#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a2n s ALA 484 N 0.00 2.53 0.73 -1.58 0.00 -1.26 -5.00 121.76 117.18 2a2n s ALA 484 Ca 0.00 0.65 -0.11 0.00 0.00 0.00 0.00 51.96 52.50 2a2n s ALA 484 Cb 0.00 -3.34 0.03 0.00 0.00 0.00 0.00 23.12 19.81 2a2n s ALA 484 CO 0.00 -1.14 1.08 -1.21 0.00 0.00 0.00 175.76 174.49 2a2n s GLU 485 N -3.82 2.62 0.00 0.00 2.02 -1.26 -5.03 118.70 113.23 2a2n s GLU 485 Ca 0.69 0.77 0.00 0.00 0.02 0.00 0.00 54.97 56.45 2a2n s GLU 485 Cb -0.22 -1.97 0.00 0.00 0.10 0.00 0.00 34.13 32.04 2a2n s GLU 485 CO 0.37 -1.27 0.00 0.41 0.02 0.00 0.00 175.26 174.79 2a2n n GLY 486 N -2.18 3.51 3.85 -1.39 0.00 -1.26 -5.09 105.19 102.62 2a2n n GLY 486 Ca 0.07 -1.85 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 2a2n n GLY 486 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2a2n s PRO 487 N -2.83 3.92 0.36 1.61 0.04 -1.26 -5.08 135.00 131.77 2a2n s PRO 487 Ca 0.00 0.92 0.04 0.00 0.04 0.00 0.00 61.00 62.00 2a2n s PRO 487 Cb 0.00 -2.14 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 2a2n s PRO 487 CO 0.00 -0.28 0.06 0.15 0.04 0.00 0.00 177.00 176.97 2a2n s LYS 488 N -4.14 1.78 0.00 4.56 1.02 -1.26 -5.06 119.74 116.64 2a2n s LYS 488 Ca 0.58 -2.02 0.00 0.00 0.02 0.00 0.00 55.97 54.55 2a2n s LYS 488 Cb -0.10 -0.94 0.00 0.00 -0.52 0.00 0.00 37.83 36.27 2a2n s LYS 488 CO 0.33 -0.24 0.70 0.54 -0.92 0.00 0.00 175.35 175.76 2a2n n ARG 489 N -0.80 1.34 -2.46 1.68 1.74 -1.26 -5.06 116.66 111.83 2a2n n ARG 489 Ca -0.04 -0.94 -0.23 0.00 -0.77 0.00 0.00 57.85 55.86 2a2n n ARG 489 Cb 0.66 -0.80 0.07 0.00 -1.02 0.00 0.00 32.46 31.38 2a2n n ARG 489 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2a2n s VAL 490 N -0.48 2.38 0.17 1.55 -7.23 -1.26 -4.51 120.40 111.02 2a2n s VAL 490 Ca 0.00 -0.50 -0.16 0.00 -1.81 0.00 0.00 61.98 59.51 2a2n s VAL 490 Cb 0.00 -2.88 0.03 0.00 0.56 0.00 0.00 36.38 34.09 2a2n s VAL 490 CO 0.00 0.00 0.46 -0.55 -0.31 0.00 0.00 175.10 174.70 2a2n s SER 491 N -4.56 -0.22 0.00 4.85 0.15 -1.26 -5.05 113.70 107.61 2a2n s SER 491 Ca 0.61 -0.47 0.20 0.00 0.70 0.00 0.00 55.95 56.99 2a2n s SER 491 Cb -0.09 0.53 0.45 0.00 -1.71 0.00 0.00 66.02 65.20 2a2n s SER 491 CO 0.42 -0.97 1.38 -0.90 1.20 0.00 0.00 173.24 174.37 2a2n n ASP 492 N -0.29 3.41 -3.55 5.45 5.75 -1.26 -4.55 116.55 121.51 2a2n n ASP 492 Ca -0.12 -1.96 -0.13 0.00 -0.01 0.00 0.00 54.79 52.58 2a2n n ASP 492 Cb 0.63 -0.30 -0.04 0.00 -1.03 0.00 0.00 41.12 40.37 2a2n n ASP 492 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2a2n s SER 493 N -1.20 -0.43 0.14 -1.12 1.04 -1.26 -0.67 113.70 110.20 2a2n s SER 493 Ca 0.37 0.04 -0.14 0.00 0.48 0.00 0.00 55.95 56.70 2a2n s SER 493 Cb 0.21 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.86 2a2n s SER 493 CO 0.28 -0.80 0.38 0.00 0.98 0.00 0.00 173.24 174.08 2a2n s ALA 494 N -3.01 -0.70 -0.15 5.32 0.00 -0.22 -1.29 121.76 121.72 2a2n s ALA 494 Ca -0.02 -0.29 0.01 0.00 0.00 0.00 0.00 51.96 51.65 2a2n s ALA 494 Cb -0.00 0.73 0.02 0.00 0.00 0.00 0.00 23.12 23.86 2a2n s ALA 494 CO -0.06 -0.66 -0.15 0.42 0.00 0.00 0.00 175.76 175.30 2a2n s ILE 495 N -3.85 1.64 -0.34 0.00 1.01 0.42 -0.46 121.20 119.62 2a2n s ILE 495 Ca 0.07 -0.68 -0.20 0.00 0.00 0.00 0.00 60.65 59.84 2a2n s ILE 495 Cb 0.02 -1.53 -0.00 0.00 0.01 0.00 0.00 42.46 40.96 2a2n s ILE 495 CO -0.08 0.47 0.59 -0.63 0.00 0.00 0.00 174.94 175.29 2a2n s ILE 496 N 1.42 4.94 -0.51 2.92 1.01 0.75 -1.24 121.20 130.48 2a2n s ILE 496 Ca 0.04 0.56 -0.20 0.00 0.00 0.00 0.00 60.65 61.04 2a2n s ILE 496 Cb -0.13 -4.02 0.05 0.00 0.01 0.00 0.00 42.46 38.37 2a2n s ILE 496 CO -0.10 -0.25 0.70 -1.00 0.00 0.00 0.00 174.94 174.29 2a2n s HIS 497 N 2.59 2.99 0.44 3.97 3.76 -0.20 -0.57 115.29 128.26 2a2n s HIS 497 Ca 0.23 -0.41 0.08 0.00 -0.15 0.00 0.00 55.06 54.80 2a2n s HIS 497 Cb -0.15 -3.65 0.01 0.00 1.11 0.00 0.00 32.58 29.90 2a2n s HIS 497 CO 0.14 -1.10 0.52 0.95 -0.85 0.00 0.00 174.74 174.40 2a2n s THR 498 N 2.93 2.73 -0.77 1.30 -4.23 -0.28 0.24 115.64 117.56 2a2n s THR 498 Ca 0.19 -1.14 0.14 0.00 -1.18 0.00 0.00 61.69 59.70 2a2n s THR 498 Cb -0.18 -2.87 0.14 0.00 1.34 0.00 0.00 72.50 70.93 2a2n s THR 498 CO 0.14 0.00 1.44 -1.54 -0.54 0.00 0.00 174.62 174.12 2a2n n SER 499 N -1.78 0.23 -0.11 3.99 3.41 0.71 -2.09 113.62 117.98 2a2n n SER 499 Ca 0.07 0.57 0.04 0.00 -0.26 0.00 0.00 58.87 59.29 2a2n n SER 499 Cb 0.60 -0.62 0.07 0.00 -0.26 0.00 0.00 64.21 64.01 2a2n n SER 499 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2a2n n MET 500 N -1.77 2.43 0.00 4.33 2.81 -1.26 -4.99 117.12 118.66 2a2n n MET 500 Ca 0.02 -1.95 0.00 0.00 -1.81 0.00 0.00 57.70 53.95 2a2n n MET 500 Cb 0.13 -1.22 0.00 0.00 -0.71 0.00 0.00 33.22 31.42 2a2n n MET 500 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2a2n n GLY 501 N -0.73 1.01 3.79 3.03 0.00 -0.89 -4.90 105.19 106.49 2a2n n GLY 501 Ca 0.07 -2.15 -0.37 0.00 0.00 0.00 0.00 46.02 43.56 2a2n n GLY 501 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a2n s ASP 502 N 0.00 6.63 -0.28 1.61 1.11 -1.26 -1.13 116.67 123.35 2a2n s ASP 502 Ca 0.00 0.75 -0.02 0.00 0.18 0.00 0.00 52.55 53.46 2a2n s ASP 502 Cb 0.00 -2.22 0.04 0.00 1.07 0.00 0.00 42.92 41.81 2a2n s ASP 502 CO 0.00 0.21 -0.01 -0.63 1.18 0.00 0.00 175.17 175.92 2a2n s ILE 503 N -0.31 3.03 -0.21 0.77 1.01 0.26 -4.28 121.20 121.48 2a2n s ILE 503 Ca 0.21 -1.22 -0.20 0.00 0.00 0.00 0.00 60.65 59.44 2a2n s ILE 503 Cb -0.15 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.63 2a2n s ILE 503 CO 0.09 0.00 0.61 -1.00 0.00 0.00 0.00 174.94 174.65 2a2n s HIS 504 N 1.30 3.36 -0.13 3.97 3.76 0.76 -0.18 115.29 128.13 2a2n s HIS 504 Ca -0.03 0.89 0.03 0.00 -0.15 0.00 0.00 55.06 55.80 2a2n s HIS 504 Cb -0.19 -2.79 0.01 0.00 1.11 0.00 0.00 32.58 30.72 2a2n s HIS 504 CO -0.02 -0.19 -0.22 0.95 -0.85 0.00 0.00 174.74 174.41 2a2n s THR 505 N 1.96 2.02 0.21 1.30 -4.23 0.39 -0.65 115.64 116.64 2a2n s THR 505 Ca 0.28 -0.97 -0.30 0.00 -1.18 0.00 0.00 61.69 59.52 2a2n s THR 505 Cb -0.16 -1.77 -0.08 0.00 1.34 0.00 0.00 72.50 71.83 2a2n s THR 505 CO 0.10 0.54 0.96 -0.75 -0.54 0.00 0.00 174.62 174.93 2a2n s LYS 506 N 0.68 4.80 0.27 3.99 2.20 0.10 -1.06 119.74 130.72 2a2n s LYS 506 Ca -0.11 1.50 0.10 0.00 -0.36 0.00 0.00 55.97 57.11 2a2n s LYS 506 Cb -0.16 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.81 2a2n s LYS 506 CO 0.01 0.42 -0.05 -0.51 -0.36 0.00 0.00 175.35 174.86 2a2n s LEU 507 N -0.89 3.05 -0.72 5.43 1.43 0.16 -1.08 118.68 126.06 2a2n s LEU 507 Ca 0.43 -0.73 0.04 0.00 -1.03 0.00 0.00 54.13 52.83 2a2n s LEU 507 Cb -0.26 -1.58 0.29 0.00 0.03 0.00 0.00 46.19 44.68 2a2n s LEU 507 CO 0.32 0.01 1.00 0.49 0.23 0.00 0.00 176.35 178.41 2a2n n PHE 508 N -0.80 3.48 0.24 0.29 3.72 -0.37 -4.69 117.46 119.32 2a2n n PHE 508 Ca -0.06 -3.74 0.13 0.00 -0.05 0.00 0.00 57.45 53.73 2a2n n PHE 508 Cb 0.59 -0.70 0.49 0.00 -0.94 0.00 0.00 39.48 38.92 2a2n n PHE 508 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2a2n h PRO 509 N 4.06 0.00 0.17 -1.08 0.13 -1.81 -0.24 132.00 133.23 2a2n h PRO 509 Ca 0.21 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.33 2a2n h PRO 509 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 2a2n h PRO 509 CO 0.94 0.10 -0.08 0.28 -0.23 0.00 0.00 178.00 179.00 2a2n h VAL 510 N 0.00 0.94 -0.38 1.56 2.07 -1.96 -2.70 116.25 115.79 2a2n h VAL 510 Ca -0.00 -0.64 -0.16 0.00 0.82 0.00 0.00 66.70 66.72 2a2n h VAL 510 Cb 0.71 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 2a2n h VAL 510 CO 0.01 0.15 -0.39 -0.33 0.02 0.00 0.00 177.57 177.02 2a2n h GLU 511 N -0.55 0.94 -2.15 1.57 3.07 -1.97 -3.37 114.58 112.11 2a2n h GLU 511 Ca -0.02 -0.50 -0.57 0.00 -0.50 0.00 0.00 59.36 57.76 2a2n h GLU 511 Cb 0.42 0.02 -0.41 0.00 -0.84 0.00 0.00 28.75 27.93 2a2n h GLU 511 CO 0.04 1.15 -0.79 0.00 -1.40 0.00 0.00 179.01 178.02 2a2n h PRO 513 N 3.69 1.08 -0.43 0.00 0.13 -1.66 -0.81 132.00 134.00 2a2n h PRO 513 Ca 0.14 -0.15 -0.08 0.00 -0.87 0.00 0.00 66.00 65.04 2a2n h PRO 513 Cb 0.70 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 2a2n h PRO 513 CO 0.71 0.83 -0.06 0.87 -0.23 0.00 0.00 178.00 180.13 2a2n h LYS 514 N 1.06 0.79 -0.29 0.86 1.79 -1.93 -0.64 116.57 118.22 2a2n h LYS 514 Ca 0.26 -0.28 -0.06 0.00 -2.18 0.00 0.00 60.65 58.39 2a2n h LYS 514 Cb 0.09 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 2a2n h LYS 514 CO -0.04 0.89 -0.06 1.15 -1.08 0.00 0.00 179.45 180.32 2a2n h THR 515 N 0.62 1.28 -0.42 -0.16 2.02 -1.86 -0.25 112.91 114.14 2a2n h THR 515 Ca 0.11 -1.07 -0.13 0.00 0.77 0.00 0.00 66.41 66.09 2a2n h THR 515 Cb 0.57 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 2a2n h THR 515 CO 0.03 0.34 -0.26 0.58 0.37 0.00 0.00 175.52 176.59 2a2n h VAL 516 N 0.31 1.27 -0.23 3.16 2.07 -1.15 -1.89 116.25 119.79 2a2n h VAL 516 Ca 0.07 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.19 2a2n h VAL 516 Cb 0.53 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2a2n h VAL 516 CO 0.03 0.48 0.14 -0.08 0.02 0.00 0.00 177.57 178.15 2a2n h GLU 517 N 0.75 0.31 -0.41 1.57 4.81 -0.98 0.27 114.58 120.90 2a2n h GLU 517 Ca 0.09 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.37 2a2n h GLU 517 Cb 0.81 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 30.06 2a2n h GLU 517 CO 0.07 0.25 0.05 -0.97 -0.73 0.00 0.00 179.01 177.67 2a2n h ASN 518 N 0.29 -0.07 -0.19 1.04 -0.00 -0.93 0.95 115.58 116.66 2a2n h ASN 518 Ca 0.08 0.08 -0.03 0.00 -0.00 0.00 0.00 56.30 56.44 2a2n h ASN 518 Cb 0.01 0.13 -0.01 0.00 -0.00 0.00 0.00 38.32 38.46 2a2n h ASN 518 CO -0.02 -0.00 0.00 0.15 -0.00 0.00 0.00 177.43 177.56 2a2n h PHE 519 N 0.16 0.36 -0.45 0.67 3.57 -0.93 -1.19 116.94 119.13 2a2n h PHE 519 Ca 0.20 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 2a2n h PHE 519 Cb 0.27 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 2a2n h PHE 519 CO -0.23 0.53 0.06 0.00 -2.23 0.00 0.00 178.31 176.43 2a2n h VAL 521 N 0.62 1.30 -0.63 0.00 2.07 -0.81 -0.47 116.25 118.34 2a2n h VAL 521 Ca 0.14 -1.28 0.06 0.00 0.82 0.00 0.00 66.70 66.44 2a2n h VAL 521 Cb 0.41 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.69 2a2n h VAL 521 CO 0.01 0.40 0.33 0.45 0.02 0.00 0.00 177.57 178.78 2a2n h HIS 522 N 0.30 0.59 0.19 1.57 -0.00 -1.13 -1.17 115.15 115.51 2a2n h HIS 522 Ca 0.05 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.44 2a2n h HIS 522 Cb 0.69 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.93 2a2n h HIS 522 CO 0.07 0.27 -0.09 0.77 -0.00 0.00 0.00 177.93 178.94 2a2n h SER 523 N 0.60 -0.22 -0.30 2.45 0.02 -0.69 -0.28 113.55 115.14 2a2n h SER 523 Ca 0.29 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.18 2a2n h SER 523 Cb 0.21 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 2a2n h SER 523 CO -0.20 -0.14 0.05 0.03 -1.14 0.00 0.00 176.83 175.44 2a2n h ARG 524 N -0.28 0.59 0.00 3.45 3.08 -0.98 -1.28 114.38 118.96 2a2n h ARG 524 Ca -0.03 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.91 2a2n h ARG 524 Cb 0.21 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2a2n h ARG 524 CO 0.04 0.57 0.00 0.09 -1.07 0.00 0.00 179.97 179.61 2a2n n ASN 525 N -4.30 0.18 -0.14 7.04 3.02 -0.45 -4.89 115.26 