h THR 576 N 0.70 1.32 0.00 0.00 1.35 -1.00 -2.95 112.91 112.32 1l7c h THR 576 Ca 0.13 -2.10 -0.08 0.00 -0.55 0.00 0.00 66.41 63.82 1l7c h THR 576 Cb 0.51 2.10 -0.01 0.00 -1.73 0.00 0.00 68.15 69.02 1l7c h THR 576 CO 0.03 0.65 -0.36 0.11 -0.25 0.00 0.00 175.52 175.69 1l7c h LYS 577 N 0.42 0.00 -0.52 4.72 1.57 -0.87 -0.40 116.57 121.49 1l7c h LYS 577 Ca -0.06 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1l7c h LYS 577 Cb 1.43 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.72 1l7c h LYS 577 CO 0.16 0.36 0.07 1.25 -0.57 0.00 0.00 179.45 180.72 1l7c h LEU 578 N 0.00 0.84 -0.21 2.94 5.85 -1.13 0.15 115.31 123.75 1l7c h LEU 578 Ca -0.00 -0.27 -0.05 0.00 0.84 0.00 0.00 57.88 58.40 1l7c h LEU 578 Cb 0.69 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1l7c h LEU 578 CO 0.05 0.90 -0.05 0.25 -0.34 0.00 0.00 178.44 179.25 1l7c h LEU 579 N 0.75 0.41 -0.03 2.25 5.85 -1.25 -1.90 115.31 121.40 1l7c h LEU 579 Ca 0.16 -0.36 -0.21 0.00 0.84 0.00 0.00 57.88 58.30 1l7c h LEU 579 Cb 0.43 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 1l7c h LEU 579 CO 0.01 0.68 -1.00 0.77 -0.34 0.00 0.00 178.44 178.56 1l7c h SER 580 N 0.14 0.04 0.42 1.25 4.64 -1.01 -3.21 113.55 115.82 1l7c h SER 580 Ca 0.05 -0.04 -0.25 0.00 -0.47 0.00 0.00 61.79 61.08 1l7c h SER 580 Cb 0.50 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.53 1l7c h SER 580 CO 0.02 1.02 -1.79 0.59 -0.87 0.00 0.00 176.83 175.80 1l7c n ASN 581 N -3.39 0.62 0.01 4.97 3.02 0.51 -4.55 115.26 116.44 1l7c n ASN 581 Ca -0.01 0.28 -0.01 0.00 -0.03 0.00 0.00 54.58 54.82 1l7c n ASN 581 Cb 0.93 0.37 -0.00 0.00 -0.61 0.00 0.00 39.78 40.47 1l7c n ASN 581 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1l7c n THR 582 N -2.88 0.45 0.35 3.41 -1.04 -0.80 -4.75 114.28 109.02 1l7c n THR 582 Ca -0.18 0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1l7c n THR 582 Cb 0.98 -1.55 0.00 0.00 -1.82 0.00 0.00 70.33 67.94 1l7c n THR 582 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1l7c n VAL 583 N -3.21 0.02 0.00 12.58 0.31 -0.78 -2.90 118.33 124.36 1l7c n VAL 583 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1l7c n VAL 583 Cb 0.35 -0.21 0.00 0.00 -0.91 0.00 0.00 33.84 33.07 1l7c n VAL 583 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1l7c n PRO 585 N 0.36 0.00 0.01 5.55 -0.02 -1.26 -2.00 135.00 137.64 1l7c n PRO 585 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.52 1l7c n PRO 585 Cb 0.09 0.00 0.43 0.00 -0.02 0.00 0.00 33.50 34.00 1l7c n PRO 585 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l7c h ARG 586 N 0.00 0.51 0.02 -0.52 3.08 -1.90 0.42 114.38 116.00 1l7c h ARG 586 Ca 0.00 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 1l7c h ARG 586 Cb 0.00 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 29.94 1l7c h ARG 586 CO 0.00 0.35 -0.01 0.35 -1.07 0.00 0.00 179.97 179.59 1l7c h PHE 587 N 0.52 -0.03 -0.74 3.04 3.57 -1.68 -0.50 116.94 121.13 1l7c h PHE 587 Ca 0.14 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.65 1l7c h PHE 587 Cb -0.03 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.68 1l7c h PHE 587 CO 0.00 0.25 0.49 1.15 -2.23 0.00 0.00 178.31 177.97 1l7c h THR 588 N -0.31 1.17 -0.55 4.41 2.02 -1.73 0.13 112.91 118.05 1l7c h THR 588 Ca -0.00 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 66.85 1l7c h THR 588 Cb 0.29 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 1l7c h THR 588 CO 0.01 0.18 0.36 -0.08 0.37 0.00 0.00 175.52 176.35 1l7c h GLU 