#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xef s ILE 468 N 0.00 4.94 -0.04 0.53 1.01 -0.53 -0.44 121.20 126.68 1xef s ILE 468 Ca 0.00 1.35 0.03 0.00 0.00 0.00 0.00 60.65 62.04 1xef s ILE 468 Cb 0.00 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 38.45 1xef s ILE 468 CO 0.00 0.04 -0.14 -0.89 0.00 0.00 0.00 174.94 173.94 1xef s THR 469 N 2.28 1.21 -0.21 2.92 2.01 0.27 -0.28 115.64 123.84 1xef s THR 469 Ca 0.32 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.71 1xef s THR 469 Cb -0.16 -1.06 -0.00 0.00 0.01 0.00 0.00 72.50 71.29 1xef s THR 469 CO 0.10 0.36 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.94 1xef s PHE 470 N 0.19 2.91 -0.23 4.92 0.08 0.14 -1.23 117.98 124.76 1xef s PHE 470 Ca -0.06 -1.14 -0.01 0.00 0.12 0.00 0.00 56.93 55.84 1xef s PHE 470 Cb -0.11 -2.05 0.02 0.00 -0.57 0.00 0.00 43.02 40.30 1xef s PHE 470 CO 0.02 -0.62 -0.08 1.03 -0.10 0.00 0.00 175.22 175.46 1xef s ARG 471 N 1.43 2.93 -1.67 0.44 0.52 -0.33 -1.65 118.95 120.61 1xef s ARG 471 Ca 0.06 -0.91 -0.10 0.00 -0.52 0.00 0.00 55.73 54.26 1xef s ARG 471 Cb -0.14 -2.91 0.10 0.00 0.52 0.00 0.00 34.95 32.52 1xef s ARG 471 CO -0.06 -0.34 0.31 0.09 0.02 0.00 0.00 175.30 175.32 1xef n ASN 472 N 4.67 -0.46 -4.69 0.23 3.02 -1.18 -1.38 115.26 115.46 1xef n ASN 472 Ca -0.17 -1.23 -0.42 0.00 -0.03 0.00 0.00 54.58 52.73 1xef n ASN 472 Cb 0.48 -1.80 -0.03 0.00 -0.61 0.00 0.00 39.78 37.83 1xef n ASN 472 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xef s ILE 473 N -3.86 4.10 -0.08 2.41 -1.09 -0.84 -3.52 121.20 118.32 1xef s ILE 473 Ca 0.36 1.46 0.02 0.00 -2.23 0.00 0.00 60.65 60.26 1xef s ILE 473 Cb -0.21 -3.94 0.02 0.00 -1.58 0.00 0.00 42.46 36.75 1xef s ILE 473 CO 1.00 0.03 -0.12 -0.60 -1.23 0.00 0.00 174.94 174.02 1xef s ARG 474 N 1.92 1.74 -0.00 2.79 3.52 -0.63 -1.35 118.95 126.93 1xef s ARG 474 Ca 0.58 -0.40 0.01 0.00 -0.13 0.00 0.00 55.73 55.79 1xef s ARG 474 Cb -0.27 -1.52 -0.00 0.00 -1.56 0.00 0.00 34.95 31.59 1xef s ARG 474 CO 0.25 -0.05 -0.05 0.12 -0.81 0.00 0.00 175.30 174.76 1xef s PHE 475 N 0.95 0.42 0.05 5.12 5.36 -0.78 -1.87 117.98 127.22 1xef s PHE 475 Ca -0.09 -0.08 0.01 0.00 -0.96 0.00 0.00 56.93 55.81 1xef s PHE 475 Cb -0.15 -0.28 -0.03 0.00 -0.34 0.00 0.00 43.02 42.22 1xef s PHE 475 CO 0.00 -0.01 -0.06 -0.98 -1.46 0.00 0.00 175.22 172.71 1xef s ARG 476 N -0.06 0.53 -0.01 10.12 1.70 -1.26 -1.19 118.95 128.77 1xef s ARG 476 Ca 0.01 -0.87 -0.22 0.00 -0.47 0.00 0.00 55.73 54.19 1xef s ARG 476 Cb -0.02 -0.10 -0.22 0.00 -0.57 0.00 0.00 34.95 34.04 1xef s ARG 476 CO -0.00 -0.01 1.12 1.88 -1.08 0.00 0.00 175.30 177.21 1xef h TYR 477 N 4.12 0.44 -1.77 5.89 0.05 -1.88 -3.46 116.97 120.35 1xef h TYR 477 Ca -0.34 -0.22 -0.51 0.00 0.05 0.00 0.00 58.73 57.71 1xef h TYR 477 Cb 1.19 -0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.82 1xef h TYR 477 CO 0.63 0.99 -0.45 0.15 -1.05 0.00 0.00 178.16 178.42 1xef s LYS 478 N -3.39 2.59 0.56 4.88 3.01 -1.26 -4.97 119.74 121.16 1xef s LYS 478 Ca -0.14 -1.42 0.28 0.00 -1.01 0.00 0.00 55.97 53.67 1xef s LYS 478 Cb 0.03 -2.37 1.66 0.00 -1.01 0.00 0.00 37.83 36.14 1xef s LYS 478 CO 0.78 0.03 2.19 -1.35 0.51 0.00 0.00 175.35 177.51 1xef h PRO 479 N 1.27 0.00 -0.20 -1.68 0.11 -2.02 -2.65 132.00 126.84 1xef h PRO 479 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1xef h PRO 479 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1xef h PRO 479 CO 0.60 0.04 0.00 -3.47 -0.21 0.00 0.00 178.00 174.96 1xef n ASP 480 N -3.83 2.53 -4.75 -2.05 2.03 -1.26 -5.00 116.55 104.21 1xef n ASP 480 Ca -0.03 -1.76 -0.38 0.00 0.52 0.00 0.00 54.79 53.15 1xef n ASP 480 Cb 0.13 -0.13 0.04 0.00 -0.72 0.00 0.00 41.12 40.44 1xef n ASP 480 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1xef s SER 481 N -1.01 5.33 0.71 1.67 0.15 -1.00 -5.01 113.70 114.53 1xef s SER 481 Ca 0.20 2.64 -0.15 0.00 0.70 0.00 0.00 55.95 59.33 1xef s SER 481 Cb 0.12 -2.62 0.03 0.00 -1.71 0.00 0.00 66.02 61.83 1xef s SER 481 CO 0.16 -1.52 1.18 -2.16 1.20 0.00 0.00 173.24 172.10 1xef s PRO 482 N -2.97 2.35 -0.02 5.44 0.04 -1.26 -4.83 135.00 133.74 1xef s PRO 482 Ca 0.72 1.65 -0.30 0.00 0.04 0.00 0.00 61.00 63.11 1xef s PRO 482 Cb -0.37 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.23 1xef s PRO 482 CO 0.43 -1.64 1.77 0.08 0.04 0.00 0.00 177.00 177.68 1xef s VAL 483 N -2.09 3.38 -0.17 -0.36 1.01 -1.26 -4.58 120.40 116.34 1xef s VAL 483 Ca 0.72 0.46 -0.15 0.00 0.00 0.00 0.00 61.98 63.01 1xef s VAL 483 Cb -0.26 -3.30 -0.11 0.00 0.00 0.00 0.00 36.38 32.71 1xef s VAL 483 CO 0.44 -0.04 0.05 0.40 0.00 0.00 0.00 175.10 175.95 1xef h ILE 484 N 5.61 0.49 -3.32 2.22 1.08 -1.51 -3.46 117.51 118.61 1xef h ILE 484 Ca -0.43 -1.59 -0.63 0.00 -0.39 0.00 0.00 64.86 61.82 1xef h ILE 484 Cb 1.20 1.15 -0.20 0.00 -3.07 0.00 0.00 36.82 35.90 1xef h ILE 484 CO 0.95 0.17 -0.63 -0.76 -0.69 0.00 0.00 178.15 177.19 1xef s LEU 485 N -8.09 3.46 -0.21 1.44 1.43 -0.99 -3.71 118.68 112.01 1xef s LEU 485 Ca -0.20 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 1xef s LEU 485 Cb 0.03 -1.86 0.04 0.00 0.03 0.00 0.00 46.19 44.43 1xef s LEU 485 CO 0.39 0.15 -0.14 -0.62 0.23 0.00 0.00 176.35 176.36 1xef s ASP 486 N 0.47 3.54 -1.39 2.29 -1.08 -0.47 -1.87 116.67 118.16 1xef s ASP 486 Ca -0.01 -0.92 -0.01 0.00 -0.52 0.00 0.00 52.55 51.10 1xef s ASP 486 Cb -0.14 -1.40 0.01 0.00 -1.46 0.00 0.00 42.92 39.93 1xef s ASP 486 CO 0.02 -0.10 0.51 -3.20 0.52 0.00 0.00 175.17 172.91 1xef n ASN 487 N 4.60 -0.67 -4.71 -0.34 4.05 -0.45 -4.73 115.26 112.99 1xef n ASN 487 Ca -0.17 -0.96 -0.38 0.00 0.45 0.00 0.00 54.58 53.52 1xef n ASN 487 Cb 0.47 -3.31 -0.06 0.00 1.23 0.00 0.00 39.78 38.11 1xef n ASN 487 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 1xef s ILE 488 N -3.86 5.15 -0.13 -1.44 -5.25 -0.68 -4.74 121.20 110.25 1xef s ILE 488 Ca 0.03 1.07 0.01 0.00 -0.99 0.00 0.00 60.65 60.78 1xef s ILE 488 Cb -0.02 -3.87 0.02 0.00 2.95 0.00 0.00 42.46 41.54 1xef s ILE 488 CO 0.87 0.29 -0.17 0.20 -1.79 0.00 0.00 174.94 174.34 1xef s ASN 489 N 0.72 2.72 -0.13 4.36 0.01 -1.26 -1.99 114.94 119.37 1xef s ASN 489 Ca 0.28 -0.50 -0.10 0.00 -0.71 0.00 0.00 52.86 51.83 1xef s ASN 489 Cb -0.16 -1.23 0.04 0.00 0.41 0.00 0.00 41.25 40.32 1xef s ASN 489 CO 0.12 0.01 0.33 -0.22 -1.51 0.00 0.00 177.10 175.83 1xef s LEU 490 N 1.11 0.48 -0.13 0.60 2.96 -0.66 -4.96 118.68 118.08 1xef s LEU 490 Ca -0.03 0.69 -0.00 0.00 -0.22 0.00 0.00 54.13 54.57 1xef s LEU 490 Cb -0.14 1.10 0.03 0.00 0.50 0.00 0.00 46.19 47.68 1xef s LEU 490 CO -0.05 -0.14 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.33 1xef s SER 491 N 0.68 2.42 -0.22 3.68 0.01 -1.26 0.25 113.70 119.26 1xef s SER 491 Ca -0.04 -0.44 -0.02 0.00 1.31 0.00 0.00 55.95 56.76 1xef s SER 491 Cb -0.05 -0.86 0.01 0.00 0.21 0.00 0.00 66.02 65.33 1xef s SER 491 CO -0.04 -0.15 -0.09 -0.63 0.41 0.00 0.00 173.24 172.74 1xef s ILE 492 N 1.68 2.84 0.48 1.44 1.01 0.62 -5.01 121.20 124.26 1xef s ILE 492 Ca 0.03 -0.84 -0.20 0.00 0.00 0.00 0.00 60.65 59.65 1xef s ILE 492 Cb -0.14 -2.34 -0.09 0.00 0.01 0.00 0.00 42.46 39.90 1xef s ILE 492 CO -0.08 0.35 1.01 -0.75 0.00 0.00 0.00 174.94 175.47 1xef s LYS 493 N 1.37 3.92 0.33 2.79 2.20 -1.26 -0.94 119.74 128.14 1xef s LYS 493 Ca 0.03 1.24 -0.29 0.00 -0.36 0.00 0.00 55.97 56.59 1xef s LYS 493 Cb -0.15 -2.12 -0.11 0.00 -1.51 0.00 0.00 37.83 33.94 1xef s LYS 493 CO -0.06 -0.31 1.50 -1.14 -0.36 0.00 0.00 175.35 174.98 1xef s GLN 494 N -3.34 4.15 0.00 4.03 0.74 -1.26 -3.14 119.66 120.85 1xef s GLN 494 Ca 0.65 2.51 0.00 0.00 0.05 0.00 0.00 55.36 58.57 1xef s GLN 494 Cb -0.13 -3.01 0.00 0.00 1.10 0.00 0.00 33.01 30.96 1xef s GLN 494 CO 0.20 -0.52 0.00 0.41 -0.55 0.00 0.00 175.29 174.83 1xef n GLY 495 N 1.25 0.72 3.73 2.59 0.00 -1.07 -4.98 105.19 107.43 1xef n GLY 495 Ca 0.04 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1xef n GLY 495 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xef s GLU 496 N -0.57 3.38 -0.30 1.61 2.02 -1.19 -4.96 118.70 118.70 1xef s GLU 496 Ca 0.00 -0.30 -0.16 0.00 0.02 0.00 0.00 54.97 54.53 1xef s GLU 496 Cb 0.00 -3.02 -0.02 0.00 0.10 0.00 0.00 34.13 31.18 1xef s GLU 496 CO 0.00 0.62 0.41 0.08 0.02 0.00 0.00 175.26 176.39 1xef s VAL 497 N -0.62 5.13 -0.12 2.63 1.01 -1.26 -1.97 120.40 125.21 1xef s VAL 497 Ca 0.11 0.43 -0.00 0.00 0.00 0.00 0.00 61.98 62.52 1xef s VAL 497 Cb -0.12 