115.73 2a2n n ASN 525 Ca 0.02 0.54 -0.02 0.00 -0.03 0.00 0.00 54.58 55.10 2a2n n ASN 525 Cb 0.22 -0.58 -0.01 0.00 -0.61 0.00 0.00 39.78 38.80 2a2n n ASN 525 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2a2n n GLY 526 N 0.04 0.54 0.25 7.41 0.00 -0.48 -4.93 105.19 108.02 2a2n n GLY 526 Ca 0.03 -0.59 0.03 0.00 0.00 0.00 0.00 46.02 45.50 2a2n n GLY 526 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2a2n h TYR 527 N 0.00 0.26 -0.01 1.61 3.20 -1.28 -2.07 116.97 118.68 2a2n h TYR 527 Ca -0.04 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.81 2a2n h TYR 527 Cb 0.17 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.36 2a2n h TYR 527 CO 0.08 0.34 -0.12 0.66 -1.64 0.00 0.00 178.16 177.48 2a2n n TYR 528 N -4.32 0.00 -1.90 -3.82 4.01 -1.26 -4.86 117.16 105.01 2a2n n TYR 528 Ca -0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 2a2n n TYR 528 Cb 0.23 -0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.19 2a2n n TYR 528 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2a2n s ASN 529 N -2.21 6.59 0.00 7.72 -0.87 -0.78 -1.44 114.94 123.95 2a2n s ASN 529 Ca 0.31 2.47 0.00 0.00 -1.57 0.00 0.00 52.86 54.07 2a2n s ASN 529 Cb 0.20 -2.55 0.00 0.00 -0.02 0.00 0.00 41.25 38.88 2a2n s ASN 529 CO 0.41 -0.92 0.00 0.61 -2.57 0.00 0.00 177.10 174.63 2a2n n GLY 530 N 4.11 1.33 3.71 0.66 0.00 0.20 -5.02 105.19 110.18 2a2n n GLY 530 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2a2n n GLY 530 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2a2n n HIS 531 N -2.00 2.05 -3.29 1.61 8.25 -0.52 -4.66 115.22 116.66 2a2n n HIS 531 Ca 0.00 0.46 -0.25 0.00 -0.26 0.00 0.00 57.72 57.67 2a2n n HIS 531 Cb 0.00 -2.34 -0.01 0.00 1.12 0.00 0.00 29.99 28.75 2a2n n HIS 531 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2a2n s THR 532 N -1.27 5.07 -0.84 1.59 -4.23 -1.26 -0.22 115.64 114.48 2a2n s THR 532 Ca 0.67 -0.30 -0.22 0.00 -1.18 0.00 0.00 61.69 60.66 2a2n s THR 532 Cb -0.46 -3.84 0.09 0.00 1.34 0.00 0.00 72.50 69.63 2a2n s THR 532 CO 0.53 -0.54 1.15 -0.36 -0.54 0.00 0.00 174.62 174.86 2a2n s PHE 533 N -2.32 2.78 -0.80 3.99 0.08 0.73 -4.12 117.98 118.34 2a2n s PHE 533 Ca 0.41 -0.89 0.26 0.00 0.12 0.00 0.00 56.93 56.83 2a2n s PHE 533 Cb -0.10 -4.40 0.72 0.00 -0.57 0.00 0.00 43.02 38.67 2a2n s PHE 533 CO 0.36 -1.68 1.62 -2.39 -0.10 0.00 0.00 175.22 173.03 2a2n n HIS 534 N 7.63 0.50 -3.68 0.36 1.44 -0.73 -4.56 115.22 116.18 2a2n n HIS 534 Ca 0.15 0.15 -0.22 0.00 -2.01 0.00 0.00 57.72 55.78 2a2n n HIS 534 Cb 0.48 -0.67 -0.18 0.00 0.12 0.00 0.00 29.99 29.75 2a2n n HIS 534 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 2a2n s ARG 535 N -3.09 0.11 -0.08 -1.40 3.52 -1.22 -4.00 118.95 112.79 2a2n s ARG 535 Ca 0.10 0.20 -0.00 0.00 -0.13 0.00 0.00 55.73 55.89 2a2n s ARG 535 Cb 0.15 -0.95 0.02 0.00 -1.56 0.00 0.00 34.95 32.61 2a2n s ARG 535 CO 0.63 -0.41 -0.04 0.42 -0.81 0.00 0.00 175.30 175.09 2a2n s ILE 536 N 2.11 0.68 -0.25 4.11 1.01 0.30 -0.76 121.20 128.40 2a2n s ILE 536 Ca 0.04 -0.10 0.02 0.00 0.00 0.00 0.00 60.65 60.61 2a2n s ILE 536 Cb -0.13 -0.75 0.06 0.00 0.01 0.00 0.00 42.46 41.66 2a2n s ILE 536 CO -0.05 0.30 -0.07 -0.63 0.00 0.00 0.00 174.94 174.49 2a2n s ILE 537 N 1.60 1.74 0.19 2.92 1.01 -0.51 -4.75 121.20 123.40 2a2n s ILE 537 Ca 0.01 -1.38 -0.33 0.00 0.00 0.00 0.00 60.65 58.95 2a2n s ILE 537 Cb -0.13 -1.97 -0.15 0.00 0.01 0.00 0.00 42.46 40.22 2a2n s ILE 537 CO -0.05 -0.10 1.28 1.17 0.00 0.00 0.00 174.94 177.24 2a2n n LYS 538 N 4.59 1.51 -1.08 2.79 4.81 -1.24 -1.08 118.16 128.46 2a2n n LYS 538 Ca -0.12 0.54 -0.03 0.00 -0.87 0.00 0.00 58.31 57.83 2a2n n LYS 538 Cb 0.43 -2.11 -0.01 0.00 0.02 0.00 0.00 35.03 33.36 2a2n n LYS 538 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2a2n n GLY 539 N 2.17 0.52 1.01 3.14 0.00 -1.26 -4.80 105.19 105.96 2a2n n GLY 539 Ca 0.14 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2a2n n GLY 539 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2a2n n PHE 540 N -2.60 0.00 -3.61 1.61 7.35 -0.24 -4.70 117.46 115.26 2a2n n PHE 540 Ca -0.03 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.62 2a2n n PHE 540 Cb 0.25 0.20 -0.02 0.00 0.35 0.00 0.00 39.48 40.26 2a2n n PHE 540 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2a2n s MET 541 N -0.61 0.74 -0.02 -4.13 0.23 -0.86 -1.35 119.30 113.29 2a2n s MET 541 Ca 0.00 -0.35 0.08 0.00 -1.03 0.00 0.00 55.69 54.39 2a2n s MET 541 Cb 0.00 0.29 -0.02 0.00 -1.53 0.00 0.00 34.83 33.57 2a2n s MET 541 CO 0.00 -0.33 -0.26 0.96 -2.03 0.00 0.00 175.02 173.36 2a2n s ILE 542 N -2.89 2.04 0.03 3.16 -4.36 0.06 -1.43 121.20 117.81 2a2n s ILE 542 Ca 0.10 -1.10 0.05 0.00 -0.26 0.00 0.00 60.65 59.44 2a2n s ILE 542 Cb 0.00 -1.70 -0.02 0.00 1.25 0.00 0.00 42.46 41.99 2a2n s ILE 542 CO -0.04 0.58 -0.15 -1.58 0.24 0.00 0.00 174.94 173.99 2a2n s GLN 543 N -0.55 1.03 0.10 0.37 0.74 0.06 -0.74 119.66 120.68 2a2n s GLN 543 Ca 0.08 -0.73 -0.03 0.00 0.05 0.00 0.00 55.36 54.73 2a2n s GLN 543 Cb -0.10 -1.05 0.01 0.00 1.10 0.00 0.00 33.01 32.97 2a2n s GLN 543 CO -0.00 0.27 0.19 -2.37 -0.55 0.00 0.00 175.29 172.82 2a2n n THR 544 N 2.07 0.00 -0.18 -0.34 5.66 -0.50 -1.78 114.28 119.21 2a2n n THR 544 Ca -0.17 -0.32 0.00 0.00 -3.05 0.00 0.00 64.05 60.51 2a2n n THR 544 Cb 0.55 0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.60 2a2n n THR 544 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2a2n n GLY 545 N -0.14 0.90 3.42 1.09 0.00 -1.26 -1.74 105.19 107.46 2a2n n GLY 545 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 2a2n n GLY 545 