589 N 0.98 0.71 -0.31 6.66 4.81 -0.69 -0.12 114.58 126.63 1l7c h GLU 589 Ca 0.28 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 1l7c h GLU 589 Cb -0.08 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 1l7c h GLU 589 CO -0.06 0.47 -0.09 1.96 -0.73 0.00 0.00 179.01 180.56 1l7c h GLN 590 N 0.74 0.60 0.49 1.92 1.08 0.35 -2.54 115.11 117.74 1l7c h GLN 590 Ca 0.20 -0.24 -0.02 0.00 -1.45 0.00 0.00 58.65 57.14 1l7c h GLN 590 Cb -0.08 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.33 1l7c h GLN 590 CO -0.05 0.80 -0.24 0.28 -0.95 0.00 0.00 178.83 178.68 1l7c h VAL 591 N 0.37 0.52 -0.88 -0.54 2.07 -0.43 -0.14 116.25 117.22 1l7c h VAL 591 Ca 0.08 -0.01 0.13 0.00 0.82 0.00 0.00 66.70 67.71 1l7c h VAL 591 Cb 0.59 0.53 -0.09 0.00 -1.52 0.00 0.00 31.29 30.80 1l7c h VAL 591 CO 0.03 0.00 0.49 -0.33 0.02 0.00 0.00 177.57 177.79 1l7c h GLU 592 N -0.67 0.73 -0.64 1.57 5.08 -1.07 0.22 114.58 119.81 1l7c h GLU 592 Ca -0.07 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.16 1l7c h GLU 592 Cb 0.51 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1l7c h GLU 592 CO 0.11 0.48 0.07 0.00 -1.00 0.00 0.00 179.01 178.67 1l7c h ALA 593 N 1.53 0.85 -0.46 3.43 0.00 -1.21 0.16 119.26 123.56 1l7c h ALA 593 Ca 0.45 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1l7c h ALA 593 Cb 0.54 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1l7c h ALA 593 CO -0.31 0.65 -0.02 0.00 0.00 0.00 0.00 179.25 179.57 1l7c h ALA 594 N 1.02 0.62 0.00 0.00 0.00 0.52 -0.18 119.26 121.24 1l7c h ALA 594 Ca 0.19 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1l7c h ALA 594 Cb 0.48 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1l7c h ALA 594 CO 0.02 0.43 0.00 0.28 0.00 0.00 0.00 179.25 179.98 1l7c n VAL 595 N -4.36 0.76 -0.01 0.00 0.31 0.63 -2.39 118.33 113.28 1l7c n VAL 595 Ca 0.00 0.13 -0.01 0.00 -0.01 0.00 0.00 64.34 64.45 1l7c n VAL 595 Cb 0.32 -0.96 -0.01 0.00 -0.91 0.00 0.00 33.84 32.28 1l7c n VAL 595 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1l7c h GLU 596 N 0.00 -0.07 0.00 5.55 4.57 0.81 -3.22 114.58 122.22 1l7c h GLU 596 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1l7c h GLU 596 Cb 0.40 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1l7c h GLU 596 CO 0.00 -0.05 0.00 0.00 -1.18 0.00 0.00 179.01 177.78 1l7c n ALA 597 N -2.58 -0.25 -0.17 2.92 0.00 -0.23 -3.04 120.51 117.16 1l7c n ALA 597 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.39 1l7c n ALA 597 Cb 0.03 0.20 -0.04 0.00 0.00 0.00 0.00 19.45 19.64 1l7c n ALA 597 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1l7c n LEU 598 N -2.22 -0.42 -1.51 0.00 4.77 -1.00 0.14 117.00 116.75 1l7c n LEU 598 Ca 0.00 0.72 -0.06 0.00 -0.03 0.00 0.00 56.01 56.64 1l7c n LEU 598 Cb 0.00 -0.10 0.02 0.00 -2.33 0.00 0.00 43.42 41.01 1l7c n LEU 598 CO 0.00 -0.58 0.93 -1.54 -1.33 0.00 0.00 177.39 174.87 1l7c n SER 599 N -4.44 4.85 -3.55 -1.43 3.41 -1.17 -4.82 113.62 106.48 1l7c n SER 599 Ca 0.01 -2.55 -0.09 0.00 -0.26 0.00 0.00 58.87 55.98 1l7c n SER 599 Cb 0.10 -0.91 -0.02 0.00 -0.26 0.00 0.00 64.21 63.12 1l7c n SER 599 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1l7c s SER 600 N 1.01 0.06 0.00 4.04 1.04 0.38 -5.01 113.70 115.21 1l7c s SER 600 Ca 0.12 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.55 1l7c s SER 600 Cb 0.10 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.93 1l7c s SER 600 CO 0.01 -1.37 0.44 0.47 0.98 0.00 0.00 173.24 173.77 1l7c n ASP 601 N -0.85 1.28 -4.51 