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 1xef s VAL 497 CO 0.02 0.02 -0.12 -0.63 0.00 0.00 0.00 175.10 174.40 1xef s ILE 498 N 2.14 3.21 -0.17 2.22 -1.09 0.57 -0.89 121.20 127.19 1xef s ILE 498 Ca 0.15 -0.62 -0.08 0.00 -2.23 0.00 0.00 60.65 57.88 1xef s ILE 498 Cb -0.16 -2.34 -0.04 0.00 -1.58 0.00 0.00 42.46 38.34 1xef s ILE 498 CO 0.11 0.53 0.09 -0.83 -1.23 0.00 0.00 174.94 173.62 1xef s GLY 499 N 0.13 2.00 -0.18 6.18 0.00 -0.57 0.37 107.32 115.25 1xef s GLY 499 Ca -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 43.96 1xef s GLY 499 CO 0.04 -0.06 -0.16 -0.42 0.00 0.00 0.00 173.10 172.51 1xef s ILE 500 N -0.03 2.48 0.25 0.90 1.01 0.58 0.72 121.20 127.11 1xef s ILE 500 Ca 0.08 -0.81 0.05 0.00 0.00 0.00 0.00 60.65 59.96 1xef s ILE 500 Cb -0.12 -2.06 -0.05 0.00 0.01 0.00 0.00 42.46 40.24 1xef s ILE 500 CO 0.00 0.51 -0.02 0.68 0.00 0.00 0.00 174.94 176.11 1xef s VAL 501 N 1.13 1.24 0.00 2.92 -7.23 0.41 -2.81 120.40 116.06 1xef s VAL 501 Ca 0.01 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.12 1xef s VAL 501 Cb -0.14 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.42 1xef s VAL 501 CO -0.06 -0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.02 1xef n GLY 502 N -0.47 2.95 3.53 2.32 0.00 -1.26 -0.34 105.19 111.91 1xef n GLY 502 Ca -0.05 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.42 1xef n GLY 502 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xef n ARG 503 N -1.31 0.19 -1.70 1.61 1.74 -1.26 -4.87 116.66 111.06 1xef n ARG 503 Ca 0.00 0.12 -0.43 0.00 -0.77 0.00 0.00 57.85 56.77 1xef n ARG 503 Cb 0.00 -2.02 -0.03 0.00 -1.02 0.00 0.00 32.46 29.38 1xef n ARG 503 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1xef n SER 504 N -1.33 3.84 0.00 0.55 2.88 -1.26 -1.91 113.62 116.39 1xef n SER 504 Ca 0.11 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.68 1xef n SER 504 Cb 0.51 -1.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.44 1xef n SER 504 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xef n GLY 505 N 3.99 0.60 0.12 0.46 0.00 -1.26 -4.97 105.19 104.14 1xef n GLY 505 Ca 0.17 -0.38 0.12 0.00 0.00 0.00 0.00 46.02 45.93 1xef n GLY 505 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xef h SER 506 N 0.00 0.00 0.00 1.61 4.64 -1.72 -3.45 113.55 114.63 1xef h SER 506 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1xef h SER 506 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xef h SER 506 CO 0.00 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1xef n GLY 507 N 1.26 1.52 0.23 -0.77 0.00 -1.26 -0.91 105.19 105.25 1xef n GLY 507 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1xef n GLY 507 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xef h LYS 508 N 0.24 -0.49 -0.26 1.61 1.57 -1.91 -2.37 116.57 114.97 1xef h LYS 508 Ca 0.00 0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 1xef h LYS 508 Cb 0.00 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1xef h LYS 508 CO 0.00 -0.26 -0.17 0.77 -0.57 0.00 0.00 179.45 179.22 1xef h SER 509 N -0.62 0.43 -0.90 0.86 0.02 -2.00 -2.85 113.55 108.50 1xef h SER 509 Ca -0.05 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.76 1xef h SER 509 Cb 0.45 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.83 1xef h SER 509 CO 0.08 0.63 0.51 0.74 -1.14 0.00 0.00 176.83 177.65 1xef h THR 510 N 0.41 1.26 -0.88 -2.27 2.02 -1.97 -1.53 112.91 109.94 1xef h THR 510 Ca 0.07 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 1xef h THR 510 Cb 0.54 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 1xef h THR 510 CO 0.03 0.28 0.54 0.25 0.37 0.00 0.00 175.52 177.00 1xef h LEU 511 N 1.26 1.05 0.00 2.58 5.85 -1.18 -2.68 115.31 122.18 1xef h LEU 511 Ca 0.32 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 1xef h LEU 511 Cb 0.00 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.77 1xef h LEU 511 CO -0.05 0.79 -0.29 0.71 -0.34 0.00 0.00 178.44 179.26 1xef h THR 512 N 1.21 0.14 -0.14 1.05 1.35 -1.44 -3.20 112.91 111.87 1xef h THR 512 Ca 0.32 -1.20 -0.08 0.00 -0.55 0.00 0.00 66.41 64.90 1xef h THR 512 Cb -0.07 1.97 -0.01 0.00 -1.73 0.00 0.00 68.15 68.31 1xef h THR 512 CO -0.06 0.08 -0.25 0.11 -0.25 0.00 0.00 175.52 175.15 1xef h LYS 513 N 0.00 0.26 0.00 4.72 1.57 -0.95 -2.55 116.57 119.62 1xef h LYS 513 Ca -0.01 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1xef h LYS 513 Cb 1.07 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.36 1xef h LYS 513 CO 0.01 0.50 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.30 1xef h LEU 514 N 0.23 0.00 -0.51 2.94 3.38 -1.52 -1.55 115.31 118.27 1xef h LEU 514 Ca 0.04 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 1xef h LEU 514 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1xef h LEU 514 CO 0.04 0.02 -0.45 0.40 0.09 0.00 0.00 178.44 178.54 1xef h ILE 515 N 0.00 0.90 -0.02 1.22 2.04 -1.55 -2.95 117.51 117.15 1xef h ILE 515 Ca -0.00 -1.89 0.00 0.00 1.00 0.00 0.00 64.86 63.97 1xef h ILE 515 Cb 0.63 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 1xef h ILE 515 CO 0.00 0.44 -0.06 0.00 0.00 0.00 0.00 178.15 178.53 1xef n GLN 516 N -3.39 1.85 -3.91 2.37 6.02 -1.05 -4.96 117.38 114.32 1xef n GLN 516 Ca 0.01 -1.35 -0.33 0.00 -0.01 0.00 0.00 57.00 55.32 1xef n GLN 516 Cb 0.62 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.41 1xef n GLN 516 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1xef n ARG 517 N 0.61 -1.67 -0.02 -1.09 0.63 -0.97 -4.93 116.66 109.23 1xef n ARG 517 Ca 0.15 0.32 -0.16 0.00 -0.92 0.00 0.00 57.85 57.25 1xef n ARG 517 Cb 0.47 -3.87 -0.09 0.00 0.45 0.00 0.00 32.46 29.42 1xef n ARG 517 CO 0.00 0.00 0.00 0.74 -2.51 0.00 0.00 177.63 175.86 1xef h PHE 518 N -2.03 0.62 -3.17 -0.14 0.04 -1.59 -3.47 116.94 107.21 1xef h PHE 518 Ca -0.66 -0.29 -0.43 0.00 2.80 0.00 0.00 57.97 59.39 1xef h PHE 518 Cb 1.38 -0.09 -0.14 0.00 2.20 0.00 0.00 35.95 39.30 1xef h PHE 518 CO 0.41 1.06 -0.61 0.71 -0.60 0.00 0.00 178.31 179.28 1xef s TYR 519 N -3.57 1.82 -0.04 -0.55 1.51 -1.26 -5.09 117.35 110.15 1xef s TYR 519 Ca -0.13 -1.04 0.03 0.00 -1.01 0.00 0.00 57.07 54.91 1xef s TYR 519 Cb 0.05 -1.15 0.01 0.00 -0.11 0.00 0.00 41.96 40.75 1xef s TYR 519 CO 0.81 -0.12 -0.12 0.96 -1.11 0.00 0.00 175.55 175.98 1xef s ILE 520 N -3.45 1.05 0.66 2.71 -5.25 -1.26 -4.71 121.20 110.94 1xef s ILE 520 Ca 0.37 -0.48 -0.18 0.00 -0.99 0.00 0.00 60.65 59.38 1xef s ILE 520 Cb 0.08 -0.94 -0.00 0.00 2.95 0.00 0.00 42.46 44.55 1xef s ILE 520 CO 0.15 0.32 1.27 -2.16 -1.79 0.00 0.00 174.94 172.73 1xef s PRO 521 N 0.35 2.52 0.25 0.37 0.04 -1.26 -4.85 135.00 132.42 1xef s PRO 521 Ca -0.08 1.98 0.13 0.00 0.04 0.00 0.00 61.00 63.08 1xef s PRO 521 Cb -0.12 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 32.66 1xef s PRO 521 CO 0.02 -1.60 1.45 1.05 0.04 0.00 0.00 177.00 177.96 1xef h GLU 522 N 0.43 0.00 -3.63 4.56 4.11 -1.73 -3.46 114.58 114.85 1xef h GLU 522 Ca -0.50 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 58.81 1xef h GLU 522 Cb 1.33 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.40 1xef h GLU 522 CO 0.53 0.63 -0.42 1.21 0.07 0.00 0.00 179.01 181.02 1xef s ASN 523 N -6.54 0.07 0.00 3.06 3.84 -1.20 -5.04 114.94 109.13 1xef s ASN 523 Ca 0.02 -0.42 0.00 0.00 0.21 0.00 0.00 52.86 52.67 1xef s ASN 523 Cb 0.09 0.28 0.00 0.00 -0.55 0.00 0.00 41.25 41.07 1xef s ASN 523 CO 0.76 -0.56 0.00 0.61 -2.79 0.00 0.00 177.10 175.12 1xef n GLY 524 N 0.66 -0.24 3.11 1.21 0.00 -1.23 -1.61 105.19 107.08 1xef n GLY 524 Ca -0.19 -1.81 -0.17 0.00 0.00 0.00 0.00 46.02 43.86 1xef n GLY 524 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xef s GLN 525 N -1.58 0.72 -0.13 1.61 1.11 -0.48 -4.90 119.66 116.00 1xef s GLN 525 Ca 0.00 -0.75 -0.00 0.00 0.01 0.00 0.00 55.36 54.61 1xef s GLN 525 Cb 0.00 -0.64 -0.01 0.00 -1.01 0.00 0.00 33.01 31.34 1xef s GLN 525 CO 0.00 0.15 -0.13 0.08 0.01 0.00 0.00 175.29 175.39 1xef s VAL 526 N -1.07 3.01 -0.03 1.09 1.01 -1.26 -1.19 120.40 121.96 1xef s VAL 526 Ca -0.03 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.31 1xef s VAL 526 Cb -0.09 -2.26 -0.00 0.00 0.00 0.00 0.00 36.38 34.03 1xef s VAL 526 CO 0.01 0.52 -0.13 -0.76 0.00 0.00 0.00 175.10 174.74 1xef s LEU 527 N 0.43 1.89 -0.20 3.92 1.02 -0.36 -0.96 118.68 124.42 1xef s LEU 527 Ca -0.10 -0.26 -0.00 0.00 0.02 0.00 0.00 54.13 53.78 1xef s LEU 527 Cb -0.16 -0.74 0.01 0.00 0.02 0.00 0.00 46.19 45.32 1xef s LEU 