#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 0.14 -0.04 0.53 1.01 -0.69 -0.27 121.20 121.87 1xef s ILE 468 Ca 0.00 0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.85 1xef s ILE 468 Cb 0.00 -0.41 0.01 0.00 0.01 0.00 0.00 42.46 42.07 1xef s ILE 468 CO 0.00 0.14 -0.09 -0.89 0.00 0.00 0.00 174.94 174.10 1xef s THR 469 N 2.06 0.85 -0.20 2.92 2.01 0.16 -0.72 115.64 122.73 1xef s THR 469 Ca 0.04 -0.35 -0.03 0.00 0.31 0.00 0.00 61.69 61.66 1xef s THR 469 Cb -0.13 -0.79 -0.01 0.00 0.01 0.00 0.00 72.50 71.59 1xef s THR 469 CO -0.05 0.28 -0.06 -0.36 -0.69 0.00 0.00 174.62 173.74 1xef s PHE 470 N 0.52 2.93 -0.18 4.92 0.08 0.87 -1.11 117.98 126.01 1xef s PHE 470 Ca -0.09 -0.93 -0.00 0.00 0.12 0.00 0.00 56.93 56.02 1xef s PHE 470 Cb -0.13 -2.05 0.00 0.00 -0.57 0.00 0.00 43.02 40.27 1xef s PHE 470 CO 0.02 -0.51 -0.14 1.03 -0.10 0.00 0.00 175.22 175.52 1xef s ARG 471 N 1.28 3.18 -1.65 0.44 0.52 -0.52 -1.60 118.95 120.61 1xef s ARG 471 Ca 0.03 -0.75 -0.13 0.00 -0.52 0.00 0.00 55.73 54.37 1xef s ARG 471 Cb -0.14 -2.69 0.11 0.00 0.52 0.00 0.00 34.95 32.75 1xef s ARG 471 CO -0.03 -0.10 0.56 0.09 0.02 0.00 0.00 175.30 175.84 1xef n ASN 472 N 4.40 -1.79 -4.66 0.23 3.02 -1.15 -1.27 115.26 114.04 1xef n ASN 472 Ca -0.19 -1.09 -0.43 0.00 -0.03 0.00 0.00 54.58 52.84 1xef n ASN 472 Cb 0.51 -2.47 -0.02 0.00 -0.61 0.00 0.00 39.78 37.19 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 -3.59 4.18 -0.14 2.41 -1.09 -0.97 -3.01 121.20 119.00 1xef s ILE 473 Ca 0.49 1.44 0.01 0.00 -2.23 0.00 0.00 60.65 60.37 1xef s ILE 473 Cb -0.27 -3.93 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 1xef s ILE 473 CO 0.95 -0.11 -0.18 -0.13 -1.23 0.00 0.00 174.94 174.23 1xef s ARG 474 N 3.41 3.15 -0.00 2.79 0.52 -0.49 -1.03 118.95 127.29 1xef s ARG 474 Ca 0.57 -0.79 0.01 0.00 -0.52 0.00 0.00 55.73 55.00 1xef s ARG 474 Cb -0.24 -2.53 -0.00 0.00 0.52 0.00 0.00 34.95 32.70 1xef s ARG 474 CO 0.17 0.04 -0.04 0.12 0.02 0.00 0.00 175.30 175.62 1xef s PHE 475 N 0.73 0.32 0.06 -0.53 5.36 -0.31 -1.48 117.98 122.14 1xef s PHE 475 Ca -0.08 -0.08 0.00 0.00 -0.96 0.00 0.00 56.93 55.82 1xef s PHE 475 Cb -0.16 -0.21 -0.04 0.00 -0.34 0.00 0.00 43.02 42.28 1xef s PHE 475 CO 0.01 -0.01 -0.05 -0.98 -1.46 0.00 0.00 175.22 172.73 1xef s ARG 476 N -0.14 0.66 -0.02 10.12 1.70 -1.26 -0.28 118.95 129.73 1xef s ARG 476 Ca 0.01 -1.18 -0.21 0.00 -0.47 0.00 0.00 55.73 53.87 1xef s ARG 476 Cb -0.02 0.02 -0.26 0.00 -0.57 0.00 0.00 34.95 34.12 1xef s ARG 476 CO -0.00 -0.06 1.01 1.88 -1.08 0.00 0.00 175.30 177.05 1xef h TYR 477 N 3.29 0.54 -2.61 5.89 0.05 -1.87 -3.47 116.97 118.79 1xef h TYR 477 Ca -0.34 -0.33 -0.54 0.00 0.05 0.00 0.00 58.73 57.56 1xef h TYR 477 Cb 1.16 -0.05 -0.15 0.00 1.01 0.00 0.00 36.73 38.70 1xef h TYR 477 CO 0.57 1.18 -0.76 0.15 -1.05 0.00 0.00 178.16 178.26 1xef s LYS 478 N -2.90 1.50 0.57 4.88 3.01 -1.26 -4.97 119.74 120.57 1xef s LYS 478 Ca -0.14 -1.66 0.35 0.00 -1.01 0.00 0.00 55.97 53.52 1xef s LYS 478 Cb 0.02 -1.49 1.92 0.00 -1.01 0.00 0.00 37.83 37.27 1xef s LYS 478 CO 0.81 0.27 2.07 -1.00 0.51 0.00 0.00 175.35 178.02 1xef h PRO 479 N 2.51 0.00 0.03 -1.68 0.13 -2.00 -0.70 132.00 130.28 1xef h PRO 479 Ca -0.40 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.44 1xef h PRO 479 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 1xef h PRO 479 CO 0.59 0.00 -1.66 0.22 -0.23 0.00 0.00 178.00 176.93 1xef h ASP 480 N 0.00 0.09 -4.05 1.44 3.58 -2.00 -3.48 116.42 112.00 1xef h ASP 480 Ca 0.00 -0.17 -0.54 0.00 0.42 0.00 0.00 57.03 56.74 1xef h ASP 480 Cb 0.16 -0.03 0.12 0.00 1.72 0.00 0.00 39.33 41.30 1xef h ASP 480 CO 0.00 1.15 0.55 -0.55 -2.88 0.00 0.00 179.24 177.51 1xef s SER 481 N -6.35 5.39 0.80 2.28 0.15 -0.27 -5.03 113.70 110.67 1xef s SER 481 Ca -0.07 2.57 -0.11 0.00 0.70 0.00 0.00 55.95 59.05 1xef s SER 481 Cb 0.08 -2.62 0.07 0.00 -1.71 0.00 0.00 66.02 61.84 1xef s SER 481 CO 0.82 -1.47 1.09 -2.84 1.20 0.00 0.00 173.24 172.04 1xef s PRO 482 N -2.99 2.06 -0.02 5.44 0.02 -1.26 -4.74 135.00 133.52 1xef s PRO 482 Ca 0.72 1.09 -0.30 0.00 0.02 0.00 0.00 61.00 62.53 1xef s PRO 482 Cb -0.35 -1.88 -0.06 0.00 0.02 0.00 0.00 34.50 32.22 1xef s PRO 482 CO 0.41 -1.76 1.69 0.08 -0.33 0.00 0.00 177.00 177.10 1xef s VAL 483 N -2.91 3.41 -0.05 3.83 1.01 -1.26 -4.51 120.40 119.92 1xef s VAL 483 Ca 0.62 0.58 -0.03 0.00 0.00 0.00 0.00 61.98 63.15 1xef s VAL 483 Cb -0.17 -3.37 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 1xef s VAL 483 CO 0.56 -0.04 -0.05 0.40 0.00 0.00 0.00 175.10 175.97 1xef h ILE 484 N 5.43 0.00 -3.26 2.22 1.08 -1.02 -3.47 117.51 118.49 1xef h ILE 484 Ca -0.41 -0.37 -0.60 0.00 -0.39 0.00 0.00 64.86 63.10 1xef h ILE 484 Cb 1.19 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.83 1xef h ILE 484 CO 0.95 0.00 -0.40 -0.76 -0.69 0.00 0.00 178.15 177.25 1xef s LEU 485 N -5.83 4.23 -0.10 1.44 1.43 -1.00 -4.07 118.68 114.78 1xef s LEU 485 Ca -0.04 0.39 0.02 0.00 -1.03 0.00 0.00 54.13 53.46 1xef s LEU 485 Cb 0.01 -2.24 0.01 0.00 0.03 0.00 0.00 46.19 44.00 1xef s LEU 485 CO 0.07 0.14 -0.15 -0.62 0.23 0.00 0.00 176.35 176.03 1xef s ASP 486 N 0.37 2.28 -1.40 2.29 -1.08 -0.86 -1.16 116.67 117.11 1xef s ASP 486 Ca 0.13 -0.39 -0.12 0.00 -0.52 0.00 0.00 52.55 51.64 1xef s ASP 486 Cb -0.12 -1.02 0.01 0.00 -1.46 0.00 0.00 42.92 40.33 1xef s ASP 486 CO 0.01 0.02 0.33 -3.20 0.52 0.00 0.00 175.17 172.85 1xef n ASN 487 N 4.09 -1.23 -4.72 -0.34 4.05 -0.20 -4.74 115.26 112.17 1xef n ASN 487 Ca -0.20 -1.23 -0.38 0.00 0.45 0.00 0.00 54.58 53.22 1xef n ASN 487 Cb 0.51 -1.95 -0.06 0.00 1.23 0.00 0.00 39.78 39.51 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 -4.00 5.19 -0.12 -1.44 -5.25 -1.00 -4.78 121.20 109.80 1xef s ILE 488 Ca 0.19 0.95 0.01 0.00 -0.99 0.00 0.00 60.65 60.81 1xef s ILE 488 Cb -0.10 -3.82 0.02 0.00 2.95 0.00 0.00 42.46 41.51 1xef s ILE 488 CO 0.97 0.32 -0.13 0.20 -1.79 0.00 0.00 174.94 174.50 1xef s ASN 489 N 0.66 2.45 -0.15 4.36 0.01 -1.26 -2.28 114.94 118.73 1xef s ASN 489 Ca 0.26 -0.42 -0.10 0.00 -0.71 0.00 0.00 52.86 51.89 1xef s ASN 489 Cb -0.15 -1.07 0.05 0.00 0.41 0.00 0.00 41.25 40.49 1xef s ASN 489 CO 0.10 -0.03 0.37 -0.22 -1.51 0.00 0.00 177.10 175.80 1xef s LEU 490 N 1.29 0.26 -0.09 0.60 2.96 -0.63 -4.97 118.68 118.11 1xef s LEU 490 Ca -0.01 0.77 0.02 0.00 -0.22 0.00 0.00 54.13 54.69 1xef s LEU 490 Cb -0.14 1.21 0.02 0.00 0.50 0.00 0.00 46.19 47.78 1xef s LEU 490 CO -0.06 -0.16 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.24 1xef s SER 491 N 0.91 2.05 -0.22 3.68 0.01 -1.26 -0.09 113.70 118.77 1xef s SER 491 Ca -0.06 -0.34 0.01 0.00 1.31 0.00 0.00 55.95 56.88 1xef s SER 491 Cb -0.06 -0.91 0.05 0.00 0.21 0.00 0.00 66.02 65.31 1xef s SER 491 CO -0.07 0.00 -0.09 -0.63 0.41 0.00 0.00 173.24 172.86 1xef s ILE 492 N 0.94 1.73 0.62 1.44 1.01 0.11 -5.02 121.20 122.02 1xef s ILE 492 Ca -0.09 -1.20 -0.14 0.00 0.00 0.00 0.00 60.65 59.23 1xef s ILE 492 Cb -0.15 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 1xef s ILE 492 CO 0.00 0.06 1.04 -1.59 0.00 0.00 0.00 174.94 174.45 1xef s LYS 493 N 1.33 3.35 0.26 2.79 -2.85 -1.26 -1.71 119.74 121.65 1xef s LYS 493 Ca -0.04 1.01 -0.31 0.00 -1.00 0.00 0.00 55.97 55.63 1xef s LYS 493 Cb -0.18 -2.04 -0.13 0.00 -2.06 0.00 0.00 37.83 33.42 1xef s LYS 493 CO -0.07 -0.77 1.52 0.94 0.10 0.00 0.00 175.35 177.06 1xef n GLN 494 N -2.43 2.38 0.00 1.78 -0.06 -1.26 -3.05 117.38 114.75 1xef n GLN 494 Ca 0.08 0.85 0.00 0.00 -2.00 0.00 0.00 57.00 55.92 1xef n GLN 494 Cb 0.53 -2.58 0.00 0.00 -4.06 0.00 0.00 30.24 24.14 1xef n GLN 494 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1xef n GLY 495 N 2.33 0.83 3.86 1.69 0.00 -1.16 -4.98 105.19 107.76 1xef n GLY 495 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.75 3.76 -0.25 1.61 2.02 -1.17 -4.81 118.70 119.12 1xef s GLU 496 Ca 0.00 0.76 -0.03 0.00 0.02 0.00 0.00 54.97 55.72 1xef s GLU 496 Cb 0.00 -2.16 0.01 0.00 0.10 0.00 0.00 34.13 32.08 1xef s GLU 496 CO 0.00 -0.35 -0.04 0.08 0.02 0.00 0.00 175.26 174.97 1xef s VAL 497 N -2.82 3.17 -0.15 2.63 1.01 -1.26 -1.83 120.40 121.16 1xef s VAL 497 Ca 0.56 