7.02 8.00 -1.26 -4.92 116.55 121.31 1l7c n ASP 601 Ca -0.04 -0.90 -0.43 0.00 0.71 0.00 0.00 54.79 54.13 1l7c n ASP 601 Cb 0.61 -0.23 -0.05 0.00 -0.02 0.00 0.00 41.12 41.42 1l7c n ASP 601 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1l7c s ASP 607 N 1.21 6.34 0.16 -2.24 -1.08 -1.26 -4.88 116.67 114.92 1l7c s ASP 607 Ca 0.00 -0.39 -0.09 0.00 -0.52 0.00 0.00 52.55 51.54 1l7c s ASP 607 Cb 0.00 -2.38 0.01 0.00 -1.46 0.00 0.00 42.92 39.08 1l7c s ASP 607 CO 0.00 -1.04 1.50 -0.08 0.52 0.00 0.00 175.17 176.07 1l7c h GLU 608 N 9.12 0.88 0.00 4.34 4.81 -2.03 -3.08 114.58 128.62 1l7c h GLU 608 Ca -0.26 -0.46 -0.04 0.00 -0.13 0.00 0.00 59.36 58.47 1l7c h GLU 608 Cb 1.08 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 1l7c h GLU 608 CO 1.01 1.10 -0.21 -0.91 -0.73 0.00 0.00 179.01 179.27 1l7c h ASN 609 N 0.72 0.00 -0.08 1.04 2.35 -2.04 -2.35 115.58 115.22 1l7c h ASN 609 Ca 0.06 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1l7c h ASN 609 Cb 0.96 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.33 1l7c h ASN 609 CO 0.09 0.21 -0.05 -0.08 -1.65 0.00 0.00 177.43 175.95 1l7c h GLU 610 N 0.00 0.18 -0.00 0.81 4.81 -1.97 -1.51 114.58 116.89 1l7c h GLU 610 Ca -0.00 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1l7c h GLU 610 Cb 0.48 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1l7c h GLU 610 CO 0.03 0.57 -0.08 0.35 -0.73 0.00 0.00 179.01 179.14 1l7c h PHE 611 N -0.21 -0.21 -0.87 0.92 3.57 -1.47 0.52 116.94 119.19 1l7c h PHE 611 Ca 0.02 0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.66 1l7c h PHE 611 Cb 0.52 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 39.29 1l7c h PHE 611 CO 0.07 -0.13 0.56 0.82 -2.23 0.00 0.00 178.31 177.41 1l7c h ILE 612 N -0.15 0.85 -0.04 1.41 2.04 -1.38 0.23 117.51 120.47 1l7c h ILE 612 Ca 0.03 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 1l7c h ILE 612 Cb 0.19 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.37 1l7c h ILE 612 CO -0.09 0.13 -0.15 0.44 0.00 0.00 0.00 178.15 178.48 1l7c h ASP 613 N 0.69 0.21 -0.56 1.72 3.32 -0.62 -1.37 116.42 119.80 1l7c h ASP 613 Ca 0.43 -0.62 0.05 0.00 0.02 0.00 0.00 57.03 56.91 1l7c h ASP 613 Cb 0.69 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 40.13 1l7c h ASP 613 CO -0.19 0.79 0.29 0.00 -1.72 0.00 0.00 179.24 178.41 1l7c h ALA 614 N 0.42 0.73 0.12 3.45 0.00 -0.03 -1.32 119.26 122.63 1l7c h ALA 614 Ca -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1l7c h ALA 614 Cb 0.78 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1l7c h ALA 614 CO 0.03 -0.05 -0.06 0.66 0.00 0.00 0.00 179.25 179.83 1l7c h SER 615 N 0.56 -0.14 -0.88 0.00 4.64 -0.60 -2.70 113.55 114.41 1l7c h SER 615 Ca 0.25 -0.27 0.19 0.00 -0.47 0.00 0.00 61.79 61.50 1l7c h SER 615 Cb 0.16 0.04 -0.07 0.00 -0.31 0.00 0.00 62.40 62.22 1l7c h SER 615 CO -0.17 0.20 0.58 -0.09 -0.87 0.00 0.00 176.83 176.48 1l7c h ARG 616 N -0.49 0.43 -0.75 4.77 2.43 -1.08 0.19 114.38 119.87 1l7c h ARG 616 Ca -0.02 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1l7c h ARG 616 Cb 0.40 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 1l7c h ARG 616 CO 0.03 0.28 0.50 1.25 -1.51 0.00 0.00 179.97 180.52 1l7c h LEU 617 N 0.44 0.86 -0.73 3.80 5.85 -0.92 -1.07 115.31 123.55 1l7c h LEU 617 Ca 0.46 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.16 1l7c h LEU 617 Cb 1.09 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.86 1l7c h LEU 617 CO -0.18 0.63 0.48 0.58 -0.34 0.00 0.00 178.44 179.61 