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2a2n s ASP 546 N -2.02 5.62 0.54 1.61 -1.08 -1.26 -3.57 116.67 116.51 2a2n s ASP 546 Ca 0.00 -0.67 0.21 0.00 -0.52 0.00 0.00 52.55 51.57 2a2n s ASP 546 Cb 0.00 -2.01 1.39 0.00 -1.46 0.00 0.00 42.92 40.84 2a2n s ASP 546 CO 0.00 -0.26 2.11 -0.65 0.52 0.00 0.00 175.17 176.89 2a2n h PRO 547 N 8.38 0.00 0.00 4.34 0.11 -1.93 0.23 132.00 143.14 2a2n h PRO 547 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2a2n h PRO 547 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2a2n h PRO 547 CO 0.63 0.00 -0.20 1.79 -0.21 0.00 0.00 178.00 180.01 2a2n h THR 548 N 0.00 0.00 -0.18 -1.15 1.35 -1.93 -3.48 112.91 107.51 2a2n h THR 548 Ca 0.08 -0.71 -0.08 0.00 -0.55 0.00 0.00 66.41 65.16 2a2n h THR 548 Cb 0.35 1.59 -0.03 0.00 -1.73 0.00 0.00 68.15 68.33 2a2n h THR 548 CO -0.00 0.00 -0.07 0.61 -0.25 0.00 0.00 175.52 175.81 2a2n n GLY 549 N 1.23 0.59 0.00 5.82 0.00 0.07 -4.88 105.19 108.03 2a2n n GLY 549 Ca 0.04 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.93 2a2n n GLY 549 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2a2n n THR 550 N -2.58 0.00 0.00 2.61 -2.24 -1.26 -4.83 114.28 105.98 2a2n n THR 550 Ca -0.04 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2a2n n THR 550 Cb 0.28 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 2a2n n THR 550 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a2n n GLY 551 N 1.49 1.36 0.56 3.38 0.00 -1.26 -4.93 105.19 105.79 2a2n n GLY 551 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.12 2a2n n GLY 551 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2a2n n MET 552 N -2.00 1.42 -3.44 1.61 2.81 -1.26 -5.03 117.12 111.23 2a2n n MET 552 Ca 0.00 -1.13 -0.17 0.00 -1.81 0.00 0.00 57.70 54.59 2a2n n MET 552 Cb 0.00 -1.46 -0.04 0.00 -0.71 0.00 0.00 33.22 31.02 2a2n n MET 552 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2a2n n GLY 553 N 1.38 3.82 0.00 3.03 0.00 -1.26 -5.08 105.19 107.07 2a2n n GLY 553 Ca 0.10 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.86 2a2n n GLY 553 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a2n n GLY 554 N 1.51 -1.13 3.50 -0.02 0.00 -1.26 -4.70 105.19 103.10 2a2n n GLY 554 Ca -0.10 -1.49 -0.09 0.00 0.00 0.00 0.00 46.02 44.33 2a2n n GLY 554 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2a2n s GLU 555 N -3.67 1.42 0.93 1.61 -1.05 -1.26 -4.52 118.70 112.16 2a2n s GLU 555 Ca 0.00 -1.21 -0.12 0.00 -0.15 0.00 0.00 54.97 53.49 2a2n s GLU 555 Cb 0.00 0.44 0.15 0.00 -0.44 0.00 0.00 34.13 34.28 2a2n s GLU 555 CO 0.00 -0.57 1.10 -1.54 0.95 0.00 0.00 175.26 175.20 2a2n s SER 556 N -3.00 3.27 0.17 0.83 1.04 0.39 -3.78 113.70 112.62 2a2n s SER 556 Ca 0.21 1.21 0.16 0.00 0.48 0.00 0.00 55.95 58.01 2a2n s SER 556 Cb 0.01 -1.87 0.77 0.00 0.10 0.00 0.00 66.02 65.02 2a2n s SER 556 CO 0.06 -2.73 1.50 2.30 0.98 0.00 0.00 173.24 175.35 2a2n n ILE 557 N -3.92 1.16 1.15 -1.02 -5.35 -1.26 -1.72 119.36 108.41 2a2n n ILE 557 Ca 0.06 0.44 0.12 0.00 -0.27 0.00 0.00 62.75 63.11 2a2n n ILE 557 Cb 0.57 -1.37 0.27 0.00 -1.74 0.00 0.00 39.64 37.37 2a2n n ILE 557 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 2a2n n TRP 558 N -1.95 0.00 -0.01 4.28 8.01 -1.26 -4.97 117.44 121.54 2a2n n TRP 558 Ca 0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.20 2a2n n TRP 558 Cb 0.11 -0.12 0.00 0.00 -2.01 0.00 0.00 31.31 29.29 2a2n n TRP 558 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2a2n n GLY 559 N 1.39 0.82 0.00 6.99 0.00 -0.70 -5.01 105.19 108.68 2a2n n GLY 559 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2a2n n GLY 559 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a2n n GLY 560 N -2.00 2.88 3.75 -0.02 0.00 -1.26 -4.85 105.19 103.69 2a2n n GLY 560 Ca 0.00 0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2a2n n GLY 560 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a2n s GLU 561 N 4.01 2.69 0.14 1.61 2.02 -1.26 -0.46 118.70 127.45 2a2n s GLU 561 Ca 0.00 -1.03 -0.01 0.00 0.02 0.00 0.00 54.97 53.95 2a2n s GLU 561 Cb 0.00 -2.49 -0.04 0.00 0.10 0.00 0.00 34.13 31.70 2a2n s GLU 561 CO 0.00 0.45 0.08 -0.59 0.02 0.00 0.00 175.26 175.22 2a2n s PHE 562 N -1.86 0.90 0.45 1.61 -0.12 -0.22 -4.90 117.98 113.83 2a2n s PHE 562 Ca 0.30 -1.24 -0.25 0.00 -0.05 0.00 0.00 56.93 55.69 2a2n s PHE 562 Cb -0.09 -0.48 -0.08 0.00 -0.63 0.00 0.00 43.02 41.74 2a2n s PHE 562 CO 0.22 -0.55 1.38 -2.00 -0.05 0.00 0.00 175.22 174.22 2a2n s GLU 563 N -4.06 3.68 0.59 1.99 2.12 -1.26 -2.27 118.70 119.49 2a2n s GLU 563 Ca 0.26 2.30 -0.20 0.00 0.36 0.00 0.00 54.97 57.70 2a2n s GLU 563 Cb 0.07 -2.61 -0.03 0.00 0.26 0.00 0.00 34.13 31.81 2a2n s GLU 563 CO 0.03 -0.78 1.26 -0.25 -0.54 0.00 0.00 175.26 174.99 2a2n n ASP 564 N -0.24 2.10 -3.38 -1.70 8.00 -1.26 -4.87 116.55 115.19 2a2n n ASP 564 Ca 0.06 0.89 -0.26 0.00 0.71 0.00 0.00 54.79 56.19 2a2n n ASP 564 Cb 0.43 -1.53 -0.08 0.00 -0.02 0.00 0.00 41.12 39.91 2a2n n ASP 564 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2a2n n GLU 565 N -1.35 1.63 -2.67 -1.24 1.02 -1.26 -5.02 120.64 111.75 2a2n n GLU 565 Ca 0.13 -4.02 -0.33 0.00 -0.02 0.00 0.00 57.16 52.92 2a2n n GLU 565 Cb 0.46 -1.84 -0.05 0.00 -0.02 0.00 0.00 31.44 29.99 2a2n n GLU 565 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2a2n s PHE 566 N -1.72 3.21 -0.14 -0.32 0.08 -1.26 -4.64 117.98 113.18 2a2n s PHE 566 Ca 0.36 1.58 -0.08 0.00 0.12 0.00 0.00 56.93 58.91 2a2n s PHE 566 Cb 0.13 -2.92 0.05 0.00 -0.57 0.00 0.00 43.02 39.71 2a2n s PHE 566 CO -0.08 -0.41 0.35 -1.58 -0.10 0.00 0.00 175.22 173.41 2a2n s