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 1xef s VAL 497 Cb -0.10 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 1xef s VAL 497 CO 0.41 0.24 -0.14 -0.63 0.00 0.00 0.00 175.10 174.98 1xef s ILE 498 N 1.39 2.81 -0.04 2.22 -1.09 0.06 -0.97 121.20 125.59 1xef s ILE 498 Ca 0.02 -0.73 -0.13 0.00 -2.23 0.00 0.00 60.65 57.58 1xef s ILE 498 Cb -0.16 -2.19 -0.05 0.00 -1.58 0.00 0.00 42.46 38.48 1xef s ILE 498 CO -0.03 0.51 0.35 -0.83 -1.23 0.00 0.00 174.94 173.72 1xef s GLY 499 N 0.69 2.40 -0.16 6.18 0.00 -0.26 -0.26 107.32 115.91 1xef s GLY 499 Ca -0.07 -0.31 0.01 0.00 0.00 0.00 0.00 44.72 44.35 1xef s GLY 499 CO 0.02 0.09 -0.19 -0.42 0.00 0.00 0.00 173.10 172.60 1xef s ILE 500 N -0.90 1.93 0.23 0.90 1.01 0.55 0.35 121.20 125.28 1xef s ILE 500 Ca 0.22 -0.87 0.07 0.00 0.00 0.00 0.00 60.65 60.06 1xef s ILE 500 Cb -0.16 -1.75 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 1xef s ILE 500 CO 0.11 0.52 -0.10 0.68 0.00 0.00 0.00 174.94 176.15 1xef s VAL 501 N 1.19 1.60 0.00 2.92 -7.23 0.46 -3.02 120.40 116.32 1xef s VAL 501 Ca 0.01 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.03 1xef s VAL 501 Cb -0.14 -2.20 0.00 0.00 0.56 0.00 0.00 36.38 34.60 1xef s VAL 501 CO -0.09 -0.48 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 1xef n GLY 502 N -0.44 2.79 3.72 2.32 0.00 -1.26 0.16 105.19 112.48 1xef n GLY 502 Ca -0.07 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.51 1xef n GLY 502 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xef s ARG 503 N -2.07 2.28 -0.06 1.61 0.52 -1.26 -4.89 118.95 115.08 1xef s ARG 503 Ca 0.00 1.99 -0.36 0.00 -0.52 0.00 0.00 55.73 56.84 1xef s ARG 503 Cb 0.00 -1.82 -0.13 0.00 0.52 0.00 0.00 34.95 33.51 1xef s ARG 503 CO 0.00 -1.78 1.73 0.45 0.02 0.00 0.00 175.30 175.72 1xef n SER 504 N -2.30 2.97 0.00 0.23 2.88 -1.26 -1.61 113.62 114.52 1xef n SER 504 Ca 0.15 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 1xef n SER 504 Cb 0.49 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 62.63 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 3.96 0.81 0.14 0.46 0.00 -1.26 -4.98 105.19 104.32 1xef n GLY 505 Ca 0.22 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.32 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 -1.65 -3.45 113.55 114.71 1xef h SER 506 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 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 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1xef n GLY 507 N 1.24 1.75 0.16 -0.77 0.00 -1.26 -0.48 105.19 105.83 1xef n GLY 507 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 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 0.01 -0.31 -0.81 1.61 1.57 -1.91 -2.46 116.57 114.27 1xef h LYS 508 Ca 0.00 0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 1xef h LYS 508 Cb 0.00 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 1xef h LYS 508 CO 0.00 0.03 0.36 0.77 -0.57 0.00 0.00 179.45 180.04 1xef h SER 509 N -0.70 1.09 -0.58 0.86 0.02 -2.00 -2.96 113.55 109.29 1xef h SER 509 Ca -0.03 -0.15 0.04 0.00 -0.84 0.00 0.00 61.79 60.80 1xef h SER 509 Cb 0.48 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.70 1xef h SER 509 CO 0.05 0.94 0.33 0.74 -1.14 0.00 0.00 176.83 177.75 1xef h THR 510 N 1.17 1.01 -0.75 -2.27 2.02 -1.99 -0.96 112.91 111.14 1xef h THR 510 Ca 0.28 -0.22 0.09 0.00 0.77 0.00 0.00 66.41 67.32 1xef h THR 510 Cb 0.16 0.32 -0.07 0.00 -1.74 0.00 0.00 68.15 66.82 1xef h THR 510 CO -0.03 0.12 0.41 0.25 0.37 0.00 0.00 175.52 176.63 1xef h LEU 511 N 0.64 0.57 -0.55 2.58 5.85 -1.27 -1.83 115.31 121.29 1xef h LEU 511 Ca 0.25 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 1xef h LEU 511 Cb 0.09 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1xef h LEU 511 CO -0.13 0.33 -0.09 0.71 -0.34 0.00 0.00 178.44 178.92 1xef h THR 512 N 0.70 0.18 -0.04 1.05 1.35 -1.31 -3.11 112.91 111.72 1xef h THR 512 Ca 0.36 -1.03 -0.10 0.00 -0.55 0.00 0.00 66.41 65.09 1xef h THR 512 Cb 0.33 1.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.62 1xef h THR 512 CO -0.24 0.09 -0.43 0.11 -0.25 0.00 0.00 175.52 174.79 1xef h LYS 513 N 0.00 0.09 0.00 4.72 1.57 -0.32 -2.97 116.57 119.66 1xef h LYS 513 Ca -0.00 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1xef h LYS 513 Cb 0.88 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.18 1xef h LYS 513 CO 0.01 0.51 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.25 1xef h LEU 514 N 0.08 0.00 -0.20 2.94 3.38 -1.44 -2.41 115.31 117.66 1xef h LEU 514 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xef h LEU 514 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1xef h LEU 514 CO 0.06 0.09 0.00 -0.38 0.09 0.00 0.00 178.44 178.30 1xef n ILE 515 N -3.15 0.60 0.51 1.22 5.41 -1.12 -2.76 119.36 120.07 1xef n ILE 515 Ca 0.02 -0.01 0.06 0.00 1.00 0.00 0.00 62.75 63.81 1xef n ILE 515 Cb 0.47 -0.79 -0.00 0.00 -0.71 0.00 0.00 39.64 38.61 1xef n ILE 515 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xef n GLN 516 N -2.01 2.01 -3.83 0.38 6.02 -1.06 -4.94 117.38 113.94 1xef n GLN 516 Ca 0.05 -0.64 -0.24 0.00 -0.01 0.00 0.00 57.00 56.16 1xef n GLN 516 Cb 0.32 -1.13 0.00 0.00 1.02 0.00 0.00 30.24 30.46 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 -0.25 -3.72 0.14 -1.09 0.63 -0.94 -4.88 116.66 106.55 1xef n ARG 517 Ca 0.05 0.49 0.00 0.00 -0.92 0.00 0.00 57.85 57.47 1xef n ARG 517 Cb 0.24 -4.74 0.18 0.00 0.45 0.00 0.00 32.46 28.59 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 -1.85 0.00 -4.18 -0.14 0.04 -1.78 -3.46 116.94 105.57 1xef h PHE 518 Ca -0.63 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.01 1xef h PHE 518 Cb 1.37 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 39.37 1xef h PHE 518 CO 0.47 0.59 -0.68 0.71 -0.60 0.00 0.00 178.31 178.79 1xef s TYR 519 N -3.51 0.56 -0.03 -0.55 1.51 -1.26 -5.10 117.35 108.98 1xef s TYR 519 Ca -0.01 -1.03 0.07 0.00 -1.01 0.00 0.00 57.07 55.09 1xef s TYR 519 Cb 0.12 -0.40 -0.02 0.00 -0.11 0.00 0.00 41.96 41.55 1xef s TYR 519 CO 0.75 -0.34 -0.23 0.96 -1.11 0.00 0.00 175.55 175.57 1xef s ILE 520 N -3.81 1.84 1.10 2.71 -5.25 -1.26 -4.72 121.20 111.81 1xef s ILE 520 Ca 0.07 -0.98 -0.15 0.00 -0.99 0.00 0.00 60.65 58.60 1xef s ILE 520 Cb 0.07 -1.54 0.24 0.00 2.95 0.00 0.00 42.46 44.18 1xef s ILE 520 CO -0.09 0.52 1.08 -2.16 -1.79 0.00 0.00 174.94 172.50 1xef s PRO 521 N -0.42 -0.38 -0.09 0.37 0.04 -1.26 -4.86 135.00 128.40 1xef s PRO 521 Ca 0.05 0.35 0.15 0.00 0.04 0.00 0.00 61.00 61.60 1xef s PRO 521 Cb -0.10 -1.66 -0.22 0.00 0.04 0.00 0.00 34.50 32.56 1xef s PRO 521 CO 0.00 -3.24 0.20 -0.85 0.04 0.00 0.00 177.00 173.16 1xef n GLU 522 N -4.50 1.02 -4.03 4.56 0.28 -0.55 -4.98 120.64 112.44 1xef n GLU 522 Ca 0.07 -0.08 -0.11 0.00 -0.16 0.00 0.00 57.16 56.88 1xef n GLU 522 Cb 0.58 -1.39 -0.11 0.00 1.43 0.00 0.00 31.44 31.95 1xef n GLU 522 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1xef s ASN 523 N -4.38 0.60 0.00 -1.84 3.04 -1.21 -5.00 114.94 106.15 1xef s ASN 523 Ca -0.07 -0.54 0.00 0.00 0.04 0.00 0.00 52.86 52.29 1xef s ASN 523 Cb 0.07 0.06 0.00 0.00 -1.54 0.00 0.00 41.25 39.85 1xef s ASN 523 CO 0.65 -0.25 0.00 0.61 -3.04 0.00 0.00 177.10 175.07 1xef n GLY 524 N 1.49 -0.33 3.12 1.21 0.00 -1.16 -1.40 105.19 108.12 1xef n GLY 524 Ca -0.23 -1.79 -0.16 0.00 0.00 0.00 0.00 46.02 43.84 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 -1.57 0.70 -0.16 1.61 1.11 -0.39 -4.89 119.66 116.06 1xef s GLN 525 Ca 0.00 -0.86 -0.01 0.00 0.01 0.00 0.00 55.36 54.50 1xef s GLN 525 Cb 0.00 -0.61 -0.01 0.00 -1.01 0.00 0.00 33.01 31.39 1xef s GLN 525 CO 0.00 0.13 -0.12 0.08 0.01 0.00 0.00 175.29 175.39 1xef s VAL 526 N -1.29 2.91 -0.03 1.09 1.01 -1.26 -1.43 120.40 121.40 1xef s VAL 526 Ca -0.05 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.31 1xef s VAL 526 Cb -0.10 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 1xef s VAL 526 CO 0.01 0.50 -0.21 -0.76 0.00 0.00 0.00 175.10 174.64 1xef s LEU 527 N 0.85 2.01 -0.18 3.92 1.02 -0.27 -1.45 118.68 124.59 1xef s LEU 527 Ca -0.04 -0.41 0.01 0.00 0.02 0.00 0.00 54.13 53.71 1xef s LEU 527 Cb -0.15 -1.14 0.03 0.00 