527 CO 0.05 0.12 -0.15 -0.63 0.02 0.00 0.00 176.35 175.76 1xef s ILE 528 N 0.02 2.45 -1.52 -0.59 1.01 -0.44 -0.57 121.20 121.55 1xef s ILE 528 Ca -0.01 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.72 1xef s ILE 528 Cb -0.09 -2.07 0.06 0.00 0.01 0.00 0.00 42.46 40.37 1xef s ILE 528 CO 0.01 0.48 0.57 -0.67 0.00 0.00 0.00 174.94 175.33 1xef n ASP 529 N 4.67 -1.61 0.00 3.58 2.03 0.42 -1.23 116.55 124.41 1xef n ASP 529 Ca -0.20 -1.00 0.00 0.00 0.52 0.00 0.00 54.79 54.11 1xef n ASP 529 Cb 0.50 -2.97 0.00 0.00 -0.72 0.00 0.00 41.12 37.93 1xef n ASP 529 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xef n GLY 530 N -1.78 1.21 3.51 0.27 0.00 -1.26 -5.02 105.19 102.12 1xef n GLY 530 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 1xef n GLY 530 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xef s HIS 531 N -3.52 3.21 0.13 1.61 3.76 -0.36 -5.05 115.29 115.06 1xef s HIS 531 Ca 0.00 -0.27 -0.31 0.00 -0.15 0.00 0.00 55.06 54.33 1xef s HIS 531 Cb 0.00 -2.43 -0.10 0.00 1.11 0.00 0.00 32.58 31.17 1xef s HIS 531 CO 0.00 -0.36 1.65 0.34 -0.85 0.00 0.00 174.74 175.52 1xef s ASP 532 N 1.70 6.55 0.61 1.40 -1.08 -1.26 -1.33 116.67 123.26 1xef s ASP 532 Ca 0.06 2.61 0.35 0.00 -0.52 0.00 0.00 52.55 55.05 1xef s ASP 532 Cb -0.17 -2.58 1.97 0.00 -1.46 0.00 0.00 42.92 40.68 1xef s ASP 532 CO 0.09 -0.89 2.26 -0.07 0.52 0.00 0.00 175.17 177.08 1xef h LEU 533 N 7.75 0.00 -2.62 -1.34 3.38 -1.44 -0.73 115.31 120.31 1xef h LEU 533 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1xef h LEU 533 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1xef h LEU 533 CO 0.93 0.02 0.05 0.00 0.09 0.00 0.00 178.44 179.53 1xef h ALA 534 N 1.98 1.05 0.00 1.53 0.00 -1.90 -2.42 119.26 119.50 1xef h ALA 534 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xef h ALA 534 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1xef h ALA 534 CO 0.00 -0.05 -0.02 1.28 0.00 0.00 0.00 179.25 180.47 1xef n LEU 535 N -2.93 2.04 -4.81 0.00 4.77 -0.28 -5.06 117.00 110.72 1xef n LEU 535 Ca -0.03 -2.41 -0.37 0.00 -0.03 0.00 0.00 56.01 53.18 1xef n LEU 535 Cb 0.12 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.95 1xef n LEU 535 CO 0.17 0.57 0.40 0.00 -1.33 0.00 0.00 177.39 177.21 1xef s ALA 536 N -1.80 3.45 -0.11 -1.18 0.00 -0.91 -5.01 121.76 116.19 1xef s ALA 536 Ca 0.15 0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.98 1xef s ALA 536 Cb 0.13 -2.81 -0.04 0.00 0.00 0.00 0.00 23.12 20.40 1xef s ALA 536 CO 0.01 0.34 1.59 0.34 0.00 0.00 0.00 175.76 178.05 1xef s ASP 537 N -1.51 6.62 0.32 0.00 -1.08 -1.26 -4.92 116.67 114.84 1xef s ASP 537 Ca 0.40 2.00 0.02 0.00 -0.52 0.00 0.00 52.55 54.45 1xef s ASP 537 Cb -0.18 -2.53 0.57 0.00 -1.46 0.00 0.00 42.92 39.32 1xef s ASP 537 CO 0.22 -0.99 1.94 -0.65 0.52 0.00 0.00 175.17 176.20 1xef h PRO 538 N 9.70 0.94 -0.69 4.34 0.11 -1.96 -0.25 132.00 144.17 1xef h PRO 538 Ca -0.36 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.65 1xef h PRO 538 Cb 1.16 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.03 1xef h PRO 538 CO 0.97 0.62 0.27 -0.91 -0.21 0.00 0.00 178.00 178.73 1xef h ASN 539 N 0.97 0.97 -0.51 -2.05 -0.26 -2.00 -2.19 115.58 110.50 1xef h ASN 539 Ca 0.35 -0.18 -0.03 0.00 -0.56 0.00 0.00 56.30 55.87 1xef h ASN 539 Cb 0.14 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.13 1xef h ASN 539 CO -0.12 0.88 0.19 -0.25 -1.06 0.00 0.00 177.43 177.08 1xef h TRP 540 N 0.99 0.79 -0.66 1.19 7.01 -1.66 -3.01 115.95 120.60 1xef h TRP 540 Ca 0.23 -0.07 -0.05 0.00 2.11 0.00 0.00 58.89 61.11 1xef h TRP 540 Cb 0.23 -0.24 -0.03 0.00 -2.10 0.00 0.00 29.16 27.02 1xef h TRP 540 CO 0.02 0.67 0.21 1.25 -2.79 0.00 0.00 178.44 177.79 1xef h LEU 541 N 0.69 0.94 -1.78 0.65 5.85 -0.94 -2.21 115.31 118.52 1xef h LEU 541 Ca 0.17 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1xef h LEU 541 Cb 0.22 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 1xef h LEU 541 CO -0.01 0.88 -0.15 0.03 -0.34 0.00 0.00 178.44 178.85 1xef h ARG 542 N 0.98 0.00 0.00 1.25 3.08 -1.33 -1.97 114.38 116.39 1xef h ARG 542 Ca 0.22 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.11 1xef h ARG 542 Cb 0.28 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1xef h ARG 542 CO -0.01 0.15 -0.73 0.00 -1.07 0.00 0.00 179.97 178.31 1xef h ARG 543 N 0.00 0.00 0.02 0.04 3.08 -1.28 -3.34 114.38 112.90 1xef h ARG 543 Ca -0.00 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.82 1xef h ARG 543 Cb 0.30 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 1xef h ARG 543 CO 0.02 0.73 -1.14 1.96 -1.07 0.00 0.00 179.97 180.47 1xef h GLN 544 N 0.00 0.04 -5.22 0.04 1.08 -0.85 -3.38 115.11 106.82 1xef h GLN 544 Ca -0.01 -0.07 -0.67 0.00 -1.45 0.00 0.00 58.65 56.45 1xef h GLN 544 Cb 1.53 0.03 -0.33 0.00 -0.05 0.00 0.00 27.48 28.66 1xef h GLN 544 CO 0.09 0.97 -0.86 0.08 -0.95 0.00 0.00 178.83 178.17 1xef s VAL 545 N -2.69 2.20 -0.10 -0.54 1.01 -0.81 0.23 120.40 119.71 1xef s VAL 545 Ca -0.01 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.08 1xef s VAL 545 Cb 0.09 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.59 1xef s VAL 545 CO 0.83 0.54 -0.23 -0.83 0.00 0.00 0.00 175.10 175.41 1xef s GLY 546 N 0.75 1.29 -0.12 4.51 0.00 -0.13 -4.78 107.32 108.84 1xef s GLY 546 Ca -0.08 -0.93 0.02 0.00 0.00 0.00 0.00 44.72 43.73 1xef s GLY 546 CO -0.00 -0.29 -0.19 0.14 0.00 0.00 0.00 173.10 172.75 1xef s VAL 547 N 0.37 2.44 -0.27 1.40 1.01 -1.26 -0.66 120.40 123.43 1xef s VAL 547 Ca -0.19 -0.87 -0.05 0.00 0.00 0.00 0.00 61.98 60.87 1xef s VAL 547 Cb -0.18 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.22 1xef s VAL 547 CO 0.09 0.54 0.03 -0.69 0.00 0.00 0.00 175.10 175.07 1xef s VAL 548 N 0.48 3.71 0.66 2.92 1.01 -0.25 -5.00 120.40 123.93 1xef s VAL 548 Ca -0.13 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 1xef s VAL 548 Cb -0.17 -2.85 0.14 0.00 0.00 0.00 0.00 36.38 33.50 1xef s VAL 548 CO 0.05 0.19 0.90 0.18 0.00 0.00 0.00 175.10 176.42 1xef n LEU 549 N 4.83 0.00 -0.16 3.92 4.77 -1.26 -1.65 117.00 127.45 1xef n LEU 549 Ca -0.16 -1.64 -0.03 0.00 -0.03 0.00 0.00 56.01 54.15 1xef n LEU 549 Cb 0.49 -0.61 0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1xef n LEU 549 CO 0.30 -1.00 0.97 -0.61 -1.33 0.00 0.00 177.39 175.73 1xef h GLN 550 N 0.00 0.37 -5.82 3.23 4.15 -1.64 -3.40 115.11 111.99 1xef h GLN 550 Ca -0.30 -0.02 -0.57 0.00 0.77 0.00 0.00 58.65 58.53 1xef h GLN 550 Cb 1.02 -0.08 -0.29 0.00 0.21 0.00 0.00 27.48 28.33 1xef h GLN 550 CO 0.29 0.24 -0.84 0.34 -1.93 0.00 0.00 178.83 176.93 1xef s ASP 551 N -5.41 2.22 -0.01 -0.69 -1.08 -1.26 -4.92 116.67 105.52 1xef s ASP 551 Ca -0.13 -0.35 0.01 0.00 -0.52 0.00 0.00 52.55 51.56 1xef s ASP 551 Cb 0.15 -0.24 0.01 0.00 -1.46 0.00 0.00 42.92 41.37 1xef s ASP 551 CO 0.73 0.23 -0.02 0.20 0.52 0.00 0.00 175.17 176.83 1xef s ASN 552 N -0.47 0.28 -0.20 -0.34 -0.87 -1.26 -5.13 114.94 106.96 1xef s ASN 552 Ca 0.07 -0.03 -0.16 0.00 -1.57 0.00 0.00 52.86 51.17 1xef s ASN 552 Cb -0.07 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.25 41.05 1xef s ASN 552 CO -0.01 -0.01 0.39 0.68 -2.57 0.00 0.00 177.10 175.59 1xef s VAL 553 N 0.22 5.21 0.16 1.60 -7.23 -1.26 -4.96 120.40 114.13 1xef s VAL 553 Ca -0.02 0.70 -0.15 0.00 -1.81 0.00 0.00 61.98 60.70 1xef s VAL 553 Cb -0.04 -3.72 -0.07 0.00 0.56 0.00 0.00 36.38 33.10 1xef s VAL 553 CO -0.01 0.26 0.57 -0.76 -0.31 0.00 0.00 175.10 174.86 1xef s LEU 554 N 1.25 4.34 0.47 1.32 1.43 -1.26 -5.06 118.68 121.16 1xef s LEU 554 Ca 0.19 1.12 -0.21 0.00 -1.03 0.00 0.00 54.13 54.20 1xef s LEU 554 Cb -0.15 -3.32 -0.08 0.00 0.03 0.00 0.00 46.19 42.68 1xef s LEU 554 CO 0.08 0.09 1.07 -0.76 0.23 0.00 0.00 176.35 177.05 1xef s LEU 555 N -1.97 3.93 -1.04 1.79 1.43 -1.26 -3.89 118.68 117.67 1xef s LEU 555 Ca 0.39 2.03 -0.20 0.00 -1.03 0.00 0.00 54.13 55.31 1xef s LEU 555 Cb -0.15 -4.43 -0.08 0.00 0.03 0.00 0.00 46.19 41.56 1xef s LEU 555 CO 0.19 -0.77 1.99 -3.20 0.23 0.00 0.00 176.35 174.79 1xef n ASN 556 N -0.71 3.12 -0.60 2.29 5.15 -1.26 -4.75 115.26 118.50 1xef n ASN 556 Ca 0.08 -2.74 0.00 0.00 -0.60 0.00 0.00 54.58 51.32 1xef n ASN 556 Cb 0.51 -1.39 0.00 0.00 -0.53 0.00 0.00 39.78 38.37 1xef n ASN 556 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 1xef n ARG 557 N 7.07 0.00 -1.45 1.20 1.85 -1.26 -4.93 116.66 119.14 1xef n ARG 557 Ca 0.49 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 57.02 1xef n ARG 557 Cb 0.41 0.00 0.08 0.00 -1.05 0.00 0.00 32.46 31.90 1xef n ARG 557 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 1xef s SER 558 N -0.00 4.67 0.14 2.89 1.04 -1.26 -1.50 113.70 119.68 1xef s SER 558 Ca 0.00 1.94 -0.17 0.00 0.48 0.00 0.00 55.95 58.20 1xef s SER 558 Cb 0.00 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.60 1xef s SER 558 CO 0.00 -1.93 1.75 0.40 0.98 0.00 0.00 173.24 174.45 1xef h ILE 559 N -0.63 0.93 -0.81 -1.02 2.04 -0.91 -1.06 117.51 116.06 1xef h ILE 559 Ca -0.45 -0.