HIS 567 N -2.16 -0.48 0.58 0.36 2.46 -1.26 -5.05 115.29 109.74 2a2n s HIS 567 Ca 0.64 1.07 0.30 0.00 0.47 0.00 0.00 55.06 57.54 2a2n s HIS 567 Cb -0.12 0.18 1.82 0.00 -0.13 0.00 0.00 32.58 34.33 2a2n s HIS 567 CO 0.18 -0.28 2.25 0.66 -2.47 0.00 0.00 174.74 175.07 2a2n h SER 568 N 6.93 0.00 0.82 9.88 4.64 -2.02 0.60 113.55 134.39 2a2n h SER 568 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2a2n h SER 568 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2a2n h SER 568 CO 0.32 0.01 -0.22 0.35 -0.87 0.00 0.00 176.83 176.42 2a2n n THR 569 N -3.82 0.03 -3.70 2.95 -2.24 -1.26 -4.70 114.28 101.54 2a2n n THR 569 Ca -0.03 -0.02 -0.39 0.00 -2.27 0.00 0.00 64.05 61.35 2a2n n THR 569 Cb 0.09 -0.20 -0.12 0.00 -2.10 0.00 0.00 70.33 68.01 2a2n n THR 569 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2a2n s LEU 570 N -3.09 4.58 0.11 3.22 1.43 0.20 -5.07 118.68 120.06 2a2n s LEU 570 Ca 0.12 -1.24 0.06 0.00 -1.03 0.00 0.00 54.13 52.05 2a2n s LEU 570 Cb 0.18 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 2a2n s LEU 570 CO 0.61 -0.39 -0.15 -0.13 0.23 0.00 0.00 176.35 176.52 2a2n s ARG 571 N 1.42 0.99 -0.20 1.70 1.81 -1.26 -4.58 118.95 118.82 2a2n s ARG 571 Ca 0.00 -1.16 -0.03 0.00 -1.72 0.00 0.00 55.73 52.82 2a2n s ARG 571 Cb -0.20 -0.94 -0.02 0.00 -0.45 0.00 0.00 34.95 33.34 2a2n s ARG 571 CO 0.03 0.19 2.74 0.72 -0.68 0.00 0.00 175.30 178.30 2a2n n HIS 572 N 0.76 0.78 1.38 -0.53 8.25 -1.26 -4.47 115.22 120.13 2a2n n HIS 572 Ca -0.17 -1.63 0.14 0.00 -0.26 0.00 0.00 57.72 55.79 2a2n n HIS 572 Cb 0.56 -1.20 0.43 0.00 1.12 0.00 0.00 29.99 30.90 2a2n n HIS 572 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2a2n n ASP 573 N 1.40 1.75 -4.19 0.41 5.75 -1.26 -0.57 116.55 119.84 2a2n n ASP 573 Ca 0.34 -1.55 -0.11 0.00 -0.01 0.00 0.00 54.79 53.46 2a2n n ASP 573 Cb 0.66 0.02 -0.10 0.00 -1.03 0.00 0.00 41.12 40.67 2a2n n ASP 573 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2a2n s ARG 574 N -2.05 0.94 0.87 0.11 1.70 -1.26 -4.77 118.95 114.48 2a2n s ARG 574 Ca 0.35 -1.42 -0.12 0.00 -0.47 0.00 0.00 55.73 54.07 2a2n s ARG 574 Cb 0.21 -0.13 0.11 0.00 -0.57 0.00 0.00 34.95 34.57 2a2n s ARG 574 CO 0.35 -0.11 1.10 -1.25 -1.08 0.00 0.00 175.30 174.31 2a2n s PRO 575 N -3.90 1.50 -1.09 3.89 0.04 -1.26 -4.12 135.00 130.06 2a2n s PRO 575 Ca 0.18 0.61 -0.07 0.00 0.04 0.00 0.00 61.00 61.76 2a2n s PRO 575 Cb 0.06 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.76 2a2n s PRO 575 CO -0.01 -2.02 0.94 0.66 0.04 0.00 0.00 177.00 176.61 2a2n n TYR 576 N -3.70 -2.30 -3.26 0.56 4.01 -0.33 -4.83 117.16 107.32 2a2n n TYR 576 Ca 0.07 0.80 -0.39 0.00 -0.16 0.00 0.00 57.90 58.23 2a2n n TYR 576 Cb 0.57 -4.22 -0.06 0.00 -0.31 0.00 0.00 39.34 35.31 2a2n n TYR 576 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2a2n s THR 577 N -3.25 4.84 -0.25 -0.72 2.01 -1.26 -0.74 115.64 116.28 2a2n s THR 577 Ca 0.47 1.20 -0.09 0.00 0.31 0.00 0.00 61.69 63.57 2a2n s THR 577 Cb -0.20 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 2a2n s THR 577 CO 0.58 0.49 0.11 -0.22 -0.69 0.00 0.00 174.62 174.89 2a2n s LEU 578 N -0.66 3.67 0.05 4.42 2.96 -0.18 -1.68 118.68 127.26 2a2n s LEU 578 Ca 0.29 -0.11 -0.01 0.00 -0.22 0.00 0.00 54.13 54.08 2a2n s LEU 578 Cb -0.19 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 2a2n s LEU 578 CO 0.18 -0.02 -0.03 -0.44 -1.32 0.00 0.00 176.35 174.71 2a2n s SER 579 N 1.55 0.55 0.29 3.68 0.01 -0.47 -0.74 113.70 118.56 2a2n s SER 579 Ca 0.06 -0.94 -0.29 0.00 1.31 0.00 0.00 55.95 56.10 2a2n s SER 579 Cb -0.15 0.17 -0.09 0.00 0.21 0.00 0.00 66.02 66.16 2a2n s SER 579 CO 0.06 -0.55 1.04 -0.04 0.41 0.00 0.00 173.24 174.16 2a2n s MET 580 N -3.61 4.63 -0.00 12.44 -1.94 -0.20 -0.45 119.30 130.16 2a2n s MET 580 Ca 0.05 1.66 -0.00 0.00 -1.71 0.00 0.00 55.69 55.68 2a2n s MET 580 Cb 0.05 -3.10 -0.00 0.00 2.01 0.00 0.00 34.83 33.79 2a2n s MET 580 CO -0.08 0.24 0.40 0.00 -0.01 0.00 0.00 175.02 175.57 2a2n h ALA 581 N 3.68 -0.39 -2.18 3.03 0.00 -1.62 -3.39 119.26 118.39 2a2n h ALA 581 Ca -0.46 -0.00 0.23 0.00 0.00 0.00 0.00 54.91 54.67 2a2n h ALA 581 Cb 1.21 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.90 2a2n h ALA 581 CO 0.66 -0.39 -0.69 0.27 0.00 0.00 0.00 179.25 179.10 2a2n n ASN 582 N -2.10 -5.23 -2.80 0.00 0.23 -1.26 -4.86 115.26 99.23 2a2n n ASN 582 Ca -0.00 0.79 -0.15 0.00 -0.53 0.00 0.00 54.58 54.68 2a2n n ASN 582 Cb 0.01 -3.05 0.00 0.00 -2.08 0.00 0.00 39.78 34.66 2a2n n ASN 582 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2a2n n ALA 583 N -3.25 3.37 0.00 -2.53 0.00 -1.26 -5.06 120.51 111.78 2a2n n ALA 583 Ca -0.04 -3.50 0.00 0.00 0.00 0.00 0.00 53.44 49.90 2a2n n ALA 583 Cb 0.43 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2a2n n ALA 583 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a2n n GLY 584 N -0.04 2.75 3.77 0.00 0.00 -1.26 -4.95 105.19 105.45 2a2n n GLY 584 Ca 0.19 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 2a2n n GLY 584 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a2n s SER 585 N 0.00 6.58 -1.38 1.61 1.04 -1.26 -3.25 113.70 117.03 2a2n s SER 585 Ca 0.00 2.83 -0.07 0.00 0.48 0.00 0.00 55.95 59.19 2a2n s SER 585 Cb 0.00 -2.65 0.03 0.00 0.10 0.00 0.00 66.02 63.50 2a2n s SER 585 CO 0.00 -0.71 0.95 0.59 0.98 0.00 0.00 173.24 175.06 2a2n n ASN 586 N 1.02 -3.73 -0.86 7.02 3.02 -1.26 -4.91 115.26 115.55 2a2n n ASN 586 Ca 0.02 -0.72 0.05 0.00 -0.03 0.00 0.00 54.58 53.91 2a2n n ASN 586 Cb 0.40 -4.36 0.13 0.00 -0.61 0.00 0.00 39.78 35.34 2a2n n ASN 586 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2a2n