0.02 0.00 0.00 46.19 44.95 1xef s LEU 527 CO -0.00 0.23 -0.14 -0.63 0.02 0.00 0.00 176.35 175.83 1xef s ILE 528 N -0.28 1.71 -1.89 -0.59 1.01 -0.47 -0.66 121.20 120.03 1xef s ILE 528 Ca 0.02 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 59.81 1xef s ILE 528 Cb -0.10 -1.66 0.00 0.00 0.01 0.00 0.00 42.46 40.70 1xef s ILE 528 CO 0.01 0.35 0.00 -0.67 0.00 0.00 0.00 174.94 174.63 1xef n ASP 529 N 4.70 -5.74 0.00 3.58 4.64 0.63 -1.61 116.55 122.75 1xef n ASP 529 Ca -0.17 0.14 0.00 0.00 -1.38 0.00 0.00 54.79 53.38 1xef n ASP 529 Cb 0.48 -4.86 0.00 0.00 -1.04 0.00 0.00 41.12 35.70 1xef n ASP 529 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1xef n GLY 530 N -0.83 0.74 3.58 0.27 0.00 -1.26 -5.02 105.19 102.66 1xef n GLY 530 Ca -0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.92 3.23 0.13 1.61 3.76 -0.63 -5.04 115.29 115.42 1xef s HIS 531 Ca 0.00 0.10 -0.31 0.00 -0.15 0.00 0.00 55.06 54.70 1xef s HIS 531 Cb 0.00 -2.46 -0.09 0.00 1.11 0.00 0.00 32.58 31.14 1xef s HIS 531 CO 0.00 -0.24 1.48 0.34 -0.85 0.00 0.00 174.74 175.48 1xef s ASP 532 N 1.73 6.70 0.19 1.40 -1.08 -1.26 -1.36 116.67 122.99 1xef s ASP 532 Ca 0.09 2.46 0.19 0.00 -0.52 0.00 0.00 52.55 54.78 1xef s ASP 532 Cb -0.16 -2.59 0.86 0.00 -1.46 0.00 0.00 42.92 39.57 1xef s ASP 532 CO 0.11 -0.74 1.60 0.18 0.52 0.00 0.00 175.17 176.83 1xef n LEU 533 N 4.04 0.45 0.08 -1.34 4.77 -0.53 -1.33 117.00 123.14 1xef n LEU 533 Ca 0.13 0.63 0.10 0.00 -0.03 0.00 0.00 56.01 56.84 1xef n LEU 533 Cb 0.40 -0.59 0.43 0.00 -2.33 0.00 0.00 43.42 41.33 1xef n LEU 533 CO 0.60 -0.55 0.81 0.00 -1.33 0.00 0.00 177.39 176.92 1xef n ALA 534 N -1.69 1.67 0.04 -1.18 0.00 -1.26 -2.93 120.51 115.16 1xef n ALA 534 Ca 0.02 0.03 0.01 0.00 0.00 0.00 0.00 53.44 53.50 1xef n ALA 534 Cb 0.17 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.29 1xef n ALA 534 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xef n LEU 535 N -1.97 1.23 -4.78 0.00 4.77 -0.44 -5.07 117.00 110.73 1xef n LEU 535 Ca 0.03 -1.14 -0.37 0.00 -0.03 0.00 0.00 56.01 54.50 1xef n LEU 535 Cb 0.21 -0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1xef n LEU 535 CO 0.18 0.30 0.71 0.00 -1.33 0.00 0.00 177.39 177.24 1xef s ALA 536 N -0.21 3.15 -0.12 -1.18 0.00 -1.15 -5.01 121.76 117.23 1xef s ALA 536 Ca 0.01 0.64 -0.29 0.00 0.00 0.00 0.00 51.96 52.32 1xef s ALA 536 Cb 0.01 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 1xef s ALA 536 CO 0.01 -0.07 1.38 0.34 0.00 0.00 0.00 175.76 177.43 1xef s ASP 537 N -1.57 6.87 0.48 0.00 -1.08 -1.26 -4.93 116.67 115.18 1xef s ASP 537 Ca 0.55 1.87 0.15 0.00 -0.52 0.00 0.00 52.55 54.60 1xef s ASP 537 Cb -0.21 -2.54 1.14 0.00 -1.46 0.00 0.00 42.92 39.86 1xef s ASP 537 CO 0.26 -0.80 2.07 -0.65 0.52 0.00 0.00 175.17 176.58 1xef h PRO 538 N 8.53 0.21 -0.38 4.34 0.11 -1.97 -1.11 132.00 141.72 1xef h PRO 538 Ca -0.31 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.70 1xef h PRO 538 Cb 1.13 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1xef h PRO 538 CO 0.96 0.14 -0.10 -0.91 -0.21 0.00 0.00 178.00 177.88 1xef h ASN 539 N 0.21 0.75 -0.19 -2.05 -0.26 -2.01 -2.93 115.58 109.11 1xef h ASN 539 Ca 0.13 -0.36 -0.00 0.00 -0.56 0.00 0.00 56.30 55.50 1xef h ASN 539 Cb 0.25 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.29 1xef h ASN 539 CO -0.02 0.94 0.11 -0.25 -1.06 0.00 0.00 177.43 177.15 1xef h TRP 540 N 0.55 0.25 -0.61 1.19 7.01 -1.71 -3.11 115.95 119.52 1xef h TRP 540 Ca 0.10 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.04 1xef h TRP 540 Cb 0.61 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.57 1xef h TRP 540 CO 0.05 0.21 0.15 1.25 -2.79 0.00 0.00 178.44 177.31 1xef h LEU 541 N 0.22 0.88 -0.93 0.65 5.85 -1.26 -1.93 115.31 118.79 1xef h LEU 541 Ca 0.07 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 1xef h LEU 541 Cb 0.04 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1xef h LEU 541 CO -0.01 0.86 0.13 0.03 -0.34 0.00 0.00 178.44 179.11 1xef h ARG 542 N 0.90 0.91 0.00 1.25 3.08 -1.53 -0.25 114.38 118.75 1xef h ARG 542 Ca 0.19 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1xef h ARG 542 Cb 0.32 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1xef h ARG 542 CO -0.00 0.82 -0.27 0.00 -1.07 0.00 0.00 179.97 179.45 1xef h ARG 543 N 0.87 0.00 0.21 0.04 3.08 -1.41 -3.25 114.38 113.93 1xef h ARG 543 Ca 0.19 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.92 1xef h ARG 543 Cb 0.33 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.41 1xef h ARG 543 CO 0.00 0.27 -1.43 1.96 -1.07 0.00 0.00 179.97 179.70 1xef h GLN 544 N 0.00 0.45 -4.95 0.04 1.08 -0.53 -3.38 115.11 107.81 1xef h GLN 544 Ca -0.00 -0.76 -0.67 0.00 -1.45 0.00 0.00 58.65 55.76 1xef h GLN 544 Cb 0.72 0.28 -0.31 0.00 -0.05 0.00 0.00 27.48 28.12 1xef h GLN 544 CO 0.04 1.36 -0.75 0.08 -0.95 0.00 0.00 178.83 178.60 1xef s VAL 545 N -2.62 2.90 -0.13 -0.54 1.01 -0.19 -0.79 120.40 120.05 1xef s VAL 545 Ca -0.08 -0.87 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 1xef s VAL 545 Cb 0.05 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 1xef s VAL 545 CO 0.92 0.30 -0.13 -0.83 0.00 0.00 0.00 175.10 175.36 1xef s GLY 546 N 1.36 1.54 -0.11 4.51 0.00 -0.60 -4.74 107.32 109.28 1xef s GLY 546 Ca 0.02 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 43.87 1xef s GLY 546 CO -0.05 -0.17 -0.19 0.14 0.00 0.00 0.00 173.10 172.83 1xef s VAL 547 N 0.39 2.51 -0.24 1.40 1.01 -1.26 -0.90 120.40 123.31 1xef s VAL 547 Ca -0.10 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 60.95 1xef s VAL 547 Cb -0.16 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 1xef s VAL 547 CO 0.05 0.54 0.05 -0.69 0.00 0.00 0.00 175.10 175.06 1xef s VAL 548 N 0.34 4.21 0.71 2.92 1.01 0.35 -4.98 120.40 124.95 1xef s VAL 548 Ca -0.15 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.64 1xef s VAL 548 Cb -0.17 -2.95 0.14 0.00 0.00 0.00 0.00 36.38 33.39 1xef s VAL 548 CO 0.08 0.36 0.97 0.18 0.00 0.00 0.00 175.10 176.69 1xef n LEU 549 N 4.76 0.00 0.23 3.92 4.77 -1.26 -1.24 117.00 128.18 1xef n LEU 549 Ca -0.16 -2.28 -0.15 0.00 -0.03 0.00 0.00 56.01 53.39 1xef n LEU 549 Cb 0.51 -0.60 -0.08 0.00 -2.33 0.00 0.00 43.42 40.92 1xef n LEU 549 CO 0.31 -0.92 0.73 -0.61 -1.33 0.00 0.00 177.39 175.57 1xef h GLN 550 N 0.00 -0.52 -5.79 3.23 4.15 -1.70 -3.40 115.11 111.08 1xef h GLN 550 Ca -0.32 0.04 -0.67 0.00 0.77 0.00 0.00 58.65 58.47 1xef h GLN 550 Cb 1.26 0.12 -0.16 0.00 0.21 0.00 0.00 27.48 28.91 1xef h GLN 550 CO 0.37 -0.35 -0.63 0.34 -1.93 0.00 0.00 178.83 176.64 1xef s ASP 551 N -4.72 5.18 -0.01 -0.69 3.68 -1.26 -4.91 116.67 113.94 1xef s ASP 551 Ca -0.16 0.09 0.01 0.00 2.13 0.00 0.00 52.55 54.62 1xef s ASP 551 Cb 0.05 -1.57 0.01 0.00 -1.45 0.00 0.00 42.92 39.96 1xef s ASP 551 CO 0.64 0.32 -0.03 0.20 0.13 0.00 0.00 175.17 176.43 1xef s ASN 552 N -0.54 0.48 -0.11 -0.34 -0.87 -1.26 -5.14 114.94 107.16 1xef s ASN 552 Ca 0.09 -0.06 -0.19 0.00 -1.57 0.00 0.00 52.86 51.13 1xef s ASN 552 Cb -0.12 -0.14 -0.04 0.00 -0.02 0.00 0.00 41.25 40.93 1xef s ASN 552 CO 0.02 -0.01 0.50 0.68 -2.57 0.00 0.00 177.10 175.72 1xef s VAL 553 N 0.34 5.17 0.17 1.60 -7.23 -1.26 -4.95 120.40 114.24 1xef s VAL 553 Ca -0.03 1.00 0.00 0.00 -1.81 0.00 0.00 61.98 61.14 1xef s VAL 553 Cb -0.06 -3.