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 1xef h ILE 559 Cb 1.24 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 1xef h ILE 559 CO 0.52 0.05 0.50 -0.29 0.00 0.00 0.00 178.15 178.93 1xef h ILE 560 N 0.25 1.22 -0.49 -0.67 2.10 -1.61 -1.28 117.51 117.04 1xef h ILE 560 Ca 0.13 -0.45 -0.09 0.00 1.08 0.00 0.00 64.86 65.53 1xef h ILE 560 Cb 0.09 0.07 -0.02 0.00 -1.09 0.00 0.00 36.82 35.87 1xef h ILE 560 CO -0.13 0.22 -0.04 0.44 -1.08 0.00 0.00 178.15 177.57 1xef h ASP 561 N 1.10 0.88 -0.60 2.19 3.32 -1.75 -0.82 116.42 120.74 1xef h ASP 561 Ca 0.29 -0.32 0.02 0.00 0.02 0.00 0.00 57.03 57.03 1xef h ASP 561 Cb -0.07 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.21 1xef h ASP 561 CO -0.06 1.00 0.39 0.78 -1.72 0.00 0.00 179.24 179.62 1xef h ASN 562 N 0.75 0.65 -0.47 6.45 4.21 -0.71 0.09 115.58 126.56 1xef h ASN 562 Ca 0.13 -0.01 -0.13 0.00 1.21 0.00 0.00 56.30 57.50 1xef h ASN 562 Cb 0.57 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 37.60 1xef h ASN 562 CO 0.03 0.46 -0.23 0.40 -1.29 0.00 0.00 177.43 176.81 1xef h ILE 563 N 0.78 1.27 -0.00 2.81 2.04 -1.17 -3.22 117.51 120.02 1xef h ILE 563 Ca 0.23 -1.40 0.00 0.00 1.00 0.00 0.00 64.86 64.70 1xef h ILE 563 Cb -0.04 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 1xef h ILE 563 CO -0.07 0.48 -0.14 -1.20 0.00 0.00 0.00 178.15 177.22 1xef n SER 564 N -4.11 0.19 -0.31 1.72 7.64 -0.32 -4.18 113.62 114.25 1xef n SER 564 Ca -0.00 0.12 0.05 0.00 1.01 0.00 0.00 58.87 60.06 1xef n SER 564 Cb 0.47 -0.24 0.12 0.00 -1.01 0.00 0.00 64.21 63.55 1xef n SER 564 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1xef n LEU 565 N -1.41 -0.31 -0.27 -3.43 0.00 -0.00 -0.44 117.00 111.13 1xef n LEU 565 Ca 0.08 1.50 -0.07 0.00 0.00 0.00 0.00 56.01 57.52 1xef n LEU 565 Cb 0.32 -0.45 -0.07 0.00 0.00 0.00 0.00 43.42 43.22 1xef n LEU 565 CO 0.28 -1.44 0.45 0.00 0.00 0.00 0.00 177.39 176.69 1xef n ALA 566 N -3.68 -0.42 -3.37 1.96 0.00 -1.26 -4.38 120.51 109.36 1xef n ALA 566 Ca 0.14 0.55 -0.15 0.00 0.00 0.00 0.00 53.44 53.99 1xef n ALA 566 Cb 0.44 0.05 -0.09 0.00 0.00 0.00 0.00 19.45 19.85 1xef n ALA 566 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1xef s ASN 567 N -4.72 1.31 0.73 0.00 3.84 0.41 -5.04 114.94 111.47 1xef s ASN 567 Ca -0.08 -0.71 -0.11 0.00 0.21 0.00 0.00 52.86 52.17 1xef s ASN 567 Cb 0.07 0.67 0.03 0.00 -0.55 0.00 0.00 41.25 41.47 1xef s ASN 567 CO 0.40 -0.37 1.08 -2.16 -2.79 0.00 0.00 177.10 173.26 1xef s PRO 568 N 2.36 2.68 0.00 0.43 0.04 -1.02 -3.75 135.00 135.74 1xef s PRO 568 Ca 0.10 0.74 0.00 0.00 0.04 0.00 0.00 61.00 61.88 1xef s PRO 568 Cb -0.14 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1xef s PRO 568 CO -0.31 -1.22 0.00 0.41 0.04 0.00 0.00 177.00 175.92 1xef n GLY 569 N -2.27 2.74 3.77 0.56 0.00 -1.26 -5.03 105.19 103.69 1xef n GLY 569 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1xef n GLY 569 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xef s MET 570 N -0.44 4.12 0.50 1.61 0.00 -1.25 -4.96 119.30 118.89 1xef s MET 570 Ca 0.00 2.17 -0.23 0.00 0.00 0.00 0.00 55.69 57.62 1xef s MET 570 Cb 0.00 -2.87 -0.07 0.00 0.00 0.00 0.00 34.83 31.89 1xef s MET 570 CO 0.00 -0.37 1.35 -1.13 0.00 0.00 0.00 175.02 174.87 1xef n SER 571 N 0.38 2.76 -0.25 1.11 3.41 -1.26 -4.93 113.62 114.85 1xef n SER 571 Ca 0.02 1.04 0.01 0.00 -0.26 0.00 0.00 58.87 59.68 1xef n SER 571 Cb 0.43 -1.56 0.24 0.00 -0.26 0.00 0.00 64.21 63.06 1xef n SER 571 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1xef h VAL 572 N 1.77 1.16 0.00 -3.33 2.07 -2.01 -2.59 116.25 113.33 1xef h VAL 572 Ca -0.50 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 1xef h VAL 572 Cb 1.29 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1xef h VAL 572 CO 0.58 0.19 -0.21 1.05 0.02 0.00 0.00 177.57 179.20 1xef h GLU 573 N 1.04 0.00 -0.40 1.57 9.09 -1.99 -0.43 114.58 123.46 1xef h GLU 573 Ca 0.31 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 59.59 1xef h GLU 573 Cb -0.03 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.05 1xef h GLU 573 CO -0.08 0.21 -0.25 0.87 0.05 0.00 0.00 179.01 179.81 1xef h LYS 574 N 0.00 0.82 -0.08 1.06 1.79 -1.84 0.32 116.57 118.65 1xef h LYS 574 Ca -0.00 -0.35 -0.01 0.00 -2.18 0.00 0.00 60.65 58.10 1xef h LYS 574 Cb 0.46 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1xef h LYS 574 CO 0.03 0.99 0.00 0.28 -1.08 0.00 0.00 179.45 179.66 1xef h VAL 575 N 0.71 1.25 -0.79 0.50 2.07 -1.34 -1.68 116.25 116.97 1xef h VAL 575 Ca 0.09 -0.78 0.05 0.00 0.82 0.00 0.00 66.70 66.88 1xef h VAL 575 Cb 0.79 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 32.11 1xef h VAL 575 CO 0.07 0.22 0.49 0.40 0.02 0.00 0.00 177.57 178.76 1xef h ILE 576 N -0.13 1.07 -0.44 4.57 2.04 -1.08 -1.60 117.51 121.93 1xef h ILE 576 Ca 0.02 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1xef h ILE 576 Cb 0.34 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1xef h ILE 576 CO 0.00 0.17 0.17 0.22 0.00 0.00 0.00 178.15 178.72 1xef h TYR 577 N 0.93 0.68 -0.62 1.37 3.20 -0.84 -1.23 116.97 120.46 1xef h TYR 577 Ca 0.33 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 1xef h TYR 577 Cb 0.09 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 1xef h TYR 577 CO -0.04 0.59 0.36 0.00 -1.64 0.00 0.00 178.16 177.43 1xef h ALA 578 N 1.02 1.46 -0.41 1.82 0.00 -1.03 -2.24 119.26 119.88 1xef h ALA 578 Ca 0.15 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1xef h ALA 578 Cb 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xef h ALA 578 CO -0.01 0.46 -0.22 0.00 0.00 0.00 0.00 179.25 179.47 1xef h ALA 579 N 1.54 0.83 -0.63 0.00 0.00 -0.94 -2.70 119.26 117.36 1xef h ALA 579 Ca 0.22 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1xef h ALA 579 Cb -0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1xef h ALA 579 CO -0.04 0.64 0.31 0.87 0.00 0.00 0.00 179.25 181.03 1xef h LYS 580 N 0.71 0.90 -0.19 0.00 1.57 -0.80 0.12 116.57 118.89 1xef h LYS 580 Ca 0.10 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1xef h LYS 580 Cb 0.75 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 1xef h LYS 580 CO 0.06 0.72 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.47 1xef h LEU 581 N 0.87 0.28 -0.08 2.94 4.07 -1.33 -2.06 115.31 120.00 1xef h LEU 581 Ca 0.22 -0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.12 1xef h LEU 581 Cb 0.11 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.77 1xef h LEU 581 CO -0.03 0.44 -0.19 0.00 -1.08 0.00 0.00 178.44 177.58 1xef n ALA 582 N -2.49 2.86 -2.41 1.53 0.00 -1.03 -4.49 120.51 114.48 1xef n ALA 582 Ca -0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 53.44 53.11 1xef n ALA 582 Cb 0.27 -1.31 0.01 0.00 0.00 0.00 0.00 19.45 18.42 1xef n ALA 582 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xef n GLY 583 N 1.42 0.10 0.01 0.00 0.00 -0.76 -4.79 105.19 101.17 1xef n GLY 583 Ca 0.09 -0.44 0.05 0.00 0.00 0.00 0.00 46.02 45.71 1xef n GLY 583 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xef n ALA 584 N -2.06 2.36 -0.19 4.61 0.00 0.35 -4.69 120.51 120.90 1xef n ALA 584 Ca -0.07 -0.37 -0.04 0.00 0.00 0.00 0.00 53.44 52.95 1xef n ALA 584 Cb 0.56 -0.38 0.06 0.00 0.00 0.00 0.00 19.45 19.70 1xef n ALA 584 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xef h HIS 585 N 0.00 0.56 -0.61 0.00 6.17 -1.83 -2.21 115.15 117.23 1xef h HIS 585 Ca -0.05 0.02 0.04 0.00 0.71 0.00 0.00 60.37 61.09 1xef h HIS 585 Cb 0.75 -0.17 -0.04 0.00 2.52 0.00 0.00 27.41 30.47 1xef h HIS 585 CO 0.00 0.29 0.36 -0.44 0.71 0.00 0.00 177.93 178.84 1xef h ASP 586 N 0.59 0.56 0.50 3.26 3.32 -1.90 0.34 116.42 123.09 1xef h ASP 586 Ca 0.24 0.01 -0.18 0.00 0.02 0.00 0.00 57.03 57.13 1xef h ASP 586 Cb 0.11 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1xef h ASP 586 CO -0.15 0.38 -0.77 2.19 -1.72 0.00 0.00 179.24 