n THR 587 N -4.57 1.30 -1.92 3.41 -2.24 -1.20 -4.43 114.28 104.63 2a2n n THR 587 Ca -0.11 -2.21 -0.41 0.00 -2.27 0.00 0.00 64.05 59.05 2a2n n THR 587 Cb 0.60 0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 69.04 2a2n n THR 587 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2a2n s ASN 588 N -2.66 6.54 0.00 3.42 0.01 -0.96 -4.33 114.94 116.96 2a2n s ASN 588 Ca 0.34 2.80 0.00 0.00 -0.71 0.00 0.00 52.86 55.29 2a2n s ASN 588 Cb 0.35 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 39.37 2a2n s ASN 588 CO -0.09 -0.77 0.00 0.61 -1.51 0.00 0.00 177.10 175.34 2a2n n GLY 589 N 1.87 1.54 0.00 0.66 0.00 -1.26 -1.06 105.19 106.95 2a2n n GLY 589 Ca 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2a2n n GLY 589 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2a2n n SER 590 N 0.00 4.21 -4.77 1.61 3.41 -1.25 -3.55 113.62 113.29 2a2n n SER 590 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.22 2a2n n SER 590 Cb 0.00 0.70 -0.01 0.00 -0.26 0.00 0.00 64.21 64.64 2a2n n SER 590 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2a2n s GLN 591 N -1.74 4.05 0.16 4.33 -0.21 -1.23 -4.72 119.66 120.30 2a2n s GLN 591 Ca 0.00 2.03 -0.06 0.00 0.02 0.00 0.00 55.36 57.36 2a2n s GLN 591 Cb 0.00 -2.77 -0.02 0.00 1.00 0.00 0.00 33.01 31.22 2a2n s GLN 591 CO 0.00 -0.38 0.20 -0.59 -2.12 0.00 0.00 175.29 172.40 2a2n s PHE 592 N -1.30 0.63 0.14 0.91 -0.12 -0.71 -1.69 117.98 115.84 2a2n s PHE 592 Ca 0.56 -0.99 -0.00 0.00 -0.05 0.00 0.00 56.93 56.45 2a2n s PHE 592 Cb -0.35 -0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 41.75 2a2n s PHE 592 CO 0.45 -0.65 0.03 -0.59 -0.05 0.00 0.00 175.22 174.40 2a2n s PHE 593 N -4.02 0.95 -0.09 3.49 -0.12 0.40 -1.40 117.98 117.19 2a2n s PHE 593 Ca 0.22 -1.14 0.01 0.00 -0.05 0.00 0.00 56.93 55.97 2a2n s PHE 593 Cb 0.05 -0.55 0.02 0.00 -0.63 0.00 0.00 43.02 41.91 2a2n s PHE 593 CO 0.02 -0.40 -0.12 0.42 -0.05 0.00 0.00 175.22 175.10 2a2n s ILE 594 N -3.90 1.21 0.62 -4.49 1.01 0.08 -1.37 121.20 114.36 2a2n s ILE 594 Ca 0.22 -0.47 -0.11 0.00 0.00 0.00 0.00 60.65 60.30 2a2n s ILE 594 Cb 0.07 -1.13 -0.03 0.00 0.01 0.00 0.00 42.46 41.37 2a2n s ILE 594 CO 0.01 0.38 1.03 0.42 0.00 0.00 0.00 174.94 176.78 2a2n s THR 595 N 1.06 4.53 -0.19 2.92 -4.23 -0.67 -0.76 115.64 118.29 2a2n s THR 595 Ca -0.07 0.78 0.02 0.00 -1.18 0.00 0.00 61.69 61.24 2a2n s THR 595 Cb -0.15 -3.81 0.02 0.00 1.34 0.00 0.00 72.50 69.90 2a2n s THR 595 CO -0.01 -1.05 0.63 1.33 -0.54 0.00 0.00 174.62 174.97 2a2n n VAL 596 N -2.76 0.15 -3.99 2.29 0.24 -0.46 -1.18 118.33 112.62 2a2n n VAL 596 Ca 0.06 -0.58 -0.10 0.00 -2.04 0.00 0.00 64.34 61.68 2a2n n VAL 596 Cb 0.55 0.95 -0.07 0.00 -1.47 0.00 0.00 33.84 33.80 2a2n n VAL 596 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2a2n s VAL 597 N -0.27 0.04 0.27 3.34 -7.23 -1.26 -4.71 120.40 110.58 2a2n s VAL 597 Ca 0.02 -1.44 -0.30 0.00 -1.81 0.00 0.00 61.98 58.44 2a2n s VAL 597 Cb 0.01 -2.00 -0.13 0.00 0.56 0.00 0.00 36.38 34.83 2a2n s VAL 597 CO 0.02 -0.19 1.46 -2.65 -0.31 0.00 0.00 175.10 173.43 2a2n n PRO 598 N -0.26 2.27 -3.14 4.82 -0.02 -1.26 -4.27 135.00 133.13 2a2n n PRO 598 Ca -0.05 0.81 -0.22 0.00 -2.02 0.00 0.00 63.50 62.01 2a2n n PRO 598 Cb 0.63 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.57 2a2n n PRO 598 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2a2n n THR 599 N 1.82 0.95 0.33 3.45 -2.24 0.27 -4.97 114.28 113.89 2a2n n THR 599 Ca 0.10 -4.85 0.22 0.00 -2.27 0.00 0.00 64.05 57.25 2a2n n THR 599 Cb 0.34 -1.05 1.15 0.00 -2.10 0.00 0.00 70.33 68.66 2a2n n THR 599 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2a2n h PRO 600 N 3.28 0.00 0.00 -0.78 0.13 -1.92 -0.57 132.00 132.14 2a2n h PRO 600 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2a2n h PRO 600 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2a2n h PRO 600 CO 0.62 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.72 2a2n n TRP 601 N -3.10 0.00 1.05 1.56 2.14 -1.26 -2.21 117.44 115.62 2a2n n TRP 601 Ca -0.03 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.66 2a2n n TRP 601 Cb 0.10 -0.41 0.10 0.00 -0.81 0.00 0.00 31.31 30.29 2a2n n TRP 601 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2a2n n LEU 602 N -1.41 1.18 -4.66 5.67 4.77 -0.22 -4.84 117.00 117.48 2a2n n LEU 602 Ca 0.05 -0.41 -0.46 0.00 -0.03 0.00 0.00 56.01 55.16 2a2n n LEU 602 Cb 0.15 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 2a2n n LEU 602 CO 0.13 0.25 1.07 0.47 -1.33 0.00 0.00 177.39 177.97 2a2n n ASP 603 N -0.91 2.78 -2.14 -1.43 8.00 -0.94 -1.19 116.55 120.72 2a2n n ASP 603 Ca 0.08 1.12 -0.17 0.00 0.71 0.00 0.00 54.79 56.53 2a2n n ASP 603 Cb 0.37 -1.41 -0.03 0.00 -0.02 0.00 0.00 41.12 40.04 2a2n n ASP 603 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2a2n n ASN 604 N 2.64 -4.75 0.00 -2.24 4.13 -1.26 -4.75 115.26 109.03 2a2n n ASN 604 Ca 0.14 0.18 0.00 0.00 1.68 0.00 0.00 54.58 56.58 2a2n n ASN 604 Cb 0.30 -4.07 0.00 0.00 -1.54 0.00 0.00 39.78 34.47 2a2n n ASN 604 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2a2n n LYS 605 N -2.67 1.80 -4.79 3.52 5.02 -0.33 -5.06 118.16 115.65 2a2n n LYS 605 Ca -0.19 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.85 2a2n n LYS 605 Cb 0.62 -0.88 -0.16 0.00 -0.02 0.00 0.00 35.03 34.59 2a2n n LYS 605 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2a2n s HIS 606 N -1.76 1.63 -0.10 2.13 3.76 -0.81 -4.88 115.29 115.25 2a2n s HIS 606 Ca 0.00 -0.44 -0.29 0.00 -0.15 0.00 0.00 55.06 54.17 2a2n s HIS 606 Cb 0.00 -1.09 -0.05 0.00 