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.00 1xef s VAL 553 CO -0.01 0.32 0.34 -0.76 -0.31 0.00 0.00 175.10 174.69 1xef s LEU 554 N 0.61 4.28 0.32 1.32 1.43 -1.26 -5.08 118.68 120.29 1xef s LEU 554 Ca 0.27 0.31 -0.15 0.00 -1.03 0.00 0.00 54.13 53.53 1xef s LEU 554 Cb -0.15 -3.06 -0.09 0.00 0.03 0.00 0.00 46.19 42.92 1xef s LEU 554 CO 0.11 0.01 0.74 -0.76 0.23 0.00 0.00 176.35 176.68 1xef s LEU 555 N -3.22 4.07 -1.09 1.79 1.43 -1.26 -4.10 118.68 116.30 1xef s LEU 555 Ca 0.37 1.30 -0.20 0.00 -1.03 0.00 0.00 54.13 54.57 1xef s LEU 555 Cb -0.11 -4.07 -0.07 0.00 0.03 0.00 0.00 46.19 41.97 1xef s LEU 555 CO 0.29 -0.20 1.97 -3.20 0.23 0.00 0.00 176.35 175.43 1xef n ASN 556 N -0.33 3.28 -1.10 2.29 5.15 -1.26 -4.73 115.26 118.57 1xef n ASN 556 Ca 0.03 -2.75 -0.01 0.00 -0.60 0.00 0.00 54.58 51.26 1xef n ASN 556 Cb 0.53 -1.46 0.00 0.00 -0.53 0.00 0.00 39.78 38.32 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 7.29 0.05 -1.34 1.20 1.85 -1.26 -4.93 116.66 119.52 1xef n ARG 557 Ca 0.49 -0.13 -0.32 0.00 -1.00 0.00 0.00 57.85 56.89 1xef n ARG 557 Cb 0.42 0.15 0.09 0.00 -1.05 0.00 0.00 32.46 32.07 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 -1.11 4.31 0.18 2.89 1.04 -1.26 -1.51 113.70 118.23 1xef s SER 558 Ca 0.01 2.07 -0.14 0.00 0.48 0.00 0.00 55.95 58.37 1xef s SER 558 Cb -0.00 -2.55 0.11 0.00 0.10 0.00 0.00 66.02 63.67 1xef s SER 558 CO 0.01 -2.17 1.80 0.40 0.98 0.00 0.00 173.24 174.26 1xef h ILE 559 N -0.74 1.01 -0.37 -1.02 2.04 -0.79 -0.95 117.51 116.69 1xef h ILE 559 Ca -0.45 -0.19 -0.06 0.00 1.00 0.00 0.00 64.86 65.16 1xef h ILE 559 Cb 1.26 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 1xef h ILE 559 CO 0.50 0.10 -0.01 -0.29 0.00 0.00 0.00 178.15 178.45 1xef h ILE 560 N 0.55 1.21 -0.10 -0.67 2.10 -1.59 -0.69 117.51 118.33 1xef h ILE 560 Ca 0.21 -0.86 -0.10 0.00 1.08 0.00 0.00 64.86 65.19 1xef h ILE 560 Cb 0.06 0.95 -0.01 0.00 -1.09 0.00 0.00 36.82 36.73 1xef h ILE 560 CO -0.12 0.30 -0.39 0.44 -1.08 0.00 0.00 178.15 177.30 1xef h ASP 561 N 0.56 0.22 -0.22 2.19 5.19 -1.74 -0.60 116.42 122.02 1xef h ASP 561 Ca 0.12 -0.09 -0.17 0.00 -0.62 0.00 0.00 57.03 56.27 1xef h ASP 561 Cb 0.38 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.83 1xef h ASP 561 CO 0.01 0.59 -0.53 0.78 -3.12 0.00 0.00 179.24 176.97 1xef h ASN 562 N 0.18 0.84 -0.23 6.45 4.21 -0.42 -2.78 115.58 123.83 1xef h ASN 562 Ca 0.02 -0.57 -0.20 0.00 1.21 0.00 0.00 56.30 56.76 1xef h ASN 562 Cb 0.77 -0.24 0.00 0.00 -1.12 0.00 0.00 38.32 37.73 1xef h ASN 562 CO 0.06 1.26 -0.62 0.40 -1.29 0.00 0.00 177.43 177.23 1xef h ILE 563 N 0.47 1.28 0.00 2.81 2.04 -1.11 -3.28 117.51 119.70 1xef h ILE 563 Ca -0.01 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 64.04 1xef h ILE 563 Cb 1.15 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.97 1xef h ILE 563 CO 0.12 0.59 0.00 -1.20 0.00 0.00 0.00 178.15 177.65 1xef n SER 564 N -3.98 0.00 -0.20 1.72 7.64 -0.24 -4.53 113.62 114.03 1xef n SER 564 Ca -0.05 0.43 0.02 0.00 1.01 0.00 0.00 58.87 60.28 1xef n SER 564 Cb 0.67 -0.48 0.06 0.00 -1.01 0.00 0.00 64.21 63.45 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 -1.48 -0.24 0.01 -3.43 0.00 -1.05 -0.25 117.00 110.57 1xef n LEU 565 Ca 0.07 0.95 -0.12 0.00 0.00 0.00 0.00 56.01 56.91 1xef n LEU 565 Cb 0.29 -0.27 0.01 0.00 0.00 0.00 0.00 43.42 43.46 1xef n LEU 565 CO 0.23 -0.90 0.38 0.00 0.00 0.00 0.00 177.39 177.11 1xef h ALA 566 N 1.00 0.56 -2.39 1.96 0.00 -1.89 -3.38 119.26 115.12 1xef h ALA 566 Ca 0.24 -0.57 -0.59 0.00 0.00 0.00 0.00 54.91 53.99 1xef h ALA 566 Cb 0.38 -0.06 -0.39 0.00 0.00 0.00 0.00 17.79 17.72 1xef h ALA 566 CO -0.56 0.72 -0.89 -1.71 0.00 0.00 0.00 179.25 176.81 1xef n ASN 567 N -3.91 0.86 -4.80 0.00 5.15 0.66 -5.07 115.26 108.16 1xef n ASN 567 Ca -0.05 -2.74 -0.34 0.00 -0.60 0.00 0.00 54.58 50.85 1xef n ASN 567 Cb 0.68 -0.63 -0.04 0.00 -0.53 0.00 0.00 39.78 39.26 1xef n ASN 567 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1xef s PRO 568 N -0.85 3.90 0.00 1.20 0.04 -0.97 -3.15 135.00 135.17 1xef s PRO 568 Ca 0.33 1.36 0.00 0.00 0.04 0.00 0.00 61.00 62.73 1xef s PRO 568 Cb 0.07 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1xef s PRO 568 CO -0.15 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 176.95 1xef n GLY 569 N -0.19 1.24 3.76 0.56 0.00 -1.26 -5.05 105.19 104.25 1xef n GLY 569 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.52 3.27 0.35 1.61 0.00 -1.19 -4.95 119.30 117.87 1xef s MET 570 Ca 0.00 1.93 -0.28 0.00 0.00 0.00 0.00 55.69 57.34 1xef s MET 570 Cb 0.00 -2.17 -0.12 0.00 0.00 0.00 0.00 34.83 32.54 1xef s MET 570 CO 0.00 -1.00 1.27 -1.13 0.00 0.00 0.00 175.02 174.16 1xef n SER 571 N -1.08 2.63 0.14 1.11 3.41 -1.26 -4.90 113.62 113.66 1xef n SER 571 Ca 0.11 1.19 0.04 0.00 -0.26 0.00 0.00 58.87 59.95 1xef n SER 571 Cb 0.48 -1.47 0.45 0.00 -0.26 0.00 0.00 64.21 63.40 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 2.45 1.14 0.00 -3.33 2.07 -2.01 -2.52 116.25 114.05 1xef h VAL 572 Ca -0.46 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.49 1xef h VAL 572 Cb 1.29 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1xef h VAL 572 CO 0.62 0.18 0.00 1.05 0.02 0.00 0.00 177.57 179.44 1xef h GLU 573 N 0.20 0.00 0.05 1.57 9.09 -1.99 -1.79 114.58 121.71 1xef h GLU 573 Ca 0.05 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.21 1xef h GLU 573 Cb 0.26 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.36 1xef h GLU 573 CO 0.01 0.00 -1.04 0.87 0.05 0.00 0.00 179.01 178.90 1xef h LYS 574 N 0.00 0.34 -0.07 1.06 1.79 -1.82 -1.56 116.57 116.31 1xef h LYS 574 Ca 0.00 -0.43 -0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1xef h LYS 574 Cb 0.67 0.14 -0.00 0.00 -1.58 0.00 0.00 32.23 31.45 1xef h LYS 574 CO 0.00 1.13 0.03 0.28 -1.08 0.00 0.00 179.45 179.82 1xef h VAL 575 N 0.17 1.13 -0.89 0.50 2.07 -1.49 -2.18 116.25 115.56 1xef h VAL 575 Ca -0.10 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1xef h VAL 575 Cb 1.71 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 32.69 1xef h VAL 575 CO 0.18 0.11 0.48 0.40 0.02 0.00 0.00 177.57 178.76 1xef h ILE 576 N -0.03 1.26 -0.51 4.57 2.04 -1.38 -1.53 117.51 121.93 1xef h ILE 576 Ca 0.02 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 1xef h ILE 576 Cb 0.15 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 1xef h ILE 576 CO -0.00 0.29 0.27 0.22 0.00 0.00 0.00 178.15 178.93 1xef h TYR 577 N 1.24 0.71 -0.73 1.37 3.20 -1.23 -0.33 116.97 121.20 1xef h TYR 577 Ca 0.31 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.15 1xef h TYR 577 Cb 0.03 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.04 1xef h TYR 577 CO 0.01 0.54 0.41 0.00 -1.64 0.00 0.00 178.16 177.48 1xef h ALA 578 N 1.11 0.93 -0.18 1.82 0.00 -1.01 -1.97 119.26 119.95 1xef h ALA 578 Ca 0.18 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1xef h ALA 578 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1xef h ALA 578 CO -0.03 0.43 -0.19 0.00 0.00 0.00 0.00 179.25 179.46 1xef h ALA 579 N 1.21 1.34 -0.42 0.00 0.00 -0.99 -2.19 119.26 118.20 1xef h ALA 579 Ca 0.26 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 1xef h ALA 579 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xef h ALA 579 CO -0.04 0.45 -0.28 0.87 0.00 0.00 0.00 179.25 180.25 1xef h LYS 580 N 0.29 0.91 -0.18 0.00 1.57 -0.71 0.43 116.57 118.87 1xef h LYS 580 Ca 0.05 -0.42 -0.07 0.00 -1.87 0.00 0.00 60.65 58.35 1xef h LYS 580 Cb 0.51 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1xef h LYS 580 CO 0.03 1.07 -0.18 -0.07 -0.57 0.00 0.00 179.45 179.73 1xef h LEU 581 N 0.78 0.29 0.00 2.94 4.07 -1.11 -2.42 115.31 119.86 1xef h LEU 581 Ca 0.09 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1xef h LEU 581 Cb 0.84 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.51 1xef h LEU 581 CO 0.07 0.50 -0.10 0.00 -1.08 0.00 0.00 178.44 177.83 1xef n ALA 582 N -2.48 2.41 -1.83 1.53 0.00 -0.85 -4.52 120.51 114.77 1xef n ALA 582 Ca -0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 1xef n ALA 582 Cb 0.32 -1.42 -0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 1.35 0.33 0.05 0.00 0.00 -0.84 -4.77 105.19 101.31 1xef n GLY 583 Ca 0.06 -0.79 0.01 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.63 2.15 -0.29 4.61 0.00 0.14 -4.61 120.51 121.89 1xef n ALA 584 Ca -0.04 -0.86 0.04 0.00 0.00 0.00 0.00 53.44 52.58 1xef n ALA 584 Cb 0.43 -0.43 0.18 0.00 0.00 0.00 0.00 19.45 19.63 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 0.83 -0.24 0.00 6.17 -1.75 -2.17 115.15 118.00 1xef h HIS 585 Ca -0.25 0.03 -0.00 0.00 0.71 0.00 0.00 60.37 60.86 1xef h HIS 585 Cb 1.54 -0.25 -0.01 0.00 2.52 0.00 0.00 27.41 31.21 1xef h HIS 585 CO 0.00 0.31 0.15 -0.44 0.71 0.00 0.00 177.93 178.65 1xef h ASP 586 N 0.75 0.28 0.21 3.26 3.32 -1.89 -0.98 116.42 121.37 1xef h ASP 586 Ca 0.41 -0.04 -0.18 0.00 0.02 0.00 0.00 57.03 57.24 1xef h ASP 586 Cb 0.44 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 