1l7c h VAL 618 N 1.02 1.19 -0.64 1.05 2.07 -0.45 -0.66 116.25 119.84 1l7c h VAL 618 Ca 0.28 -0.36 -0.07 0.00 0.82 0.00 0.00 66.70 67.37 1l7c h VAL 618 Cb -0.12 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 29.75 1l7c h VAL 618 CO -0.06 0.19 0.14 0.22 0.02 0.00 0.00 177.57 178.08 1l7c h TYR 619 N 1.00 1.08 -0.63 1.57 3.20 -1.12 -2.72 116.97 119.34 1l7c h TYR 619 Ca 0.27 -0.14 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 1l7c h TYR 619 Cb -0.10 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 37.84 1l7c h TYR 619 CO -0.02 0.91 0.23 -0.44 -1.64 0.00 0.00 178.16 177.19 1l7c h ASP 620 N 0.94 0.87 -0.03 -2.11 3.32 -0.51 -1.42 116.42 117.49 1l7c h ASP 620 Ca 0.20 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 1l7c h ASP 620 Cb 0.38 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1l7c h ASP 620 CO 0.01 0.80 -0.20 1.23 -1.72 0.00 0.00 179.24 179.35 1l7c h GLY 621 N 1.02 0.43 1.02 2.75 0.00 -0.99 -0.18 103.07 107.13 1l7c h GLY 621 Ca 0.21 -0.32 -0.15 0.00 0.00 0.00 0.00 47.33 47.07 1l7c h GLY 621 CO -0.01 0.30 -0.40 -2.22 0.00 0.00 0.00 176.54 174.20 1l7c h ILE 622 N 0.36 1.30 -0.50 2.60 1.08 -1.12 -1.67 117.51 119.56 1l7c h ILE 622 Ca 0.06 -1.60 -0.10 0.00 -0.39 0.00 0.00 64.86 62.84 1l7c h ILE 622 Cb 0.57 1.68 -0.02 0.00 -3.07 0.00 0.00 36.82 35.97 1l7c h ILE 622 CO 0.04 0.51 -0.07 -0.09 -0.69 0.00 0.00 178.15 177.85 1l7c h ARG 623 N 0.48 0.90 -0.54 2.37 2.43 -1.11 -0.88 114.38 118.04 1l7c h ARG 623 Ca 0.02 -0.29 -0.09 0.00 -0.81 0.00 0.00 59.98 58.81 1l7c h ARG 623 Cb 1.00 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.45 1l7c h ARG 623 CO 0.09 0.94 -0.01 -0.44 -1.51 0.00 0.00 179.97 179.04 1l7c h ASP 624 N 0.82 0.89 -0.01 -3.80 3.32 -0.94 0.10 116.42 116.80 1l7c h ASP 624 Ca 0.14 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 1l7c h ASP 624 Cb 0.58 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 1l7c h ASP 624 CO 0.04 0.96 0.00 0.40 -1.72 0.00 0.00 179.24 178.91 1l7c h ILE 625 N 0.85 1.21 0.11 0.35 2.04 -1.04 -0.64 117.51 120.38 1l7c h ILE 625 Ca 0.16 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.42 1l7c h ILE 625 Cb 0.51 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 1l7c h ILE 625 CO 0.03 0.16 -0.26 -0.09 0.00 0.00 0.00 178.15 177.99 1l7c h ARG 626 N -0.25 -0.44 -0.66 2.37 2.43 -0.83 -0.29 114.38 116.71 1l7c h ARG 626 Ca 0.00 0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.30 1l7c h ARG 626 Cb 0.26 0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 29.83 1l7c h ARG 626 CO 0.00 -0.29 0.27 0.87 -1.51 0.00 0.00 179.97 179.30 1l7c h LYS 627 N -0.46 0.44 -0.99 0.20 1.57 -0.76 -0.69 116.57 115.88 1l7c h LYS 627 Ca 0.03 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1l7c h LYS 627 Cb 0.49 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 1l7c h LYS 627 CO -0.15 0.29 0.65 0.00 -0.57 0.00 0.00 179.45 179.67 1l7c h ALA 628 N 1.44 1.37 0.00 3.86 0.00 -0.48 -1.06 119.26 124.40 1l7c h ALA 628 Ca 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1l7c h ALA 628 Cb 0.42 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1l7c h ALA 628 CO -0.32 0.52 0.00 0.28 0.00 0.00 0.00 179.25 179.73 1l7c h VAL 629 N 1.23 0.00 -0.00 0.00 2.07 0.38 -3.45 116.25 116.48 1l7c h VAL 629 Ca 0.40 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1l7c h VAL 629 Cb 0.05 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1l7c h VAL 629 CO -0.13 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.64