1.11 0.00 0.00 32.58 32.55 2a2n s HIS 606 CO 0.00 -0.14 1.62 0.99 -0.85 0.00 0.00 174.74 176.36 2a2n s THR 607 N -0.00 3.66 -0.30 1.30 2.01 -1.26 -4.81 115.64 116.23 2a2n s THR 607 Ca -0.02 0.79 -0.28 0.00 0.31 0.00 0.00 61.69 62.48 2a2n s THR 607 Cb -0.11 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 68.87 2a2n s THR 607 CO 0.02 -0.11 1.01 -0.69 -0.69 0.00 0.00 174.62 174.16 2a2n s VAL 608 N 4.27 4.59 0.00 3.82 1.01 -1.26 -1.04 120.40 131.79 2a2n s VAL 608 Ca 0.72 1.69 0.00 0.00 0.00 0.00 0.00 61.98 64.38 2a2n s VAL 608 Cb -0.31 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.73 2a2n s VAL 608 CO 0.28 -0.38 0.52 2.22 0.00 0.00 0.00 175.10 177.74 2a2n n PHE 609 N 6.65 0.00 -3.89 5.22 1.16 0.08 -4.90 117.46 121.78 2a2n n PHE 609 Ca 0.10 -0.12 -0.03 0.00 -1.87 0.00 0.00 57.45 55.53 2a2n n PHE 609 Cb 0.47 -0.01 0.02 0.00 -1.61 0.00 0.00 39.48 38.35 2a2n n PHE 609 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 2a2n s GLY 610 N -0.25 0.11 -0.20 4.97 0.00 -0.98 -1.23 107.32 109.73 2a2n s GLY 610 Ca 0.00 -0.33 -0.19 0.00 0.00 0.00 0.00 44.72 44.20 2a2n s GLY 610 CO 0.00 2.55 0.55 -1.60 0.00 0.00 0.00 173.10 174.60 2a2n s ARG 611 N -2.16 0.65 0.11 2.90 3.52 -0.24 -1.01 118.95 122.71 2a2n s ARG 611 Ca 0.22 0.74 -0.30 0.00 -0.13 0.00 0.00 55.73 56.26 2a2n s ARG 611 Cb -0.03 0.32 -0.06 0.00 -1.56 0.00 0.00 34.95 33.62 2a2n s ARG 611 CO 0.05 -0.08 1.06 0.08 -0.81 0.00 0.00 175.30 175.59 2a2n s VAL 612 N 0.24 4.26 -0.02 7.11 1.01 0.08 -0.72 120.40 132.36 2a2n s VAL 612 Ca -0.00 1.80 0.09 0.00 0.00 0.00 0.00 61.98 63.87 2a2n s VAL 612 Cb -0.04 -4.15 -0.14 0.00 0.00 0.00 0.00 36.38 32.05 2a2n s VAL 612 CO 0.01 0.24 0.20 0.35 0.00 0.00 0.00 175.10 175.90 2a2n n THR 613 N 3.05 0.03 -3.68 3.92 -2.24 0.17 -4.91 114.28 110.62 2a2n n THR 613 Ca 0.04 -0.22 -0.14 0.00 -2.27 0.00 0.00 64.05 61.46 2a2n n THR 613 Cb 0.48 0.23 -0.08 0.00 -2.10 0.00 0.00 70.33 68.86 2a2n n THR 613 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2a2n s LYS 614 N -2.63 0.69 0.00 -0.78 2.20 -1.21 -4.91 119.74 113.09 2a2n s LYS 614 Ca -0.03 0.63 0.00 0.00 -0.36 0.00 0.00 55.97 56.21 2a2n s LYS 614 Cb 0.06 0.33 0.00 0.00 -1.51 0.00 0.00 37.83 36.71 2a2n s LYS 614 CO 0.39 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.68 2a2n n GLY 615 N 2.47 0.79 0.37 5.54 0.00 -1.26 -0.17 105.19 112.92 2a2n n GLY 615 Ca -0.15 -0.14 0.10 0.00 0.00 0.00 0.00 46.02 45.83 2a2n n GLY 615 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2a2n h MET 616 N 1.92 0.83 -0.53 1.61 2.86 -1.91 0.20 114.93 119.92 2a2n h MET 616 Ca 0.00 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2a2n h MET 616 Cb 0.00 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.45 2a2n h MET 616 CO 0.00 0.55 0.32 0.93 1.06 0.00 0.00 176.91 179.77 2a2n h GLU 617 N 0.86 0.71 -0.15 1.72 3.07 -1.96 -0.25 114.58 118.58 2a2n h GLU 617 Ca 0.49 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 59.27 2a2n h GLU 617 Cb 0.62 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 2a2n h GLU 617 CO -0.26 0.50 0.01 0.28 -1.40 0.00 0.00 179.01 178.14 2a2n h VAL 618 N 0.73 1.24 -0.42 3.13 2.07 -1.30 -1.03 116.25 120.66 2a2n h VAL 618 Ca 0.19 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.97 2a2n h VAL 618 Cb -0.03 1.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 2a2n h VAL 618 CO -0.04 0.23 0.18 0.58 0.02 0.00 0.00 177.57 178.54 2a2n h VAL 619 N 0.02 0.92 -0.27 2.57 2.07 -0.95 0.13 116.25 120.73 2a2n h VAL 619 Ca 0.04 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.46 2a2n h VAL 619 Cb 0.34 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2a2n h VAL 619 CO 0.01 0.07 0.11 -0.61 0.02 0.00 0.00 177.57 177.16 2a2n h GLN 620 N 0.37 0.23 -0.46 1.57 5.75 -0.90 -0.90 115.11 120.77 2a2n h GLN 620 Ca 0.19 -0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.64 2a2n h GLN 620 Cb 0.14 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.62 2a2n h GLN 620 CO -0.16 0.15 0.17 0.00 -2.65 0.00 0.00 178.83 176.34 2a2n h ARG 621 N 0.24 0.71 -0.46 1.69 3.08 -0.81 -1.98 114.38 116.85 2a2n h ARG 621 Ca 0.11 -0.14 0.06 0.00 0.07 0.00 0.00 59.98 60.09 2a2n h ARG 621 Cb 0.06 -0.11 -0.06 0.00 0.08 0.00 0.00 29.97 29.95 2a2n h ARG 621 CO -0.10 0.65 0.14 0.82 -1.07 0.00 0.00 179.97 180.41 2a2n h ILE 622 N 0.61 0.82 0.00 2.04 2.04 -0.48 -1.73 117.51 120.81 2a2n h ILE 622 Ca 0.15 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.91 2a2n h ILE 622 Cb 0.23 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2a2n h ILE 622 CO -0.01 0.05 0.06 0.77 0.00 0.00 0.00 178.15 179.03 2a2n h SER 623 N 0.30 0.00 -0.39 1.72 4.64 -0.42 -2.22 113.55 117.17 2a2n h SER 623 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2a2n h SER 623 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2a2n h SER 623 CO -0.25 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.30 2a2n n ASN 624 N -2.49 3.14 -4.76 4.97 5.03 -0.66 -3.60 115.26 116.89 2a2n n ASN 624 Ca -0.02 -1.92 -0.33 0.00 0.87 0.00 0.00 54.58 53.18 2a2n n ASN 624 Cb 0.11 -0.26 0.06 0.00 -1.02 0.00 0.00 39.78 38.67 2a2n n ASN 624 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 2a2n s VAL 625 N -1.11 3.01 0.12 2.41 -7.23 -0.84 -4.96 120.40 111.79 2a2n s VAL 625 Ca 0.31 0.47 -0.31 0.00 -1.81 0.00 0.00 61.98 60.65 2a2n s VAL 625 Cb 0.17 -2.99 -0.07 0.00 0.56 0.00 0.00 36.38 34.05 2a2n s VAL 625 CO 0.23 -0.29 1.26 -0.54 -0.31 0.00 0.00 175.10 175.45 2a2n s LYS 626 N -4.06 4.41 0.18 4.82 1.02 -1.26 -4.99 119.74 119.86 2a2n s LYS 626 Ca 0.69 1.90 0.08 0.00 0.02 