1xef h ASP 586 CO -0.28 0.25 -0.69 2.19 -1.72 0.00 0.00 179.24 178.99 1xef h PHE 587 N 0.30 0.58 -0.42 4.55 -5.15 -1.80 -2.82 116.94 112.17 1xef h PHE 587 Ca 0.09 -0.24 -0.03 0.00 -0.20 0.00 0.00 57.97 57.59 1xef h PHE 587 Cb 0.01 -0.09 -0.02 0.00 0.22 0.00 0.00 35.95 36.07 1xef h PHE 587 CO -0.05 0.99 0.17 0.82 -2.00 0.00 0.00 178.31 178.24 1xef h ILE 588 N 0.30 1.20 -0.14 0.88 2.04 -1.27 -2.80 117.51 117.72 1xef h ILE 588 Ca -0.02 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.16 1xef h ILE 588 Cb 1.26 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1xef h ILE 588 CO 0.12 0.23 -0.17 0.28 0.00 0.00 0.00 178.15 178.61 1xef h SER 589 N 0.54 0.21 0.99 1.72 0.02 -1.20 -2.51 113.55 113.32 1xef h SER 589 Ca 0.14 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1xef h SER 589 Cb 0.20 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1xef h SER 589 CO -0.01 0.40 0.00 -0.62 -1.14 0.00 0.00 176.83 175.46 1xef n GLU 590 N -4.25 0.17 -2.31 3.45 1.02 -1.06 -4.75 120.64 112.92 1xef n GLU 590 Ca -0.01 0.29 -0.35 0.00 -0.02 0.00 0.00 57.16 57.07 1xef n GLU 590 Cb 0.29 -1.77 -0.01 0.00 -0.02 0.00 0.00 31.44 29.94 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 -4.16 3.80 0.26 -4.62 1.43 -0.94 -4.95 118.68 109.50 1xef s LEU 591 Ca 0.08 2.15 -0.04 0.00 -1.03 0.00 0.00 54.13 55.29 1xef s LEU 591 Cb 0.11 -4.53 0.35 0.00 0.03 0.00 0.00 46.19 42.15 1xef s LEU 591 CO 0.46 -1.11 1.91 -0.09 0.23 0.00 0.00 176.35 177.76 1xef h ARG 592 N 1.37 1.22 -0.23 1.70 2.43 -1.87 -2.84 114.38 116.16 1xef h ARG 592 Ca -0.50 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.60 1xef h ARG 592 Cb 1.25 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1xef h ARG 592 CO 0.58 0.81 0.00 -1.91 -1.51 0.00 0.00 179.97 177.93 1xef n GLU 593 N -4.44 2.15 0.00 0.20 4.07 -1.26 -5.06 120.64 116.31 1xef n GLU 593 Ca 0.13 -1.98 0.00 0.00 -0.06 0.00 0.00 57.16 55.25 1xef n GLU 593 Cb 0.09 -1.43 0.00 0.00 -0.06 0.00 0.00 31.44 30.04 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 1.23 3.48 0.20 8.31 0.00 -1.07 -1.76 105.19 115.57 1xef n GLY 594 Ca 0.15 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.93 -2.97 116.97 113.73 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 -0.00 0.09 -1.05 0.00 0.00 178.16 177.20 1xef n ASN 596 N -2.71 0.44 -4.64 3.88 3.02 -0.72 -1.51 115.26 113.02 1xef n ASN 596 Ca 0.02 -1.11 -0.42 0.00 -0.03 0.00 0.00 54.58 53.04 1xef n ASN 596 Cb 0.34 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.48 1xef n ASN 596 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1xef s THR 597 N -2.03 3.15 -0.11 3.41 2.01 -1.12 -4.69 115.64 116.26 1xef s THR 597 Ca 0.44 0.17 -0.29 0.00 0.31 0.00 0.00 61.69 62.32 1xef s THR 597 Cb 0.22 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 1xef s THR 597 CO 0.37 -0.05 1.54 -0.63 -0.69 0.00 0.00 174.62 175.16 1xef s ILE 598 N 5.78 3.79 0.00 1.82 1.09 -1.26 -1.61 121.20 130.81 1xef s ILE 598 Ca 0.89 0.94 0.00 0.00 -1.10 0.00 0.00 60.65 61.38 1xef s ILE 598 Cb -0.36 -3.64 0.00 0.00 -1.06 0.00 0.00 42.46 37.39 1xef s ILE 598 CO 0.37 -0.12 0.00 1.33 -0.10 0.00 0.00 174.94 176.42 1xef n VAL 599 N 5.61 0.00 -1.55 2.92 0.24 -0.57 -4.91 118.33 120.07 1xef n VAL 599 Ca 0.17 0.00 -0.54 0.00 -2.04 0.00 0.00 64.34 61.93 1xef n VAL 599 Cb 0.44 -1.58 -0.06 0.00 -1.47 0.00 0.00 33.84 31.17 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 3.95 0.06 0.70 7.63 0.00 -1.20 -4.55 105.19 111.79 1xef n GLY 600 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.70 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 2.00 0.14 0.00 1.61 4.71 -1.26 -2.19 120.64 125.65 1xef n GLU 601 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.33 1xef n GLU 601 Cb 0.16 -1.22 0.00 0.00 -1.01 0.00 0.00 31.44 29.38 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 0.63 0.16 0.00 3.49 -0.06 -1.26 -5.01 117.38 115.33 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 0.05 -0.04 0.00 0.00 -4.06 0.00 0.00 30.24 26.19 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 -0.27 2.96 2.74 1.69 0.00 -0.93 -4.75 105.19 106.64 1xef n GLY 603 Ca 0.00 -0.41 -0.19 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.20 -0.43 4.61 0.00 -1.26 -3.21 121.76 121.27 1xef s ALA 604 Ca 0.00 0.22 0.03 0.00 0.00 0.00 0.00 51.96 52.22 1xef s ALA 604 Cb 0.00 -1.26 0.29 0.00 0.00 0.00 0.00 23.12 22.14 1xef s ALA 604 CO 0.00 -1.16 1.18 0.41 0.00 0.00 0.00 175.76 176.18 1xef n GLY 605 N 5.32 2.54 3.77 0.00 0.00 -1.26 -4.57 105.19 110.98 1xef n GLY 605 Ca -0.06 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.17 2.35 0.57 0.99 1.43 -1.26 -4.83 118.68 116.76 1xef s LEU 606 Ca 0.22 -1.61 -0.05 0.00 -1.03 0.00 0.00 54.13 51.65 1xef s LEU 606 Cb 0.17 -0.78 0.01 0.00 0.03 0.00 0.00 46.19 45.62 1xef s LEU 606 CO 0.05 -0.85 0.88 -0.94 0.23 0.00 0.00 176.35 175.72 1xef s SER 607 N -3.90 5.65 0.19 2.29 1.04 -1.26 -4.91 113.70 112.80 1xef s SER 607 Ca 0.09 0.70 -0.12 0.00 0.48 0.00 0.00 55.95 57.10 1xef s SER 607 Cb 0.02 -1.72 0.20 0.00 0.10 0.00 0.00 66.02 64.61 1xef s SER 607 CO 0.05 -1.01 1.76 1.23 0.98 0.00 0.00 173.24 176.25 1xef h GLY 608 N -0.11 0.74 1.84 7.32 0.00 -1.99 -0.01 103.07 110.86 1xef h GLY 608 Ca -0.45 -0.13 -0.16 0.00 0.00 0.00 0.00 47.33 46.59 1xef h GLY 608 CO 0.60 0.03 -0.68 -1.33 0.00 0.00 0.00 176.54 175.16 1xef h GLY 609 N 0.41 0.17 0.83 4.60 0.00 -1.95 -0.53 103.07 106.61 1xef h GLY 609 Ca 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 1xef h GLY 609 CO -0.24 0.21 0.03 1.46 0.00 0.00 0.00 176.54 178.00 1xef h GLN 610 N 0.11 0.32 -0.39 4.80 4.20 -1.88 -1.66 115.11 120.61 1xef h GLN 610 Ca -0.01 -0.09 0.06 0.00 0.06 0.00 0.00 58.65 58.66 1xef h GLN 610 Cb 1.22 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.91 1xef h GLN 610 CO 0.10 0.48 0.10 -0.09 -0.67 0.00 0.00 178.83 178.75 1xef h ARG 611 N 0.11 0.23 -0.92 1.46 2.43 -0.88 -1.93 114.38 114.88 1xef h ARG 611 Ca 0.06 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1xef h ARG 611 Cb 0.32 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 1xef h ARG 611 CO 0.00 0.15 0.54 0.37 -1.51 0.00 0.00 179.97 179.53 1xef h GLN 612 N 0.23 1.26 -0.06 0.20 5.75 -0.99 -1.56 115.11 119.94 1xef h GLN 612 Ca 0.18 -0.12 -0.12 0.00 -0.15 0.00 0.00 58.65 58.44 1xef h GLN 612 Cb 0.20 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 1xef h GLN 612 CO -0.22 0.89 -0.53 0.00 -2.65 0.00 0.00 178.83 176.32 1xef h ARG 613 N 1.27 0.17 -0.60 1.69 3.08 -1.03 -1.32 114.38 117.63 1xef h ARG 613 Ca 0.33 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 60.25 1xef h ARG 613 Cb -0.03 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 1xef h ARG 613 CO -0.06 0.66 0.25 0.82 -1.07 0.00 0.00 179.97 180.57 1xef h ILE 614 N 0.13 1.23 -0.73 2.04 1.08 -0.92 -1.94 117.51 118.39 1xef h ILE 614 Ca 0.00 -0.69 -0.06 0.00 -0.39 0.00 0.00 64.86 63.71 1xef h ILE 614 Cb 0.98 0.56 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 1xef h ILE 614 CO 0.08 0.27 0.20 0.00 -0.69 0.00 0.00 178.15 178.01 1xef h ALA 615 N 1.09 0.96 -0.49 1.87 0.00 -0.97 -0.62 119.26 121.10 1xef h ALA 615 Ca 0.20 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1xef h ALA 615 Cb 0.19 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1xef h ALA 615 CO -0.02 0.66 0.20 0.82 0.00 0.00 0.00 179.25 180.92 1xef h ILE 616 N 1.09 1.21 -0.64 0.00 2.04 -1.16 -2.24 117.51 117.82 1xef h ILE 616 Ca 0.23 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1xef h ILE 616 Cb 0.34 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1xef h ILE 616 CO -0.00 0.24 0.37 0.00 0.00 0.00 0.00 178.15 178.76 1xef h ALA 617 N 1.05 0.82 -0.73 1.87 0.00 -1.07 -2.35 119.26 118.84 1xef h ALA 617 Ca 0.16 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1xef h ALA 617 Cb 0.19 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1xef h ALA 617 CO -0.01 0.31 0.44 -0.09 0.00 0.00 0.00 179.25 179.90 1xef h ARG 618 N 0.87 0.80 -0.32 0.00 2.43 -0.94 -2.29 114.38 114.93 1xef h ARG 618 Ca 0.23 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.25 1xef h ARG 618 Cb 0.00 