179.17 1xef h PHE 587 N 0.69 0.30 -0.32 4.55 -5.15 -1.82 -2.98 116.94 112.21 1xef h PHE 587 Ca 0.26 -0.14 -0.08 0.00 -0.20 0.00 0.00 57.97 57.80 1xef h PHE 587 Cb 0.08 -0.04 -0.01 0.00 0.22 0.00 0.00 35.95 36.20 1xef h PHE 587 CO -0.07 0.90 -0.11 0.82 -2.00 0.00 0.00 178.31 177.86 1xef h ILE 588 N 0.13 1.28 -0.49 0.88 2.04 -1.11 -3.08 117.51 117.17 1xef h ILE 588 Ca -0.03 -1.18 0.01 0.00 1.00 0.00 0.00 64.86 64.66 1xef h ILE 588 Cb 1.35 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.80 1xef h ILE 588 CO 0.12 0.38 0.33 0.28 0.00 0.00 0.00 178.15 179.25 1xef h SER 589 N 0.40 0.55 1.18 1.72 0.02 -0.96 -2.46 113.55 114.01 1xef h SER 589 Ca 0.08 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1xef h SER 589 Cb 0.61 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1xef h SER 589 CO 0.04 0.40 -0.03 -0.62 -1.14 0.00 0.00 176.83 175.48 1xef n GLU 590 N -4.46 0.12 -2.13 3.45 1.02 -1.13 -4.68 120.64 112.82 1xef n GLU 590 Ca 0.04 0.09 -0.39 0.00 -0.02 0.00 0.00 57.16 56.89 1xef n GLU 590 Cb 0.06 -1.63 -0.01 0.00 -0.02 0.00 0.00 31.44 29.84 1xef n GLU 590 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1xef s LEU 591 N -3.67 4.20 0.30 -4.62 1.43 -0.93 -4.93 118.68 110.46 1xef s LEU 591 Ca 0.12 2.55 0.03 0.00 -1.03 0.00 0.00 54.13 55.81 1xef s LEU 591 Cb 0.16 -3.95 0.63 0.00 0.03 0.00 0.00 46.19 43.06 1xef s LEU 591 CO 0.57 -0.80 1.83 0.03 0.23 0.00 0.00 176.35 178.20 1xef h ARG 592 N 2.64 0.88 -0.51 1.70 2.47 -1.87 -2.18 114.38 117.52 1xef h ARG 592 Ca -0.49 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.17 1xef h ARG 592 Cb 1.24 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 29.36 1xef h ARG 592 CO 0.62 0.58 0.00 -1.91 0.56 0.00 0.00 179.97 179.83 1xef n GLU 593 N -4.64 2.62 0.00 0.04 4.07 -1.26 -5.06 120.64 116.41 1xef n GLU 593 Ca 0.20 -2.32 0.00 0.00 -0.06 0.00 0.00 57.16 54.98 1xef n GLU 593 Cb 0.42 -1.44 0.00 0.00 -0.06 0.00 0.00 31.44 30.35 1xef n GLU 593 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1xef n GLY 594 N 1.20 3.30 0.22 8.31 0.00 -0.82 -1.78 105.19 115.62 1xef n GLY 594 Ca 0.18 -0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.28 1xef n GLY 594 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xef h TYR 595 N 0.00 0.00 -0.00 1.61 0.05 -1.92 -3.01 116.97 113.70 1xef h TYR 595 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1xef h TYR 595 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1xef h TYR 595 CO 0.00 0.00 -0.07 0.09 -1.05 0.00 0.00 178.16 177.13 1xef n ASN 596 N -2.86 0.37 -4.66 3.88 3.02 -0.73 -1.58 115.26 112.71 1xef n ASN 596 Ca 0.02 -0.61 -0.43 0.00 -0.03 0.00 0.00 54.58 53.53 1xef n ASN 596 Cb 0.36 -0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.39 1xef n ASN 596 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1xef n THR 597 N -0.96 0.72 -2.42 3.41 -1.04 -1.12 -4.67 114.28 108.21 1xef n THR 597 Ca 0.16 -0.14 -0.43 0.00 -2.04 0.00 0.00 64.05 61.60 1xef n THR 597 Cb 0.25 -2.24 -0.02 0.00 -1.82 0.00 0.00 70.33 66.50 1xef n THR 597 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1xef s ILE 598 N 4.55 4.26 0.56 12.58 1.09 -1.26 -1.71 121.20 141.26 1xef s ILE 598 Ca 0.90 1.52 -0.09 0.00 -1.10 0.00 0.00 60.65 61.88 1xef s ILE 598 Cb -0.49 -4.00 0.14 0.00 -1.06 0.00 0.00 42.46 37.05 1xef s ILE 598 CO 0.44 -0.16 0.53 1.33 -0.10 0.00 0.00 174.94 176.98 1xef n VAL 599 N 5.43 0.00 -1.15 2.92 0.24 -0.56 -4.90 118.33 120.31 1xef n VAL 599 Ca 0.14 -0.26 -0.34 0.00 -2.04 0.00 0.00 64.34 61.84 1xef n VAL 599 Cb 0.45 -1.20 0.12 0.00 -1.47 0.00 0.00 33.84 31.73 1xef n VAL 599 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xef n GLY 600 N -0.65 -0.34 0.61 7.63 0.00 -1.23 -4.62 105.19 106.59 1xef n GLY 600 Ca 0.07 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1xef n GLY 600 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xef n GLU 601 N -2.70 0.96 0.00 1.61 4.71 -1.26 -2.64 120.64 121.32 1xef n GLU 601 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.28 1xef n GLU 601 Cb 0.50 -1.37 0.00 0.00 -1.01 0.00 0.00 31.44 29.56 1xef n GLU 601 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1xef n GLN 602 N 0.14 0.00 0.00 3.49 -0.06 -1.26 -4.98 117.38 114.70 1xef n GLN 602 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1xef n GLN 602 Cb 0.29 -0.09 0.00 0.00 -4.06 0.00 0.00 30.24 26.39 1xef n GLN 602 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1xef n GLY 603 N 0.00 3.84 3.16 1.69 0.00 -1.08 -4.79 105.19 108.01 1xef n GLY 603 Ca 0.00 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 1xef n GLY 603 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xef s ALA 604 N 0.00 -1.00 -0.36 4.61 0.00 -1.26 -3.55 121.76 120.20 1xef s ALA 604 Ca 0.00 1.29 0.05 0.00 0.00 0.00 0.00 51.96 53.29 1xef s ALA 604 Cb 0.00 -1.30 0.51 0.00 0.00 0.00 0.00 23.12 22.34 1xef s ALA 604 CO 0.00 -0.80 1.60 0.41 0.00 0.00 0.00 175.76 176.97 1xef n GLY 605 N 5.38 3.48 3.70 0.00 0.00 -1.26 -4.47 105.19 112.02 1xef n GLY 605 Ca -0.07 -0.76 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 1xef n GLY 605 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xef s LEU 606 N -2.28 2.97 0.61 0.99 1.43 -1.26 -4.84 118.68 116.30 1xef s LEU 606 Ca 0.41 -1.22 -0.09 0.00 -1.03 0.00 0.00 54.13 52.19 1xef s LEU 606 Cb 0.34 -1.19 -0.02 0.00 0.03 0.00 0.00 46.19 45.34 1xef s LEU 606 CO 0.09 -0.55 0.97 -0.94 0.23 0.00 0.00 176.35 176.16 1xef s SER 607 N -3.85 5.95 0.17 2.29 1.04 -1.26 -4.89 113.70 113.15 1xef s SER 607 Ca 0.37 1.13 -0.19 0.00 0.48 0.00 0.00 55.95 57.74 1xef s SER 607 Cb 0.06 -2.17 0.09 0.00 0.10 0.00 0.00 66.02 64.10 1xef s SER 607 CO 0.20 -0.95 1.63 1.23 0.98 0.00 0.00 173.24 176.33 1xef h GLY 608 N -0.26 0.08 1.76 7.32 0.00 -1.99 -0.48 103.07 109.50 1xef h GLY 608 Ca -0.45 0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.04 1xef h GLY 608 CO 0.62 -0.20 -0.31 -1.33 0.00 0.00 0.00 176.54 175.33 1xef h GLY 609 N -0.13 0.30 1.02 4.60 0.00 -1.94 -1.44 103.07 105.48 1xef h GLY 609 Ca 0.19 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 1xef h GLY 609 CO -0.47 0.23 -0.07 1.46 0.00 0.00 0.00 176.54 177.69 1xef h GLN 610 N 0.24 0.87 -0.66 4.80 4.20 -1.82 -1.51 115.11 121.23 1xef h GLN 610 Ca 0.03 -0.31 0.05 0.00 0.06 0.00 0.00 58.65 58.48 1xef h GLN 610 Cb 0.67 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.34 1xef h GLN 610 CO 0.05 0.95 0.38 0.00 -0.67 0.00 0.00 178.83 179.54 1xef h ARG 611 N 0.71 0.70 -0.32 1.46 3.08 -0.71 -2.40 114.38 116.91 1xef h ARG 611 Ca 0.12 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.06 1xef h ARG 611 Cb 0.60 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1xef h ARG 611 CO 0.04 0.46 -0.09 0.37 -1.07 0.00 0.00 179.97 179.68 1xef h GLN 612 N 0.72 0.63 -0.40 0.04 5.75 -1.08 -2.29 115.11 118.49 1xef h GLN 612 Ca 0.28 -0.25 -0.06 0.00 -0.15 0.00 0.00 58.65 58.47 1xef h GLN 612 Cb 0.12 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.62 1xef h GLN 612 CO -0.15 0.82 -0.01 0.00 -2.65 0.00 0.00 178.83 176.83 1xef h ARG 613 N 0.40 0.64 -0.26 1.69 3.08 -1.22 -1.23 114.38 117.49 1xef h ARG 613 Ca 0.08 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1xef h ARG 613 Cb 0.59 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1xef h ARG 613 CO 0.03 0.67 0.14 0.82 -1.07 0.00 0.00 179.97 180.56 1xef h ILE 614 N 0.60 1.12 -0.83 2.04 1.08 -1.34 -2.07 117.51 118.12 1xef h ILE 614 Ca 0.12 -0.32 0.03 0.00 -0.39 0.00 0.00 64.86 64.30 1xef h ILE 614 Cb 0.40 0.87 -0.05 0.00 -3.07 0.00 0.00 36.82 34.97 1xef h ILE 614 CO 0.02 0.12 0.55 0.00 -0.69 0.00 0.00 178.15 178.14 1xef h ALA 615 N 1.02 1.47 -0.44 1.87 0.00 -0.96 -0.68 119.26 121.55 1xef h ALA 615 Ca 0.09 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1xef h ALA 615 Cb 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1xef h ALA 615 CO -0.01 0.47 0.02 0.82 0.00 0.00 0.00 179.25 180.54 1xef h ILE 616 N 1.06 1.26 -0.17 0.00 2.04 -1.07 -2.23 117.51 118.39 1xef h ILE 616 Ca 0.32 -0.99 -0.04 0.00 1.00 0.00 0.00 64.86 65.15 1xef h ILE 616 Cb -0.02 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1xef h ILE 616 CO -0.09 0.34 -0.06 0.00 0.00 0.00 0.00 178.15 178.34 1xef h ALA 617 N 0.91 1.58 -0.44 1.87 0.00 -0.75 -2.18 119.26 120.25 1xef h ALA 617 Ca 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1xef h ALA 617 Cb 0.46 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1xef