0.00 0.00 55.97 58.66 2a2n s LYS 626 Cb -0.22 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.76 2a2n s LYS 626 CO 0.43 -0.26 -0.16 0.14 -0.92 0.00 0.00 175.35 174.57 2a2n s VAL 627 N 0.72 1.75 -0.07 3.17 -7.23 -1.26 -1.87 120.40 115.60 2a2n s VAL 627 Ca 0.59 -2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 58.42 2a2n s VAL 627 Cb -0.33 -1.91 -0.06 0.00 0.56 0.00 0.00 36.38 34.64 2a2n s VAL 627 CO 0.32 -0.46 1.72 0.21 -0.31 0.00 0.00 175.10 176.59 2a2n s ASN 628 N -2.96 6.53 0.58 4.85 3.84 -0.27 -4.88 114.94 122.64 2a2n s ASN 628 Ca 0.18 2.20 0.30 0.00 0.21 0.00 0.00 52.86 55.75 2a2n s ASN 628 Cb -0.03 -2.53 1.78 0.00 -0.55 0.00 0.00 41.25 39.92 2a2n s ASN 628 CO 0.07 -1.04 2.23 -0.65 -2.79 0.00 0.00 177.10 174.91 2a2n h PRO 629 N 10.14 0.00 0.00 0.43 0.11 -1.98 0.25 132.00 140.95 2a2n h PRO 629 Ca -0.40 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.68 2a2n h PRO 629 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2a2n h PRO 629 CO 0.96 0.02 -0.16 0.87 -0.21 0.00 0.00 178.00 179.48 2a2n h LYS 630 N 0.00 0.00 0.00 1.05 1.79 -1.98 -3.37 116.57 114.06 2a2n h LYS 630 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2a2n h LYS 630 Cb 0.06 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2a2n h LYS 630 CO 0.00 0.16 -0.30 0.25 -1.08 0.00 0.00 179.45 178.49 2a2n n THR 631 N -3.16 0.00 -1.60 -0.16 -2.24 -0.81 -5.01 114.28 101.31 2a2n n THR 631 Ca 0.03 -0.17 -0.20 0.00 -2.27 0.00 0.00 64.05 61.43 2a2n n THR 631 Cb 0.56 0.68 -0.09 0.00 -2.10 0.00 0.00 70.33 69.39 2a2n n THR 631 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2a2n n ASP 632 N -0.79 -5.47 -4.70 3.42 8.00 0.80 -4.87 116.55 112.95 2a2n n ASP 632 Ca 0.00 0.50 -0.38 0.00 0.71 0.00 0.00 54.79 55.62 2a2n n ASP 632 Cb 0.00 -4.77 -0.07 0.00 -0.02 0.00 0.00 41.12 36.27 2a2n n ASP 632 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2a2n s LYS 633 N -3.74 4.26 0.47 -1.24 2.20 -1.25 -0.54 119.74 119.90 2a2n s LYS 633 Ca 0.00 0.37 -0.24 0.00 -0.36 0.00 0.00 55.97 55.74 2a2n s LYS 633 Cb 0.00 -3.49 -0.07 0.00 -1.51 0.00 0.00 37.83 32.76 2a2n s LYS 633 CO 0.00 0.04 1.32 -2.14 -0.36 0.00 0.00 175.35 174.21 2a2n s PRO 634 N 1.03 3.59 0.28 4.03 0.02 -1.26 -1.11 135.00 141.58 2a2n s PRO 634 Ca 0.24 2.16 -0.01 0.00 0.02 0.00 0.00 61.00 63.40 2a2n s PRO 634 Cb -0.15 -2.50 0.39 0.00 0.02 0.00 0.00 34.50 32.26 2a2n s PRO 634 CO 0.09 -0.80 1.82 1.88 -0.33 0.00 0.00 177.00 179.66 2a2n h TYR 635 N 2.08 0.85 -3.32 6.54 0.05 -1.71 -3.41 116.97 118.05 2a2n h TYR 635 Ca -0.50 -0.08 -0.66 0.00 0.05 0.00 0.00 58.73 57.54 2a2n h TYR 635 Cb 1.27 -0.25 -0.27 0.00 1.01 0.00 0.00 36.73 38.49 2a2n h TYR 635 CO 0.50 0.73 -0.76 -1.21 -1.05 0.00 0.00 178.16 176.37 2a2n s GLU 636 N -5.18 3.38 0.38 4.88 2.02 -1.26 -5.08 118.70 117.83 2a2n s GLU 636 Ca -0.10 -0.68 -0.28 0.00 0.02 0.00 0.00 54.97 53.94 2a2n s GLU 636 Cb 0.15 -2.69 -0.11 0.00 0.10 0.00 0.00 34.13 31.59 2a2n s GLU 636 CO 0.80 0.14 1.44 -0.25 0.02 0.00 0.00 175.26 177.41 2a2n n ASP 637 N 3.73 3.50 -4.44 -0.19 8.00 -1.26 -5.01 116.55 120.89 2a2n n ASP 637 Ca -0.18 1.21 -0.33 0.00 0.71 0.00 0.00 54.79 56.19 2a2n n ASP 637 Cb 0.52 -1.59 -0.13 0.00 -0.02 0.00 0.00 41.12 39.90 2a2n n ASP 637 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2a2n s VAL 638 N -1.13 3.24 0.11 2.53 1.01 -1.26 -5.05 120.40 119.85 2a2n s VAL 638 Ca 0.55 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2a2n s VAL 638 Cb -0.49 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 2a2n s VAL 638 CO 0.63 0.55 -0.08 -0.94 0.00 0.00 0.00 175.10 175.25 2a2n s SER 639 N -0.05 1.33 -0.11 3.32 1.04 -1.26 -0.19 113.70 117.78 2a2n s SER 639 Ca -0.02 -0.96 -0.23 0.00 0.48 0.00 0.00 55.95 55.23 2a2n s SER 639 Cb -0.14 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.00 2a2n s SER 639 CO 0.04 -0.39 0.69 -0.63 0.98 0.00 0.00 173.24 173.92 2a2n s ILE 640 N -3.27 5.03 -0.09 -1.02 1.01 0.69 -0.21 121.20 123.33 2a2n s ILE 640 Ca 0.11 1.38 -0.11 0.00 0.00 0.00 0.00 60.65 62.02 2a2n s ILE 640 Cb 0.03 -4.02 -0.09 0.00 0.01 0.00 0.00 42.46 38.39 2a2n s ILE 640 CO -0.03 0.19 0.38 0.40 0.00 0.00 0.00 174.94 175.89 2a2n h ILE 641 N 4.91 0.52 -2.56 2.92 2.04 -0.51 0.57 117.51 125.40 2a2n h ILE 641 Ca -0.37 -1.26 0.14 0.00 1.00 0.00 0.00 64.86 64.36 2a2n h ILE 641 Cb 1.17 0.96 -0.06 0.00 -0.74 0.00 0.00 36.82 38.16 2a2n h ILE 641 CO 0.77 0.17 0.44 0.54 0.00 0.00 0.00 178.15 180.06 2a2n s ASN 642 N -5.61 -0.13 -0.06 1.72 4.22 -1.19 -3.70 114.94 110.19 2a2n s ASN 642 Ca -0.07 -0.58 -0.01 0.00 -2.14 0.00 0.00 52.86 50.06 2a2n s ASN 642 Cb -0.00 0.57 0.03 0.00 1.28 0.00 0.00 41.25 43.13 2a2n s ASN 642 CO 0.25 -1.08 0.01 -0.63 -2.04 0.00 0.00 177.10 173.61 2a2n s ILE 643 N -3.07 0.29 -0.24 0.54 1.01 -1.26 -1.04 121.20 117.44 2a2n s ILE 643 Ca 0.14 0.15 -0.11 0.00 0.00 0.00 0.00 60.65 60.83 2a2n s ILE 643 Cb -0.03 -0.45 -0.05 0.00 0.01 0.00 0.00 42.46 41.94 2a2n s ILE 643 CO 0.05 0.23 0.19 -0.89 0.00 0.00 0.00 174.94 174.52 2a2n s THR 644 N 1.82 5.34 -0.20 2.92 2.01 -0.37 -4.49 115.64 122.67 2a2n s THR 644 Ca 0.02 0.24 -0.08 0.00 0.31 0.00 0.00 61.69 62.18 2a2n s THR 644 Cb -0.12 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 2a2n s THR 644 CO -0.04 0.34 0.09 -0.69 -0.69 0.00 0.00 174.62 173.63 2a2n s VAL 645 N 1.08 4.95 -2.00 3.82 1.01 -1.26 -0.43 120.40 127.57 2a2n s VAL 645 Ca 0.09 0.03 0.16 0.00 0.00 0.00 0.00 61.98 62.26 2a2n s VAL 645 Cb -0.14 -3.26 0.47 0.00 0.00 0.00 0.00 36.38 33.45 2a2n s VAL 645 CO 0.05 0.42 1.39 1.17 0.00 0.00 0.00 175.10 178.13