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1xef h ARG 618 CO -0.04 0.53 -0.22 0.00 -1.51 0.00 0.00 179.97 178.73 1xef h ALA 619 N 1.34 1.02 -0.22 2.80 0.00 -1.13 -1.70 119.26 121.37 1xef h ALA 619 Ca 0.31 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1xef h ALA 619 Cb 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1xef h ALA 619 CO -0.15 0.59 -0.11 -0.07 0.00 0.00 0.00 179.25 179.50 1xef h LEU 620 N 0.54 0.35 -0.23 0.00 3.38 -1.09 -2.87 115.31 115.39 1xef h LEU 620 Ca 0.08 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 1xef h LEU 620 Cb 0.68 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1xef h LEU 620 CO 0.05 0.50 -0.51 0.58 0.09 0.00 0.00 178.44 179.15 1xef h VAL 621 N 0.34 1.30 -1.09 1.22 2.07 -1.06 -2.75 116.25 116.28 1xef h VAL 621 Ca 0.07 -1.72 0.30 0.00 0.82 0.00 0.00 66.70 66.17 1xef h VAL 621 Cb 0.42 1.79 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 1xef h VAL 621 CO 0.02 0.55 0.74 0.78 0.02 0.00 0.00 177.57 179.68 1xef h ASN 622 N 0.48 0.23 -5.87 0.57 4.21 -1.11 -3.47 115.58 110.62 1xef h ASN 622 Ca 0.00 0.05 -0.30 0.00 1.21 0.00 0.00 56.30 57.26 1xef h ASN 622 Cb 1.12 0.01 0.10 0.00 -1.12 0.00 0.00 38.32 38.43 1xef h ASN 622 CO 0.11 0.04 -0.75 -3.20 -1.29 0.00 0.00 177.43 172.34 1xef n ASN 623 N -4.42 -6.18 -4.88 5.81 4.05 -1.04 -5.02 115.26 103.58 1xef n ASN 623 Ca 0.25 -0.74 -0.30 0.00 0.45 0.00 0.00 54.58 54.25 1xef n ASN 623 Cb 1.05 -4.16 0.03 0.00 1.23 0.00 0.00 39.78 37.92 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 -4.84 3.22 0.39 1.20 0.04 -1.26 -4.97 135.00 128.77 1xef s PRO 624 Ca 0.34 0.49 0.21 0.00 0.04 0.00 0.00 61.00 62.08 1xef s PRO 624 Cb -0.09 -2.11 0.38 0.00 0.04 0.00 0.00 34.50 32.72 1xef s PRO 624 CO 0.81 -0.74 1.60 0.87 0.04 0.00 0.00 177.00 179.58 1xef h LYS 625 N -0.39 0.00 -4.58 4.56 1.57 -1.53 -3.43 116.57 112.77 1xef h LYS 625 Ca -0.45 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.77 1xef h LYS 625 Cb 1.22 0.00 -0.35 0.00 0.08 0.00 0.00 32.23 33.18 1xef h LYS 625 CO 0.63 0.21 -0.82 0.42 -0.57 0.00 0.00 179.45 179.31 1xef s ILE 626 N -3.20 1.34 -0.22 1.86 1.01 0.03 -1.16 121.20 120.86 1xef s ILE 626 Ca 0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 1xef s ILE 626 Cb 0.07 -1.25 0.02 0.00 0.01 0.00 0.00 42.46 41.30 1xef s ILE 626 CO 0.68 0.41 -0.09 -0.22 0.00 0.00 0.00 174.94 175.72 1xef s LEU 627 N 1.15 2.84 -0.23 2.97 2.96 0.07 -1.56 118.68 126.88 1xef s LEU 627 Ca -0.04 -0.70 -0.07 0.00 -0.22 0.00 0.00 54.13 53.11 1xef s LEU 627 Cb -0.14 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 1xef s LEU 627 CO -0.03 -0.07 0.05 -0.63 -1.32 0.00 0.00 176.35 174.35 1xef s ILE 628 N 1.35 4.19 -0.39 6.68 1.01 -0.07 -0.54 121.20 133.44 1xef s ILE 628 Ca 0.03 -0.22 -0.12 0.00 0.00 0.00 0.00 60.65 60.34 1xef s ILE 628 Cb -0.15 -2.94 0.03 0.00 0.01 0.00 0.00 42.46 39.41 1xef s ILE 628 CO -0.06 0.37 0.24 -0.36 0.00 0.00 0.00 174.94 175.12 1xef s PHE 629 N 1.39 3.25 -0.71 3.97 0.40 0.58 -0.50 117.98 126.37 1xef s PHE 629 Ca 0.05 -0.88 -0.09 0.00 -0.60 0.00 0.00 56.93 55.40 1xef s PHE 629 Cb -0.15 -2.50 0.19 0.00 0.51 0.00 0.00 43.02 41.07 1xef s PHE 629 CO 0.03 -0.64 0.60 0.34 0.70 0.00 0.00 175.22 176.24 1xef s ASP 630 N 1.61 6.08 -1.92 1.36 -1.08 -0.37 -0.01 116.67 122.34 1xef s ASP 630 Ca 0.03 -2.65 0.00 0.00 -0.52 0.00 0.00 52.55 49.41 1xef s ASP 630 Cb -0.19 -2.06 0.00 0.00 -1.46 0.00 0.00 42.92 39.21 1xef s ASP 630 CO 0.07 -0.52 0.00 -0.62 0.52 0.00 0.00 175.17 174.63 1xef n GLU 631 N 3.92 -1.60 0.22 4.34 -0.58 0.04 -2.49 120.64 124.49 1xef n GLU 631 Ca 0.09 1.08 0.11 0.00 -0.42 0.00 0.00 57.16 58.01 1xef n GLU 631 Cb 0.43 -5.61 0.68 0.00 -0.57 0.00 0.00 31.44 26.38 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 0.57 2.02 -0.01 0.62 0.00 -1.78 -2.78 119.26 117.90 1xef h ALA 632 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1xef h ALA 632 Cb 1.34 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1xef h ALA 632 CO 0.58 -0.11 -0.13 0.25 0.00 0.00 0.00 179.25 179.85 1xef n THR 633 N -4.42 0.00 0.31 0.00 -2.24 -1.26 -4.68 114.28 101.99 1xef n THR 633 Ca -0.01 -0.44 0.20 0.00 -2.27 0.00 0.00 64.05 61.54 1xef n THR 633 Cb 0.18 1.18 0.99 0.00 -2.10 0.00 0.00 70.33 70.58 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 1.71 0.00 -0.35 3.42 4.64 -1.87 -0.52 113.55 120.58 1xef h SER 634 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xef h SER 634 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1xef h SER 634 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1xef n ALA 635 N -2.07 2.28 -2.16 5.18 0.00 -1.26 -4.97 120.51 117.50 1xef n ALA 635 Ca -0.01 -1.06 -0.37 0.00 0.00 0.00 0.00 53.44 52.00 1xef n ALA 635 Cb 0.16 -0.53 -0.06 0.00 0.00 0.00 0.00 19.45 19.02 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 -1.04 4.40 0.88 0.00 1.02 -0.20 -4.82 118.68 118.93 1xef s LEU 636 Ca 0.27 1.36 -0.10 0.00 0.02 0.00 0.00 54.13 55.67 1xef s LEU 636 Cb 0.14 -3.38 0.13 0.00 0.02 0.00 0.00 46.19 43.10 1xef s LEU 636 CO 0.19 0.11 1.13 1.51 0.02 0.00 0.00 176.35 179.31 1xef s ASP 637 N -1.51 3.29 0.41 2.29 -4.77 -1.26 -4.75 116.67 110.38 1xef s ASP 637 Ca 0.39 2.08 0.11 0.00 -3.30 0.00 0.00 52.55 51.83 1xef s ASP 637 Cb -0.18 -2.55 0.94 0.00 -1.09 0.00 0.00 42.92 40.05 1xef s ASP 637 CO 0.21 -2.85 1.98 1.88 0.70 0.00 0.00 175.17 177.09 1xef h TYR 638 N -1.69 0.53 -0.10 2.11 0.05 -1.97 -1.88 116.97 114.01 1xef h TYR 638 Ca -0.43 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.32 1xef h TYR 638 Cb 1.26 -0.17 -0.00 0.00 1.01 0.00 0.00 36.73 38.83 1xef h TYR 638 CO 0.52 0.26 -0.10 1.49 -1.05 0.00 0.00 178.16 179.29 1xef h GLU 639 N 0.51 0.24 -0.63 4.88 4.81 -1.99 -1.57 114.58 120.83 1xef h GLU 639 Ca 0.28 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1xef h GLU 639 Cb 0.43 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1xef h GLU 639 CO -0.08 0.66 0.26 0.77 -0.73 0.00 0.00 179.01 179.88 1xef h SER 640 N -0.16 0.83 -0.19 1.04 0.02 -1.83 -1.37 113.55 111.90 1xef h SER 640 Ca 0.02 -0.11 -0.18 0.00 -0.84 0.00 0.00 61.79 60.69 1xef h SER 640 Cb 0.61 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1xef h SER 640 CO 0.02 0.74 -0.57 -0.08 -1.14 0.00 0.00 176.83 175.80 1xef h GLU 641 N 0.90 0.72 -0.95 3.45 4.81 -1.39 -2.90 114.58 119.22 1xef h GLU 641 Ca 0.21 -0.52 0.04 0.00 -0.13 0.00 0.00 59.36 58.97 1xef h GLU 641 Cb 0.16 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.57 1xef h GLU 641 CO -0.02 1.14 0.62 1.25 -0.73 0.00 0.00 179.01 181.27 1xef h HIS 642 N 0.43 1.16 -0.39 0.92 2.76 -1.06 -0.76 115.15 118.20 1xef h HIS 642 Ca -0.02 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.20 1xef h HIS 642 Cb 1.19 -0.38 -0.03 0.00 1.55 0.00 0.00 27.41 29.74 1xef h HIS 642 CO 0.09 0.65 0.24 0.28 -1.30 0.00 0.00 177.93 177.89 1xef h VAL 643 N 1.18 1.05 -0.40 5.26 2.07 -1.22 -0.72 116.25 123.48 1xef h VAL 643 Ca 0.39 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.70 1xef h VAL 643 Cb 0.03 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1xef h VAL 643 CO -0.13 0.09 0.08 0.40 0.02 0.00 0.00 177.57 178.02 1xef h ILE 644 N 0.48 1.24 -0.16 4.57 2.04 -1.22 -2.30 117.51 122.16 1xef h ILE 644 Ca 0.15 -0.84 -0.11 0.00 1.00 0.00 0.00 64.86 65.07 1xef h ILE 644 Cb -0.00 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1xef h ILE 644 CO -0.07 0.29 -0.38 0.24 0.00 0.00 0.00 178.15 178.23 1xef h MET 645 N 0.51 0.34 0.00 2.37 2.86 -1.02 -1.87 114.93 118.12 1xef h MET 645 Ca 0.12 -0.16 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1xef h MET 645 Cb 0.35 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 1xef h MET 645 CO 0.01 0.68 -0.39 0.00 1.06 0.00 0.00 176.91 178.26 1xef h ARG 646 N 0.29 0.00 -0.01 1.72 3.08 -1.07 -2.57 114.38 115.82 1xef h ARG 646 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1xef h ARG 646 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1xef h ARG 646 CO 0.06 0.39 -0.05 0.09 -1.07 0.00 0.00 179.97 179.39 1xef n ASN 647 N -3.95 0.59 -0.05 7.04 3.02 -0.85 -4.26 115.26 116.80 1xef n ASN 647 Ca -0.02 -0.91 0.08 0.00 -0.03 0.00 0.00 54.58 53.71 1xef