h ALA 617 CO 0.02 0.31 0.13 -0.09 0.00 0.00 0.00 179.25 179.62 1xef h ARG 618 N 0.25 0.69 -0.52 0.00 2.43 -0.84 -2.04 114.38 114.35 1xef h ARG 618 Ca 0.06 -0.15 -0.10 0.00 -0.81 0.00 0.00 59.98 58.98 1xef h ARG 618 Cb 0.28 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1xef h ARG 618 CO 0.01 0.67 -0.06 0.00 -1.51 0.00 0.00 179.97 179.08 1xef h ALA 619 N 0.99 0.91 -0.48 2.80 0.00 -0.95 -0.33 119.26 122.19 1xef h ALA 619 Ca 0.14 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1xef h ALA 619 Cb 0.27 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1xef h ALA 619 CO -0.00 0.64 -0.11 -0.07 0.00 0.00 0.00 179.25 179.71 1xef h LEU 620 N 0.85 0.87 -0.59 0.00 3.38 -1.36 -2.68 115.31 115.78 1xef h LEU 620 Ca 0.15 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 1xef h LEU 620 Cb 0.59 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1xef h LEU 620 CO 0.04 0.99 0.18 0.58 0.09 0.00 0.00 178.44 180.32 1xef h VAL 621 N 0.79 1.24 -0.95 1.22 2.07 -1.14 -2.38 116.25 117.10 1xef h VAL 621 Ca 0.13 -0.83 0.25 0.00 0.82 0.00 0.00 66.70 67.07 1xef h VAL 621 Cb 0.62 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 1xef h VAL 621 CO 0.04 0.31 0.65 0.78 0.02 0.00 0.00 177.57 179.37 1xef h ASN 622 N 0.83 0.22 -5.81 0.57 4.21 -0.76 -3.47 115.58 111.38 1xef h ASN 622 Ca 0.19 0.03 -0.33 0.00 1.21 0.00 0.00 56.30 57.40 1xef h ASN 622 Cb 0.29 -0.01 0.14 0.00 -1.12 0.00 0.00 38.32 37.63 1xef h ASN 622 CO -0.00 0.07 -0.88 -3.20 -1.29 0.00 0.00 177.43 172.13 1xef n ASN 623 N -4.41 -6.09 -4.89 5.81 4.05 -0.90 -5.02 115.26 103.82 1xef n ASN 623 Ca 0.21 -0.83 -0.29 0.00 0.45 0.00 0.00 54.58 54.11 1xef n ASN 623 Cb 0.88 -4.37 -0.01 0.00 1.23 0.00 0.00 39.78 37.51 1xef n ASN 623 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1xef s PRO 624 N -5.07 3.65 0.10 1.20 0.04 -1.26 -4.97 135.00 128.69 1xef s PRO 624 Ca 0.45 0.40 0.27 0.00 0.04 0.00 0.00 61.00 62.16 1xef s PRO 624 Cb -0.11 -2.33 1.02 0.00 0.04 0.00 0.00 34.50 33.12 1xef s PRO 624 CO 0.80 -0.20 1.84 1.63 0.04 0.00 0.00 177.00 181.10 1xef n LYS 625 N -1.98 0.12 -3.88 4.56 5.02 -0.84 -4.62 118.16 116.55 1xef n LYS 625 Ca 0.02 0.12 -0.26 0.00 -2.02 0.00 0.00 58.31 56.17 1xef n LYS 625 Cb 0.55 -1.65 -0.17 0.00 -0.02 0.00 0.00 35.03 33.74 1xef n LYS 625 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1xef s ILE 626 N -3.06 0.93 -0.17 -0.18 1.01 0.14 -1.48 121.20 118.39 1xef s ILE 626 Ca 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 1xef s ILE 626 Cb 0.15 -1.01 -0.00 0.00 0.01 0.00 0.00 42.46 41.61 1xef s ILE 626 CO 0.54 0.30 -0.12 -0.22 0.00 0.00 0.00 174.94 175.45 1xef s LEU 627 N 1.74 2.63 -0.18 2.97 2.96 0.25 -0.96 118.68 128.10 1xef s LEU 627 Ca 0.04 -0.43 -0.00 0.00 -0.22 0.00 0.00 54.13 53.52 1xef s LEU 627 Cb -0.13 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 44.94 1xef s LEU 627 CO -0.08 0.06 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.24 1xef s ILE 628 N 0.95 2.59 -0.35 6.68 1.01 0.17 -0.75 121.20 131.50 1xef s ILE 628 Ca -0.02 -0.78 -0.11 0.00 0.00 0.00 0.00 60.65 59.74 1xef s ILE 628 Cb -0.15 -2.11 0.01 0.00 0.01 0.00 0.00 42.46 40.22 1xef s ILE 628 CO -0.01 0.51 0.19 -0.36 0.00 0.00 0.00 174.94 175.27 1xef s PHE 629 N 1.11 3.21 -0.67 3.97 0.40 0.81 -1.08 117.98 125.74 1xef s PHE 629 Ca 0.00 -0.70 -0.06 0.00 -0.60 0.00 0.00 56.93 55.57 1xef s PHE 629 Cb -0.14 -2.42 0.17 0.00 0.51 0.00 0.00 43.02 41.14 1xef s PHE 629 CO -0.05 -0.54 0.52 0.34 0.70 0.00 0.00 175.22 176.19 1xef s ASP 630 N 1.60 5.70 -1.45 1.36 -1.08 -0.66 0.04 116.67 122.19 1xef s ASP 630 Ca 0.04 -2.73 -0.09 0.00 -0.52 0.00 0.00 52.55 49.25 1xef s ASP 630 Cb -0.18 -1.96 0.04 0.00 -1.46 0.00 0.00 42.92 39.36 1xef s ASP 630 CO 0.07 -0.45 0.71 -0.62 0.52 0.00 0.00 175.17 175.40 1xef n GLU 631 N 3.74 -4.88 0.26 4.34 -0.58 0.07 -2.37 120.64 121.23 1xef n GLU 631 Ca 0.08 0.70 0.16 0.00 -0.42 0.00 0.00 57.16 57.68 1xef n GLU 631 Cb 0.41 -5.54 0.56 0.00 -0.57 0.00 0.00 31.44 26.30 1xef n GLU 631 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xef h ALA 632 N 0.99 1.00 -0.01 0.62 0.00 -1.78 -3.19 119.26 116.89 1xef h ALA 632 Ca -0.51 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1xef h ALA 632 Cb 1.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1xef h ALA 632 CO 0.58 0.00 0.00 0.25 0.00 0.00 0.00 179.25 180.08 1xef n THR 633 N -3.10 0.06 0.18 0.00 -2.24 -1.26 -4.78 114.28 103.14 1xef n THR 633 Ca 0.01 -0.53 0.05 0.00 -2.27 0.00 0.00 64.05 61.31 1xef n THR 633 Cb 0.36 1.03 0.48 0.00 -2.10 0.00 0.00 70.33 70.10 1xef n THR 633 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1xef h SER 634 N 0.60 0.10 -0.49 3.42 4.64 -1.94 -1.35 113.55 118.54 1xef h SER 634 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1xef h SER 634 Cb 0.16 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1xef h SER 634 CO 0.00 0.23 0.00 0.00 -0.87 0.00 0.00 176.83 176.19 1xef n ALA 635 N -2.50 2.42 -2.19 5.18 0.00 -1.26 -4.92 120.51 117.23 1xef n ALA 635 Ca -0.02 -1.04 -0.39 0.00 0.00 0.00 0.00 53.44 51.99 1xef n ALA 635 Cb 0.22 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 18.69 1xef n ALA 635 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xef s LEU 636 N -1.32 4.54 0.85 0.00 1.02 -0.51 -4.79 118.68 118.48 1xef s LEU 636 Ca 0.41 1.39 -0.12 0.00 0.02 0.00 0.00 54.13 55.83 1xef s LEU 636 Cb 0.23 -3.04 0.11 0.00 0.02 0.00 0.00 46.19 43.51 1xef s LEU 636 CO 0.31 0.24 1.18 1.51 0.02 0.00 0.00 176.35 179.61 1xef s ASP 637 N -1.04 3.32 0.44 2.29 -4.77 -1.26 -4.70 116.67 110.95 1xef s ASP 637 Ca 0.32 2.28 0.12 0.00 -3.30 0.00 0.00 52.55 51.96 1xef s ASP 637 Cb -0.21 -2.58 1.03 0.00 -1.09 0.00 0.00 42.92 40.07 1xef s ASP 637 CO 0.21 -2.84 2.04 1.88 0.70 0.00 0.00 175.17 177.16 1xef h TYR 638 N -1.33 0.37 -0.08 2.11 0.05 -1.97 -0.80 116.97 115.32 1xef h TYR 638 Ca -0.45 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.32 1xef h TYR 638 Cb 1.28 -0.12 -0.00 0.00 1.01 0.00 0.00 36.73 38.90 1xef h TYR 638 CO 0.49 0.21 -0.02 1.49 -1.05 0.00 0.00 178.16 179.27 1xef h GLU 639 N 0.37 0.15 -0.83 4.88 4.81 -1.99 -0.67 114.58 121.31 1xef h GLU 639 Ca 0.18 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1xef h GLU 639 Cb 0.25 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 1xef h GLU 639 CO -0.04 0.49 0.49 0.77 -0.73 0.00 0.00 179.01 179.99 1xef h SER 640 N -0.20 1.00 -0.25 1.04 0.02 -1.75 -1.25 113.55 112.16 1xef h SER 640 Ca 0.02 -0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 60.81 1xef h SER 640 Cb 0.44 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 1xef h SER 640 CO 0.01 0.77 -0.21 -0.08 -1.14 0.00 0.00 176.83 176.18 1xef h GLU 641 N 1.15 0.58 -0.93 3.45 4.81 -1.17 -3.07 114.58 119.40 1xef h GLU 641 Ca 0.30 -0.29 0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1xef h GLU 641 Cb -0.03 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.30 1xef h GLU 641 CO -0.05 0.88 0.61 1.25 -0.73 0.00 0.00 179.01 180.96 1xef h HIS 642 N 0.29 1.15 -0.85 0.92 2.76 -0.82 -1.25 115.15 117.34 1xef h HIS 642 Ca 0.04 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.23 1xef h HIS 642 Cb 0.75 -0.39 -0.04 0.00 1.55 0.00 0.00 27.41 29.29 1xef h HIS 642 CO 0.07 0.70 0.48 0.28 -1.30 0.00 0.00 177.93 178.17 1xef h VAL 643 N 1.22 1.24 -0.30 5.26 2.07 -1.24 0.10 116.25 124.61 1xef h VAL 643 Ca 0.35 -0.58 -0.18 0.00 0.82 0.00 0.00 66.70 67.11 1xef h VAL 643 Cb -0.09 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1xef h VAL 643 CO -0.09 0.27 -0.53 0.40 0.02 0.00 0.00 177.57 177.64 1xef h ILE 644 N 1.18 1.27 0.00 4.57 2.04 -1.37 -2.53 117.51 122.68 1xef h ILE 644 Ca 0.30 -1.71 -0.10 0.00 1.00 0.00 0.00 64.86 64.35 1xef h ILE 644 Cb 0.00 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1xef h ILE 644 CO -0.05 0.56 -0.49 0.24 0.00 0.00 0.00 178.15 178.41 1xef h MET 645 N 0.68 0.00 0.00 2.37 2.86 -1.02 -2.37 114.93 117.45 1xef h MET 645 Ca 0.02 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 1xef h MET 645 Cb 1.13 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.79 1xef h MET 645 CO 0.12 0.49 -0.19 0.00 1.06 0.00 0.00 176.91 178.39 1xef h ARG 646 N 0.00 0.00 -0.01 1.72 3.08 -0.77 -3.07 114.38 115.33 1xef h ARG 646 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xef h ARG 646 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 1xef h ARG 646 CO 0.06 0.19 -0.11 0.09 -1.07 0.00 0.00 179.97 179.14 1xef n ASN 647 N -3.25 1.55 -0.19 7.04 3.02 -0.95 -4.45 115.26 118.02 1xef n ASN 647 Ca 0.01 -1.37 0.08 0.00 -0.03 0.00 0.00 54.58 53.27 1xef n ASN 647 Cb 0.48 0.07 0.37 0.00 -0.61 0.00 0.00 39.78 40.09 1xef n ASN 647 CO 0.00 0.00 0.00 -0.03 -2.62 0.00 0.00 177.26 174.61 1xef h MET 648 N 2.26 0.70 0.00 3.52 4.05 -1.34 -1.51 114.93 122.61 1xef h MET 648 Ca 0.00 -0.04 -0.03 0.00 -0.28 0.00 0.00 59.70 59.35 1xef h MET 648 Cb 0.57 -0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 31.21 1xef h MET 648 CO 0.00 0.46 -0.13 1.12 0.23 0.00 0.00 176.91 178.59 1xef h HIS 649 N 0.72 0.00 0.00 1.39 2.07 -1.82 -1.48 115.15 116.03 1xef h HIS 649 Ca 0.33 0.00 -0.24 0.00 -2.85 0.00 0.00 60.37 57.61 1xef h HIS 649 Cb 0.35 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.29 1xef h HIS 649 CO -0.00 0.13 -1.71 1.63 -3.07 0.00 0.00 177.93 174.91 1xef n LYS 650 N -3.68 0.64 -0.12 5.12 5.02 -0.65 -4.06 118.16 120.43 1xef n LYS 650 Ca -0.02 0.20 -0.11 0.00 -2.02 0.00 0.00 58.31 56.36 1xef n LYS 650 Cb 0.25 -1.75 0.01 0.00 -0.02 0.00 0.00 35.03 33.52 1xef n LYS 650 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1xef h ILE 651 N 0.00 1.27 -0.63 -0.18 2.04 -0.74 -3.26 117.51 116.01 1xef h ILE 651 Ca -0.27 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.12 1xef h ILE 651 Cb 1.84 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 39.19 1xef h ILE 651 CO 0.05 0.50 0.00 0.00 0.00 0.00 0.00 178.15 178.70 1xef s LYS 653 N -1.42 3.70 -0.17 0.00 1.02 -1.23 -2.35 119.74 119.28 1xef s LYS 653 Ca 0.45 1.72 0.00 0.00 0.02 0.00 0.00 55.97 58.16 1xef s LYS 653 Cb 0.26 -4.10 0.00 0.00 -0.52 0.00 0.00 37.83 33.47 1xef s LYS 653 CO 0.27 -1.42 0.00 0.41 -0.92 0.00 0.00 175.35 173.69 1xef n GLY 654 N 4.86 0.51 3.72 -3.33 0.00 -1.26 -5.03 105.19 104.66 1xef n GLY 654 Ca 0.20 -0.95 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 1xef n GLY 654 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1xef s ARG 655 N -2.02 1.73 -0.12 1.61 1.70 -0.99 -4.86 118.95 116.00 1xef s ARG 655 Ca 0.00 -1.18 -0.02 0.00 -0.47 0.00 0.00 55.73 54.06 1xef s ARG 655 Cb 0.00 0.54 -0.03 0.00 -0.57 0.00 0.00 34.95 34.89 1xef s ARG 655 CO 0.00 -0.76 -0.03 0.99 -1.08 0.00 0.00 175.30 174.42 1xef s THR 656 N -3.79 4.00 -0.16 4.99 2.01 -0.55 -2.60 115.64 119.54 1xef s THR 656 Ca 0.17 -0.34 -0.00 0.00 0.31 0.00 0.00 61.69 61.83 1xef s THR 656 Cb -0.03 -2.71 -0.00 0.00 0.01 0.00 0.00 72.50 69.76 1xef s THR 656 CO 0.09 0.54 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.73 1xef s VAL 657 N -0.20 2.77 -0.18 3.82 1.01 -0.83 -0.58 120.40 126.20 1xef s VAL 657 Ca 0.04 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 1xef s VAL 657 Cb -0.13 -2.18 -0.00 0.00 0.00 0.00 0.00 36.38 34.07 1xef s VAL 657 CO 0.02 0.50 -0.10 -0.63 0.00 0.00 0.00 175.10 174.89 1xef s ILE 658 N 0.89 2.97 -0.24 2.22 1.01 0.08 -0.31 121.20 127.81 1xef s ILE 658 Ca -0.04 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 59.99 1xef s ILE 658 Cb -0.15 -2.30 0.05 0.00 0.01 0.00 0.00 42.46 40.06 1xef s ILE 658 CO -0.01 0.48 -0.13 -0.63 0.00 0.00 0.00 174.94 174.65 1xef s ILE 659 N 1.11 2.19 -0.23 2.92 1.01 0.16 -0.13 121.20 128.23 1xef s ILE 659 Ca 0.01 -1.43 -0.17 0.00 0.00 0.00 0.00 60.65 59.06 1xef s ILE 659 Cb -0.14 -2.19 -0.03 0.00 0.01 0.00 0.00 42.46 40.10 1xef s ILE 659 CO -0.03 0.12 0.45 -0.63 0.00 0.00 0.00 174.94 174.86 1xef s ILE 660 N 1.16 5.14 -0.07 2.92 1.01 0.11 -0.31 121.20 131.17 1xef s ILE 660 Ca -0.05 0.78 -0.06 0.00 0.00 0.00 0.00 60.65 61.32 1xef s ILE 660 Cb -0.18 -3.77 0.02 0.00 0.01 0.00 0.00 42.46 38.54 1xef s ILE 660 CO -0.07 0.18 0.18 0.00 0.00 0.00 0.00 174.94 175.23 1xef s ALA 661 N 1.76 -0.43 -0.04 9.38 0.00 -1.12 -0.75 121.76 130.56 1xef s ALA 661 Ca 0.20 0.54 0.12 0.00 0.00 0.00 0.00 51.96 52.82 1xef s ALA 661 Cb -0.15 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 1xef s ALA 661 CO 0.09 -0.10 1.39 0.00 0.00 0.00 0.00 175.76 177.14 1xef h ALA 662 N 6.05 0.56 -1.94 0.00 0.00 -1.94 -3.43 119.26 118.56 1xef h ALA 662 Ca -0.27 -0.63 -0.60 0.00 0.00 0.00 0.00 54.91 53.41 1xef h ALA 662 Cb 1.19 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.77 1xef h ALA 662 CO 0.40 0.87 0.59 0.50 0.00 0.00 0.00 179.25 181.61 1xef s ARG 663 N -2.89 3.60 0.24 0.00 3.52 -1.26 -4.92 118.95 117.24 1xef s ARG 663 Ca 0.03 0.26 0.21 0.00 -0.13 0.00 0.00 55.73 56.10 1xef s ARG 663 Cb 0.09 -3.90 0.94 0.00 -1.56 0.00 0.00 34.95 30.52 1xef s ARG 663 CO 0.77 -1.17 1.64 1.28 -0.81 0.00 0.00 175.30 177.01 1xef n LEU 664 N 7.10 0.54 0.20 -0.88 4.32 -1.26 -2.19 117.00 124.82 1xef n LEU 664 Ca 0.06 0.67 0.10 0.00 -0.02 0.00 0.00 56.01 56.82 1xef n LEU 664 Cb 0.48 -0.63 0.13 0.00 -1.62 0.00 0.00 43.42 41.79 1xef n LEU 664 CO 0.63 -0.63 0.71 0.77 -1.22 0.00 0.00 177.39 177.65 1xef h SER 665 N 0.00 0.00 -0.52 -1.43 4.64 -1.97 -3.27 113.55 111.00 1xef h SER 665 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1xef h SER 665 Cb 0.24 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 1xef h SER 665 CO 0.00 0.12 0.23 0.74 -0.87 0.00 0.00 176.83 177.04 1xef h THR 666 N 0.00 1.20 -0.28 2.95 2.02 -1.86 -3.08 112.91 113.86 1xef h THR 666 Ca -0.00 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1xef h THR 666 Cb 1.09 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1xef h THR 666 CO 0.01 0.25 0.00 1.33 0.37 0.00 0.00 175.52 177.49 1xef n VAL 667 N -4.33 2.33 -0.29 3.16 0.24 -1.24 -4.68 118.33 113.51 1xef n VAL 667 Ca 0.05 -1.87 0.03 0.00 -2.04 0.00 0.00 64.34 60.50 1xef n VAL 667 Cb 0.16 -0.26 0.17 0.00 -1.47 0.00 0.00 33.84 32.44 1xef n VAL 667 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1xef h LYS 668 N 1.92 0.77 -0.64 7.34 3.64 -1.59 -2.55 116.57 125.46 1xef h LYS 668 Ca 0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1xef h LYS 668 Cb 1.49 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 1xef h LYS 668 CO 0.25 0.51 0.00 0.09 -2.27 0.00 0.00 179.45 178.03 1xef n ASN 669 N -4.74 4.46 -4.77 4.20 4.13 -1.26 -4.57 115.26 112.71 1xef n ASN 669 Ca 0.14 -2.45 -0.35 0.00 1.68 0.00 0.00 54.58 53.59 1xef n ASN 669 Cb 0.28 -0.56 0.01 0.00 -1.54 0.00 0.00 39.78 37.96 1xef n ASN 669 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1xef s ALA 670 N -1.91 2.66 0.23 5.41 0.00 -0.96 -4.95 121.76 122.23 1xef s ALA 670 Ca 0.47 0.86 -0.07 0.00 0.00 0.00 0.00 51.96 53.21 1xef s ALA 670 Cb 0.31 -3.38 0.20 0.00 0.00 0.00 0.00 23.12 20.24 1xef s ALA 670 CO 0.21 -0.87 1.84 -0.44 0.00 0.00 0.00 175.76 176.51 1xef h ASP 671 N 1.10 1.12 -3.77 0.00 3.32 -1.36 -3.44 116.42 113.38 1xef h ASP 671 Ca -0.50 -0.12 -0.19 0.00 0.02 0.00 0.00 57.03 56.25 1xef h ASP 671 Cb 1.27 -0.29 -0.27 0.00 0.22 0.00 0.00 39.33 40.27 1xef h ASP 671 CO 0.56 0.91 -0.51 -0.60 -1.72 0.00 0.00 179.24 177.89 1xef s ARG 672 N -5.78 0.20 -0.13 3.56 3.52 -1.19 -4.59 118.95 114.54 1xef s ARG 672 Ca -0.13 0.26 -0.01 0.00 -0.13 0.00 0.00 55.73 55.73 1xef s ARG 672 Cb 0.17 0.09 -0.02 0.00 -1.56 0.00 0.00 34.95 33.62 1xef s ARG 672 CO 0.83 -0.03 -0.11 0.42 -0.81 0.00 0.00 175.30 175.60 1xef s ILE 673 N 0.17 3.24 -0.13 4.11 1.01 -0.17 -1.50 121.20 127.93 1xef s ILE 673 Ca -0.01 -0.60 -0.04 0.00 0.00 0.00 0.00 60.65 60.01 1xef s ILE 673 Cb -0.02 -2.