n ASN 647 Cb 0.44 -0.04 0.46 0.00 -0.61 0.00 0.00 39.78 40.04 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 0.84 0.46 0.00 3.52 4.05 -0.93 -0.48 114.93 122.39 1xef h MET 648 Ca 0.00 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.38 1xef h MET 648 Cb 0.30 -0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 30.99 1xef h MET 648 CO 0.00 0.31 -0.05 1.12 0.23 0.00 0.00 176.91 178.51 1xef h HIS 649 N 0.48 0.00 0.01 1.39 2.07 -1.79 -1.86 115.15 115.45 1xef h HIS 649 Ca 0.22 0.00 -0.35 0.00 -2.85 0.00 0.00 60.37 57.39 1xef h HIS 649 Cb 0.27 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 30.19 1xef h HIS 649 CO -0.00 0.05 -2.19 1.63 -3.07 0.00 0.00 177.93 174.35 1xef n LYS 650 N -3.30 0.67 -0.30 5.12 5.02 -0.35 -4.21 118.16 120.82 1xef n LYS 650 Ca -0.01 0.12 0.01 0.00 -2.02 0.00 0.00 58.31 56.41 1xef n LYS 650 Cb 0.22 -1.61 0.20 0.00 -0.02 0.00 0.00 35.03 33.83 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 0.01 1.17 -0.60 -0.18 2.04 -0.78 -3.01 117.51 116.15 1xef h ILE 651 Ca -0.48 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 1xef h ILE 651 Cb 2.11 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 1xef h ILE 651 CO 0.03 0.21 0.04 0.00 0.00 0.00 0.00 178.15 178.43 1xef s LYS 653 N -2.82 3.90 -1.41 0.00 -0.14 -1.14 -2.61 119.74 115.53 1xef s LYS 653 Ca 0.55 2.11 0.00 0.00 -1.36 0.00 0.00 55.97 57.27 1xef s LYS 653 Cb 0.42 -4.10 0.00 0.00 -1.68 0.00 0.00 37.83 32.47 1xef s LYS 653 CO 0.16 -1.20 0.00 0.41 -0.76 0.00 0.00 175.35 173.96 1xef n GLY 654 N 4.64 -0.19 3.68 -3.33 0.00 -1.26 -4.99 105.19 103.74 1xef n GLY 654 Ca 0.20 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 -4.72 1.64 -0.08 1.61 1.70 -1.07 -4.93 118.95 113.10 1xef s ARG 655 Ca 0.00 -1.18 0.01 0.00 -0.47 0.00 0.00 55.73 54.09 1xef s ARG 655 Cb 0.00 0.52 -0.03 0.00 -0.57 0.00 0.00 34.95 34.87 1xef s ARG 655 CO 0.00 -0.71 -0.08 0.99 -1.08 0.00 0.00 175.30 174.42 1xef s THR 656 N -3.95 3.59 -0.12 4.99 2.01 -0.31 -3.01 115.64 118.85 1xef s THR 656 Ca 0.19 -0.51 0.03 0.00 0.31 0.00 0.00 61.69 61.70 1xef s THR 656 Cb -0.02 -2.47 0.01 0.00 0.01 0.00 0.00 72.50 70.02 1xef s THR 656 CO 0.09 0.58 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.70 1xef s VAL 657 N -0.59 1.86 -0.18 3.82 1.01 -0.76 -0.75 120.40 124.80 1xef s VAL 657 Ca 0.09 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 1xef s VAL 657 Cb -0.12 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1xef s VAL 657 CO 0.02 0.51 -0.05 -0.63 0.00 0.00 0.00 175.10 174.95 1xef s ILE 658 N 0.71 3.61 -0.20 2.22 1.01 0.30 -0.76 121.20 128.09 1xef s ILE 658 Ca -0.11 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.12 1xef s ILE 658 Cb -0.16 -2.60 0.04 0.00 0.01 0.00 0.00 42.46 39.75 1xef s ILE 658 CO 0.02 0.46 -0.14 -0.63 0.00 0.00 0.00 174.94 174.65 1xef s ILE 659 N 0.83 1.92 -0.24 2.92 1.01 0.64 -0.30 121.20 127.98 1xef s ILE 659 Ca -0.01 -1.12 -0.13 0.00 0.00 0.00 0.00 60.65 59.38 1xef s ILE 659 Cb -0.15 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1xef s ILE 659 CO 0.02 0.27 0.29 -0.63 0.00 0.00 0.00 174.94 174.88 1xef s ILE 660 N 1.29 5.26 -0.03 2.92 1.01 0.99 -0.33 121.20 132.30 1xef s ILE 660 Ca -0.01 0.44 -0.07 0.00 0.00 0.00 0.00 60.65 61.01 1xef s ILE 660 Cb -0.16 -3.62 0.01 0.00 0.01 0.00 0.00 42.46 38.70 1xef s ILE 660 CO -0.09 0.26 0.16 0.00 0.00 0.00 0.00 174.94 175.27 1xef s ALA 661 N 1.48 -0.40 -0.02 9.38 0.00 -1.17 -0.78 121.76 130.26 1xef s ALA 661 Ca 0.13 0.21 -0.06 0.00 0.00 0.00 0.00 51.96 52.24 1xef s ALA 661 Cb -0.15 -0.10 -0.29 0.00 0.00 0.00 0.00 23.12 22.58 1xef s ALA 661 CO 0.08 -0.14 0.76 0.00 0.00 0.00 0.00 175.76 176.45 1xef h ALA 662 N 5.10 0.24 -1.61 0.00 0.00 -1.94 -3.43 119.26 117.61 1xef h ALA 662 Ca -0.28 -1.14 -0.54 0.00 0.00 0.00 0.00 54.91 52.95 1xef h ALA 662 Cb 1.20 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 19.30 1xef h ALA 662 CO 0.40 1.11 1.14 0.50 0.00 0.00 0.00 179.25 182.40 1xef s ARG 663 N -2.60 3.25 0.59 0.00 3.52 -1.26 -4.89 118.95 117.55 1xef s ARG 663 Ca -0.12 0.58 0.38 0.00 -0.13 0.00 0.00 55.73 56.44 1xef s ARG 663 Cb 0.06 -4.15 1.84 0.00 -1.56 0.00 0.00 34.95 31.14 1xef s ARG 663 CO 0.85 -2.00 2.14 -0.07 -0.81 0.00 0.00 175.30 175.42 1xef h LEU 664 N 13.46 0.00 -1.38 -0.88 4.07 -1.96 -1.71 115.31 126.91 1xef h LEU 664 Ca -0.27 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.63 1xef h LEU 664 Cb 1.11 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.84 1xef h LEU 664 CO 1.16 0.00 -0.27 0.77 -1.08 0.00 0.00 178.44 179.02 1xef h SER 665 N 0.00 0.00 -0.58 -0.43 4.64 -1.98 -3.04 113.55 112.16 1xef h SER 665 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1xef h SER 665 Cb 0.25 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 1xef h SER 665 CO 0.00 0.27 0.31 0.74 -0.87 0.00 0.00 176.83 177.28 1xef h THR 666 N 0.00 1.19 -0.44 2.95 2.02 -1.72 -2.90 112.91 114.01 1xef h THR 666 Ca -0.00 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1xef h THR 666 Cb 0.62 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1xef h THR 666 CO 0.04 0.22 0.00 1.33 0.37 0.00 0.00 175.52 177.47 1xef n VAL 667 N -4.37 2.49 -0.10 3.16 0.24 -1.15 -4.68 118.33 113.92 1xef n VAL 667 Ca 0.06 -1.60 -0.06 0.00 -2.04 0.00 0.00 64.34 60.70 1xef n VAL 667 Cb 0.11 -0.23 0.01 0.00 -1.47 0.00 0.00 33.84 32.26 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 3.03 0.17 -0.64 7.34 3.64 -1.50 -2.91 116.57 125.69 1xef h LYS 668 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1xef h LYS 668 Cb 1.71 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.49 1xef h LYS 668 CO 0.36 0.11 0.00 0.09 -2.27 0.00 0.00 179.45 177.74 1xef n ASN 669 N -5.11 4.03 -4.76 4.20 4.13 -1.26 -4.51 115.26 111.97 1xef n ASN 669 Ca 0.01 -2.44 -0.37 0.00 1.68 0.00 0.00 54.58 53.46 1xef n ASN 669 Cb 0.16 -0.54 0.01 0.00 -1.54 0.00 0.00 39.78 37.86 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 -1.92 2.90 0.35 5.41 0.00 -1.10 -4.93 121.76 122.47 1xef s ALA 670 Ca 0.41 1.05 0.02 0.00 0.00 0.00 0.00 51.96 53.44 1xef s ALA 670 Cb 0.27 -3.44 0.64 0.00 0.00 0.00 0.00 23.12 20.60 1xef s ALA 670 CO 0.18 -0.90 2.01 -0.44 0.00 0.00 0.00 175.76 176.61 1xef h ASP 671 N 1.79 0.72 -3.80 0.00 3.32 -1.41 -3.44 116.42 113.60 1xef h ASP 671 Ca -0.50 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.38 1xef h ASP 671 Cb 1.27 -0.18 -0.25 0.00 0.22 0.00 0.00 39.33 40.38 1xef h ASP 671 CO 0.59 0.52 -0.37 -0.60 -1.72 0.00 0.00 179.24 177.66 1xef s ARG 672 N -5.72 0.34 -0.15 3.56 3.52 -1.19 -4.65 118.95 114.66 1xef s ARG 672 Ca -0.10 0.43 -0.02 0.00 -0.13 0.00 0.00 55.73 55.91 1xef s ARG 672 Cb 0.18 0.15 -0.02 0.00 -1.56 0.00 0.00 34.95 33.70 1xef s ARG 672 CO 0.76 -0.05 -0.09 0.42 -0.81 0.00 0.00 175.30 175.53 1xef s ILE 673 N 0.24 3.36 -0.25 4.11 1.01 0.14 -1.10 121.20 128.72 1xef s ILE 673 Ca -0.01 -0.54 -0.07 0.00 0.00 0.00 0.00 60.65 60.03 1xef s ILE 673 Cb -0.03 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 1xef s ILE 673 CO -0.00 0.50 0.07 -0.63 0.00 0.00 0.00 174.94 174.88 1xef s ILE 674 N 0.51 4.31 -0.32 2.92 1.01 0.16 -2.14 121.20 127.65 1xef s ILE 674 Ca -0.06 -0.18 -0.14 0.00 0.00 0.00 0.00 60.65 60.27 1xef s ILE 674 Cb -0.15 -3.02 -0.02 0.00 0.01 0.00 0.00 42.46 39.27 1xef s ILE 674 CO 0.03 0.33 0.30 -0.69 0.00 0.00 0.00 174.94 174.92 1xef s VAL 675 N 1.61 5.23 0.16 2.92 1.01 -0.48 -0.40 120.40 130.45 1xef s VAL 675 Ca 0.06 0.06 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 1xef s VAL 675 Cb -0.15 -3.73 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 1xef s VAL 675 CO 0.04 0.02 0.47 -0.04 0.00 0.00 0.00 175.10 175.58 1xef s MET 676 N 1.90 3.76 -0.29 2.72 -1.94 0.12 -1.41 119.30 124.16 1xef s MET 676 Ca 0.10 0.18 -0.07 0.00 -1.71 0.00 0.00 55.69 54.18 1xef s MET 676 Cb -0.17 -2.82 0.15 0.00 2.01 0.00 0.00 34.83 34.00 1xef s MET 676 CO 0.11 0.43 0.62 -2.00 -0.01 0.00 0.00 175.02 174.17 1xef s GLU 677 N -2.46 0.56 -1.44 2.03 2.56 -0.48 -4.31 118.70 115.16 1xef s GLU 677 Ca 0.41 1.29 -0.04 0.00 0.00 0.00 0.00 54.97 56.64 1xef s GLU 677 Cb -0.13 0.74 0.03 0.00 2.00 0.00 0.00 34.13 36.77 1xef s GLU 677 CO 0.21 -0.33 0.54 1.63 -0.56 0.00 0.00 175.26 176.75 1xef n LYS 678 N 5.44 -3.63 -1.06 4.30 5.02 -1.25 -2.25 118.16 124.72 1xef n LYS 678 Ca -0.08 0.44 -0.02 0.00 -2.02 0.00 0.00 58.31 56.62 1xef n LYS 678 Cb 0.50 -4.75 -0.01 0.00 -0.02 0.00 0.00 35.03 30.74 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 -1.84 0.56 3.13 0.72 0.00 0.36 -4.90 105.19 103.23 1xef n GLY 679 Ca -0.23 -0.63 -0.15 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.64 0.70 -0.63 1.61 1.02 -0.96 -2.03 119.74 117.82 1xef s LYS 680 Ca 0.00 -0.91 -0.24 0.00 0.02 0.00 0.00 55.97 54.84 1xef s LYS 680 Cb 0.00 -0.54 0.05 0.00 -0.52 0.00 0.00 37.83 36.82 1xef s LYS 680 CO 0.00 0.11 1.01 0.42 -0.92 0.00 0.00 175.35 175.97 1xef s ILE 681 N -1.56 4.24 -0.04 2.17 1.01 -1.26 -1.38 121.20 124.38 1xef s ILE 681 Ca -0.04 0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.62 1xef s ILE 681 Cb -0.09 -4.67 -0.28 0.00 0.01 0.00 0.00 42.46 37.44 1xef s ILE 681 CO 0.01 -1.39 0.70 0.58 0.00 0.00 0.00 174.94 174.84 1xef h VAL 682 N 6.01 0.97 -3.70 2.92 2.07 -1.56 -3.48 116.25 119.47 1xef h VAL 682 Ca -0.28 -2.62 -0.28 0.00 0.82 0.00 0.00 66.70 64.35 1xef h VAL 682 Cb 1.07 2.69 -0.16 0.00 -1.52 0.00 0.00 31.29 33.37 1xef h VAL 682 CO 1.16 0.82 -0.71 -1.61 0.02 0.00 0.00 177.57 177.25 1xef s GLU 683 N -2.59 0.87 -0.29 1.57 2.02 -1.19 -5.03 118.70 114.05 1xef s GLU 683 Ca -0.13 -1.28 -0.14 0.00 0.02 0.00 0.00 54.97 53.45 1xef s GLU 683 Cb 0.06 -0.39 0.13 0.00 0.10 0.00 0.00 34.13 34.03 1xef s GLU 683 CO 0.84 0.03 0.81 -1.14 0.02 0.00 0.00 175.26 175.82 1xef s GLN 684 N -3.39 0.49 0.00 1.61 0.74 -1.26 -1.38 119.66 116.47 1xef s GLN 684 Ca 0.10 1.07 0.00 0.00 0.05 0.00 0.00 55.36 56.58 1xef s GLN 684 Cb 0.01 0.48 0.00 0.00 1.10 0.00 0.00 33.01 34.60 1xef s GLN 684 CO -0.02 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 174.99 1xef n GLY 685 N 4.80 -0.52 3.92 2.59 0.00 -0.91 -4.99 105.19 110.08 1xef n GLY 685 Ca -0.14 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.38 3.55 0.22 1.61 1.02 -1.26 0.28 119.74 123.78 1xef s LYS 686 Ca 0.00 -0.21 -0.20 0.00 0.02 0.00 0.00 55.97 55.59 1xef s LYS 686 Cb 0.00 -2.71 0.19 0.00 -0.52 0.00 0.00 37.83 34.79 1xef s LYS 686 CO 0.00 0.25 1.55 1.25 -0.92 0.00 0.00 175.35 177.48 1xef h HIS 687 N 1.50 -1.22 0.00 3.18 -0.00 -1.84 -0.83 115.15 115.95 1xef h HIS 687 Ca -0.48 0.11 -0.15 0.00 -0.00 0.00 0.00 60.37 59.84 1xef h HIS 687 Cb 1.20 0.67 -0.02 0.00 -0.00 0.00 0.00 27.41 29.26 1xef h HIS 687 CO 0.55 -0.40 -1.03 0.87 -0.00 0.00 0.00 177.93 177.92 1xef h LYS 688 N -0.01 0.00 -0.80 5.26 1.57 -1.95 -2.24 116.57 118.40 1xef h LYS 688 Ca 0.31 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 1xef h LYS 688 Cb 0.57 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 1xef h LYS 688 CO -0.97 0.46 0.43 0.93 -0.57 0.00 0.00 179.45 179.72 1xef h GLU 689 N 0.00 1.12 0.02 3.15 5.08 -1.70 0.76 114.58 123.01 1xef h GLU 689 Ca -0.09 -0.13 -0.25 0.00 -1.00 0.00 0.00 59.36 57.88 1xef h GLU 689 Cb 1.55 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 30.59 1xef h GLU 689 CO 0.06 0.83 -1.04 -0.07 -1.00 0.00 0.00 179.01 177.79 1xef h LEU 690 N 1.12 0.72 -1.53 1.33 3.38 -1.23 -3.26 115.31 115.85 1xef h LEU 690 Ca 0.28 -0.60 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1xef h LEU 690 Cb 0.05 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1xef h LEU 690 CO -0.04 1.41 -0.13 0.25 0.09 0.00 0.00 178.44 180.01 1xef h LEU 691 N 0.29 0.00 -0.77 1.67 5.85 -1.12 -2.95 115.31 118.27 1xef h LEU 691 Ca -0.12 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.48 1xef h LEU 691 Cb 1.69 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.71 1xef h LEU 691 CO 0.19 0.13 -0.59 0.28 -0.34 0.00 0.00 178.44 178.11 1xef h SER 692 N 0.00 0.00 -2.55 1.25 0.02 -0.89 -3.44 113.55 107.94 1xef h SER 692 Ca -0.00 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.41 1xef h SER 692 Cb 0.53 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.09 1xef h SER 692 CO 0.02 0.59 1.11 -1.61 -1.14 0.00 0.00 176.83 175.80 1xef s GLU 693 N -3.60 4.17 0.40 3.45 0.41 -1.11 -4.91 118.70 117.50 1xef s GLU 693 Ca -0.01 2.41 0.16 0.00 -0.41 0.00 0.00 54.97 57.12 1xef s GLU 693 Cb 0.12 -3.88 0.83 0.00 -1.78 0.00 0.00 34.13 29.42 1xef s GLU 693 CO 0.75 -0.85 1.86 -1.35 -0.49 0.00 0.00 175.26 175.18 1xef h PRO 694 N 9.39 0.00 -0.03 0.39 0.11 -1.89 -3.28 132.00 136.70 1xef h PRO 694 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1xef h PRO 694 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1xef h PRO 694 CO 0.94 0.33 0.00 -0.85 -0.21 0.00 0.00 178.00 178.21 1xef n GLU 695 N -3.97 0.30 -1.38 1.05 0.28 -1.26 -4.96 120.64 110.70 1xef n GLU 695 Ca -0.02 -1.03 -0.32 0.00 -0.16 0.00 0.00 57.16 55.63 1xef n GLU 695 Cb 0.39 -1.15 0.09 0.00 1.43 0.00 0.00 31.44 32.20 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 -0.67 4.41 0.14 -1.84 1.04 -1.24 -4.96 113.70 110.59 1xef s SER 696 Ca 0.10 2.04 -0.03 0.00 0.48 0.00 0.00 55.95 58.53 1xef s SER 696 Cb 0.07 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.59 1xef s SER 696 CO 0.10 -2.10 1.35 0.25 0.98 0.00 0.00 173.24 173.81 1xef h LEU 697 N -0.68 0.52 -0.30 2.42 5.85 -1.93 -2.95 115.31 118.24 1xef h LEU 697 Ca -0.45 -0.39 0.04 0.00 0.84 0.00 0.00 57.88 57.91 1xef h LEU 697 Cb 1.25 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1xef h LEU 697 CO 0.50 1.17 0.08 0.22 -0.34 0.00 0.00 178.44 180.08 1xef h TYR 698 N 0.25 0.15 -0.63 1.25 3.20 -1.93 0.13 116.97 119.39 1xef h TYR 698 Ca -0.06 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 1xef h TYR 698 Cb 1.48 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 39.69 1xef h TYR 698 CO 0.05 0.05 0.37 0.77 -1.64 0.00 0.00 178.16 177.77 1xef h SER 699 N 0.20 0.77 -0.72 -2.11 0.02 -1.75 -0.70 113.55 109.25 1xef h SER 699 Ca 0.14 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1xef h SER 699 Cb 0.12 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1xef h SER 699 CO -0.16 0.61 0.41 0.22 -1.14 0.00 0.00 176.83 176.78 1xef h TYR 700 N 0.85 0.98 -0.12 3.45 3.20 -1.27 -1.13 116.97 122.93 1xef h TYR 700 Ca 0.22 -0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.94 1xef h TYR 700 Cb -0.00 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 37.94 1xef h TYR 700 CO -0.02 0.68 -0.54 -0.07 -1.64 0.00 0.00 178.16 176.57 1xef h LEU 701 N 0.99 0.38 -0.29 2.82 3.38 -0.45 -2.89 115.31 119.25 1xef h LEU 701 Ca 0.26 -0.20 -0.17 0.00 0.09 0.00 0.00 57.88 57.85 1xef h LEU 701 Cb 0.01 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1xef h LEU 701 CO -0.04 0.85 -0.50 0.22 0.09 0.00 0.00 178.44 179.05 1xef h TYR 702 N 0.26 1.06 0.00 1.13 3.20 -0.95 -3.03 116.97 118.63 1xef h TYR 702 Ca 0.01 -0.37 0.00 0.00 3.14 0.00 0.00 58.73 61.50 1xef h TYR 702 Cb 1.04 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.10 1xef h TYR 702 CO 0.03 1.19 0.00 1.96 -1.64 0.00 0.00 178.16 179.70 1xef h GLN 703 N 0.62 0.00 0.00 1.82 1.08 -1.16 0.07 115.11 117.54 1xef h GLN 703 Ca 0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1xef h GLN 703 Cb 1.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 1xef h GLN 703 CO 0.11 0.00 0.00 1.28 -0.95 0.00 0.00 178.83 179.27 1xef n LEU 704 N -3.06 0.59 -0.02 1.46 4.77 -1.10 -2.92 117.00 116.72 1xef n LEU 704 Ca -0.02 0.58 -0.07 0.00 -0.03 0.00 0.00 56.01 56.47 1xef n LEU 704 Cb 0.16 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 40.79 1xef n LEU 704 CO 0.23 -0.22 0.20 -0.61 -1.33 0.00 0.00 177.39 175.66 1xef h GLN 705 N 0.00 -0.07 0.00 3.23 4.15 -1.03 -3.38 115.11 118.02 1xef h GLN 705 Ca 0.00 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.30 1xef h GLN 705 Cb 0.60 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.29 1xef h GLN 705 CO 0.00 0.33 -0.58 0.66 -1.93 0.00 0.00 178.83 177.30 1xef h SER 706 N -0.98 0.00 0.00 -0.69 4.64 -1.67 -3.53 113.55 111.32 1xef h SER 706 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1xef h SER 706 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1xef h SER 706 CO 0.01 0.58 0.00 -0.67 -0.87 0.00 0.00 176.83 175.89