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 1xef s ILE 673 CO -0.00 0.53 -0.00 -0.63 0.00 0.00 0.00 174.94 174.83 1xef s ILE 674 N 0.23 4.25 -0.21 2.92 1.01 0.22 -1.93 121.20 127.70 1xef s ILE 674 Ca -0.07 -0.24 -0.03 0.00 0.00 0.00 0.00 60.65 60.31 1xef s ILE 674 Cb -0.15 -2.85 -0.00 0.00 0.01 0.00 0.00 42.46 39.47 1xef s ILE 674 CO 0.05 0.53 -0.08 -0.69 0.00 0.00 0.00 174.94 174.75 1xef s VAL 675 N -0.12 3.08 -0.00 2.92 1.01 0.10 -0.44 120.40 126.95 1xef s VAL 675 Ca 0.04 -0.60 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 1xef s VAL 675 Cb -0.13 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 1xef s VAL 675 CO 0.02 0.45 0.26 -0.04 0.00 0.00 0.00 175.10 175.80 1xef s MET 676 N 1.37 3.58 -0.20 2.72 -1.94 0.53 -1.26 119.30 124.10 1xef s MET 676 Ca 0.05 -0.07 -0.08 0.00 -1.71 0.00 0.00 55.69 53.88 1xef s MET 676 Cb -0.14 -3.09 0.09 0.00 2.01 0.00 0.00 34.83 33.70 1xef s MET 676 CO -0.05 0.66 0.44 -2.00 -0.01 0.00 0.00 175.02 174.06 1xef s GLU 677 N -1.69 0.35 -1.44 2.03 2.56 -0.28 -4.27 118.70 115.96 1xef s GLU 677 Ca 0.27 1.04 -0.01 0.00 0.00 0.00 0.00 54.97 56.26 1xef s GLU 677 Cb -0.13 0.33 0.00 0.00 2.00 0.00 0.00 34.13 36.33 1xef s GLU 677 CO 0.15 -0.24 0.31 1.63 -0.56 0.00 0.00 175.26 176.55 1xef n LYS 678 N 5.25 -2.46 -1.24 4.30 5.02 -1.25 -2.24 118.16 125.53 1xef n LYS 678 Ca -0.11 0.30 -0.06 0.00 -2.02 0.00 0.00 58.31 56.43 1xef n LYS 678 Cb 0.50 -4.19 -0.02 0.00 -0.02 0.00 0.00 35.03 31.30 1xef n LYS 678 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xef n GLY 679 N -2.16 0.80 3.06 0.72 0.00 -0.09 -4.83 105.19 102.69 1xef n GLY 679 Ca -0.31 -0.77 -0.19 0.00 0.00 0.00 0.00 46.02 44.75 1xef n GLY 679 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xef s LYS 680 N -2.64 0.82 -0.76 1.61 1.02 -0.95 -1.37 119.74 117.47 1xef s LYS 680 Ca 0.00 -0.44 -0.26 0.00 0.02 0.00 0.00 55.97 55.29 1xef s LYS 680 Cb 0.00 -0.79 0.02 0.00 -0.52 0.00 0.00 37.83 36.54 1xef s LYS 680 CO 0.00 0.21 1.48 0.42 -0.92 0.00 0.00 175.35 176.54 1xef s ILE 681 N -0.38 3.65 -0.03 2.17 1.01 -1.26 -1.12 121.20 125.23 1xef s ILE 681 Ca 0.03 0.15 -0.08 0.00 0.00 0.00 0.00 60.65 60.74 1xef s ILE 681 Cb -0.05 -4.66 -0.30 0.00 0.01 0.00 0.00 42.46 37.46 1xef s ILE 681 CO -0.00 -1.60 0.73 0.58 0.00 0.00 0.00 174.94 174.65 1xef h VAL 682 N 6.41 1.00 -3.91 2.92 2.07 -1.51 -3.48 116.25 119.76 1xef h VAL 682 Ca -0.18 -2.60 -0.30 0.00 0.82 0.00 0.00 66.70 64.43 1xef h VAL 682 Cb 1.07 2.76 -0.20 0.00 -1.52 0.00 0.00 31.29 33.40 1xef h VAL 682 CO 1.28 0.84 -0.74 -1.61 0.02 0.00 0.00 177.57 177.36 1xef s GLU 683 N -2.59 0.66 -0.28 1.57 2.02 -1.17 -5.02 118.70 113.88 1xef s GLU 683 Ca -0.14 -0.91 -0.15 0.00 0.02 0.00 0.00 54.97 53.79 1xef s GLU 683 Cb 0.06 -0.43 0.10 0.00 0.10 0.00 0.00 34.13 33.95 1xef s GLU 683 CO 0.85 0.08 0.71 -1.14 0.02 0.00 0.00 175.26 175.78 1xef s GLN 684 N -2.00 0.65 0.00 1.61 0.74 -1.26 -0.72 119.66 118.68 1xef s GLN 684 Ca -0.04 1.22 0.00 0.00 0.05 0.00 0.00 55.36 56.59 1xef s GLN 684 Cb -0.08 0.28 0.00 0.00 1.10 0.00 0.00 33.01 34.31 1xef s GLN 684 CO 0.00 -0.15 0.00 0.41 -0.55 0.00 0.00 175.29 175.00 1xef n GLY 685 N 4.49 -1.79 3.80 2.59 0.00 -0.81 -4.96 105.19 108.51 1xef n GLY 685 Ca -0.18 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.13 1xef n GLY 685 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xef s LYS 686 N -1.91 3.18 0.18 1.61 1.02 -1.26 -1.00 119.74 121.56 1xef s LYS 686 Ca 0.00 1.15 -0.21 0.00 0.02 0.00 0.00 55.97 56.93 1xef s LYS 686 Cb 0.00 -2.02 0.12 0.00 -0.52 0.00 0.00 37.83 35.41 1xef s LYS 686 CO 0.00 -0.92 1.59 1.25 -0.92 0.00 0.00 175.35 176.35 1xef h HIS 687 N 0.09 -0.89 -0.17 3.18 -0.00 -1.84 -1.25 115.15 114.27 1xef h HIS 687 Ca -0.46 0.07 -0.10 0.00 -0.00 0.00 0.00 60.37 59.88 1xef h HIS 687 Cb 1.22 0.47 -0.01 0.00 -0.00 0.00 0.00 27.41 29.09 1xef h HIS 687 CO 0.59 -0.38 -0.32 0.87 -0.00 0.00 0.00 177.93 178.69 1xef h LYS 688 N -0.17 0.34 -0.51 5.26 1.57 -1.93 -2.12 116.57 119.01 1xef h LYS 688 Ca 0.22 -0.14 -0.09 0.00 -1.87 0.00 0.00 60.65 58.77 1xef h LYS 688 Cb 0.54 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 1xef h LYS 688 CO -0.65 0.63 -0.05 0.93 -0.57 0.00 0.00 179.45 179.73 1xef h GLU 689 N 0.29 0.89 0.00 3.15 5.08 -1.63 -1.83 114.58 120.53 1xef h GLU 689 Ca 0.04 -0.28 -0.16 0.00 -1.00 0.00 0.00 59.36 57.95 1xef h GLU 689 Cb 0.72 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1xef h GLU 689 CO 0.05 0.92 -0.84 -0.07 -1.00 0.00 0.00 179.01 178.08 1xef h LEU 690 N 0.81 0.00 0.00 1.33 3.38 -1.23 -3.31 115.31 116.29 1xef h LEU 690 Ca 0.14 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 1xef h LEU 690 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1xef h LEU 690 CO 0.03 0.74 -0.53 0.25 0.09 0.00 0.00 178.44 179.02 1xef h LEU 691 N 0.00 0.00 -1.17 1.67 5.85 -1.27 -3.25 115.31 117.14 1xef h LEU 691 Ca -0.03 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 1xef h LEU 691 Cb 1.59 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.61 1xef h LEU 691 CO 0.09 0.36 -0.41 0.28 -0.34 0.00 0.00 178.44 178.42 1xef h SER 692 N 0.00 0.00 -2.74 1.25 0.02 -1.42 -3.41 113.55 107.25 1xef h SER 692 Ca -0.02 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.36 1xef h SER 692 Cb 1.30 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 1xef h SER 692 CO 0.04 0.41 1.13 -1.61 -1.14 0.00 0.00 176.83 175.67 1xef s GLU 693 N -4.07 3.81 0.27 3.45 0.41 -1.23 -4.90 118.70 116.45 1xef s GLU 693 Ca -0.02 1.71 0.26 0.00 -0.41 0.00 0.00 54.97 56.50 1xef s GLU 693 Cb 0.14 -4.04 0.78 0.00 -1.78 0.00 0.00 34.13 29.23 1xef s GLU 693 CO 0.73 -1.27 1.75 -1.00 -0.49 0.00 0.00 175.26 174.97 1xef h PRO 694 N 10.71 0.00 0.00 0.39 0.13 -1.89 -3.25 132.00 138.09 1xef h PRO 694 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1xef h PRO 694 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1xef h PRO 694 CO 1.00 0.00 -1.17 -0.85 -0.23 0.00 0.00 178.00 176.75 1xef n GLU 695 N -2.44 0.31 -1.45 0.86 0.28 -1.26 -4.85 120.64 112.08 1xef n GLU 695 Ca 0.05 -0.03 -0.34 0.00 -0.16 0.00 0.00 57.16 56.68 1xef n GLU 695 Cb 0.41 -1.57 0.09 0.00 1.43 0.00 0.00 31.44 31.80 1xef n GLU 695 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1xef s SER 696 N -3.92 4.34 0.29 -1.84 1.04 -1.23 -4.95 113.70 107.44 1xef s SER 696 Ca 0.02 2.23 0.07 0.00 0.48 0.00 0.00 55.95 58.76 1xef s SER 696 Cb 0.14 -2.58 0.44 0.00 0.10 0.00 0.00 66.02 64.13 1xef s SER 696 CO 0.83 -2.16 1.68 0.25 0.98 0.00 0.00 173.24 174.82 1xef h LEU 697 N -0.36 0.20 -0.27 2.42 5.85 -1.92 -3.01 115.31 118.22 1xef h LEU 697 Ca -0.47 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.17 1xef h LEU 697 Cb 1.28 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 1xef h LEU 697 CO 0.50 0.64 0.16 0.22 -0.34 0.00 0.00 178.44 179.62 1xef h TYR 698 N 0.16 0.30 -0.54 1.25 3.20 -1.92 -2.63 116.97 116.78 1xef h TYR 698 Ca 0.01 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 1xef h TYR 698 Cb 0.87 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.02 1xef h TYR 698 CO 0.01 0.18 0.06 0.77 -1.64 0.00 0.00 178.16 177.55 1xef h SER 699 N 0.33 0.89 -0.63 -2.11 0.02 -1.74 -1.37 113.55 108.94 1xef h SER 699 Ca 0.10 -0.27 0.06 0.00 -0.84 0.00 0.00 61.79 60.84 1xef h SER 699 Cb -0.01 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.24 1xef h SER 699 CO -0.04 0.94 0.33 0.22 -1.14 0.00 0.00 176.83 177.14 1xef h TYR 700 N 0.80 0.60 -0.14 3.45 3.20 -1.45 -0.34 116.97 123.10 1xef h TYR 700 Ca 0.16 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.89 1xef h TYR 700 Cb 0.45 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1xef h TYR 700 CO 0.03 0.27 -0.62 -0.07 -1.64 0.00 0.00 178.16 176.14 1xef h LEU 701 N 0.61 0.55 -0.69 2.82 3.38 -1.32 -2.97 115.31 117.68 1xef h LEU 701 Ca 0.29 -0.32 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 1xef h LEU 701 Cb 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1xef h LEU 701 CO -0.19 1.03 -0.36 0.22 0.09 0.00 0.00 178.44 179.23 1xef h TYR 702 N 0.36 0.70 -0.16 1.13 3.20 -0.83 -1.68 116.97 119.68 1xef h TYR 702 Ca -0.01 -0.19 -0.06 0.00 3.14 0.00 0.00 58.73 61.61 1xef h TYR 702 Cb 1.17 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 1xef h TYR 702 CO 0.04 0.88 -0.16 1.96 -1.64 0.00 0.00 178.16 179.24 1xef h GLN 703 N 0.50 0.26 0.00 1.82 1.08 -1.08 -0.55 115.11 117.15 1xef h GLN 703 Ca 0.05 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 1xef h GLN 703 Cb 0.86 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.25 1xef h GLN 703 CO 0.07 0.43 -0.11 -0.07 -0.95 0.00 0.00 178.83 178.20 1xef h LEU 704 N 0.25 0.00 0.18 1.46 3.38 -1.30 -3.25 115.31 116.03 1xef h LEU 704 Ca 0.05 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.77 1xef h LEU 704 Cb 0.44 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.21 1xef h LEU 704 CO 0.03 0.11 -1.13 -0.61 0.09 0.00 0.00 178.44 176.93 1xef h GLN 705 N 0.00 0.38 0.00 1.13 4.15 -0.30 -3.42 115.11 117.05 1xef h GLN 705 Ca -0.00 -0.65 0.00 0.00 0.77 0.00 0.00 58.65 58.77 1xef h GLN 705 Cb 0.74 0.24 0.00 0.00 0.21 0.00 0.00 27.48 28.67 1xef h GLN 705 CO 0.01 1.31 0.00 -1.13 -1.93 0.00 0.00 178.83 177.10 1xef n SER 706 N -3.95 0.00 0.00 -0.69 3.41 -0.33 -5.10 113.62 106.95 1xef n SER 706 Ca -0.16 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1xef n SER 706 Cb 0.94 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 1xef n SER 706 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35