#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpy s SER 530 N 0.00 -0.40 0.11 1.61 0.01 -1.26 -5.19 113.70 108.59 2cpy s SER 530 Ca 0.00 -0.31 -0.07 0.00 1.31 0.00 0.00 55.95 56.88 2cpy s SER 530 Cb 0.00 0.65 -0.01 0.00 0.21 0.00 0.00 66.02 66.87 2cpy s SER 530 CO 0.00 -1.14 0.18 -0.55 0.41 0.00 0.00 173.24 172.14 2cpy s SER 531 N -2.83 0.16 0.00 2.44 0.15 -1.26 -5.13 113.70 107.24 2cpy s SER 531 Ca 0.06 -0.84 0.00 0.00 0.70 0.00 0.00 55.95 55.87 2cpy s SER 531 Cb -0.03 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 2cpy s SER 531 CO -0.03 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.26 2cpy n GLY 532 N -0.10 0.85 3.46 9.45 0.00 -1.26 -5.18 105.19 112.41 2cpy n GLY 532 Ca -0.11 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 2cpy n GLY 532 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cpy s SER 533 N 1.19 -0.10 0.01 1.61 1.04 -1.26 -5.12 113.70 111.08 2cpy s SER 533 Ca 0.00 -0.74 -0.29 0.00 0.48 0.00 0.00 55.95 55.40 2cpy s SER 533 Cb 0.00 0.52 -0.15 0.00 0.10 0.00 0.00 66.02 66.50 2cpy s SER 533 CO 0.00 -1.01 0.75 -1.54 0.98 0.00 0.00 173.24 172.43 2cpy n SER 534 N -0.30 -0.08 0.00 7.02 3.41 -1.26 -4.89 113.62 117.52 2cpy n SER 534 Ca -0.07 0.85 0.00 0.00 -0.26 0.00 0.00 58.87 59.39 2cpy n SER 534 Cb 0.62 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 2cpy n SER 534 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cpy n GLY 535 N 1.13 0.54 0.90 5.00 0.00 -1.25 -5.06 105.19 106.44 2cpy n GLY 535 Ca 0.15 -0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 2cpy n GLY 535 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cpy n GLU 536 N 0.00 0.08 0.00 1.61 -0.58 -1.26 -4.99 120.64 115.50 2cpy n GLU 536 Ca 0.00 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.77 2cpy n GLU 536 Cb 0.00 -0.62 0.00 0.00 -0.57 0.00 0.00 31.44 30.25 2cpy n GLU 536 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2cpy n GLY 537 N 3.18 -2.03 3.72 0.62 0.00 -1.26 -4.69 105.19 104.73 2cpy n GLY 537 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2cpy n GLY 537 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2cpy s ASP 538 N -2.05 6.49 -0.32 1.61 -4.77 -1.26 -4.98 116.67 111.39 2cpy s ASP 538 Ca 0.00 2.73 0.01 0.00 -3.30 0.00 0.00 52.55 51.99 2cpy s ASP 538 Cb 0.00 -2.60 0.10 0.00 -1.09 0.00 0.00 42.92 39.33 2cpy s ASP 538 CO 0.00 -0.89 0.08 -0.69 0.70 0.00 0.00 175.17 174.37 2cpy s VAL 539 N 1.17 1.41 -0.02 2.11 1.01 -1.26 -3.77 120.40 121.04 2cpy s VAL 539 Ca 0.72 -1.77 0.02 0.00 0.00 0.00 0.00 61.98 60.96 2cpy s VAL 539 Cb -0.46 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 33.86 2cpy s VAL 539 CO 0.32 -0.65 -0.07 0.21 0.00 0.00 0.00 175.10 174.91 2cpy s ASN 540 N 1.34 0.98 -1.39 3.32 2.47 -1.26 -4.84 114.94 115.56 2cpy s ASN 540 Ca 0.10 -0.15 -0.01 0.00 0.42 0.00 0.00 52.86 53.22 2cpy s ASN 540 Cb -0.18 -0.26 -0.00 0.00 -1.45 0.00 0.00 41.25 39.36 2cpy s ASN 540 CO -0.19 0.05 0.44 -1.20 -3.72 0.00 0.00 177.10 172.48 2cpy n SER 541 N 3.31 -0.57 -4.64 -4.21 7.64 -1.26 -4.71 113.62 109.18 2cpy n SER 541 Ca -0.18 -1.01 -0.40 0.00 1.01 0.00 0.00 58.87 58.30 2cpy n SER 541 Cb 0.55 -3.08 -0.07 0.00 -1.01 0.00 0.00 64.21 60.60 2cpy n SER 541 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cpy s ALA 542 N -3.93 3.57 -0.64 -0.43 0.00 -1.26 -4.96 121.76 114.10 2cpy s ALA 542 Ca 0.03 -0.45 -0.26 0.00 0.00 0.00 0.00 51.96 51.28 2cpy s ALA 542 Cb -0.01 -2.90 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 2cpy s ALA 542 CO 0.89 -0.61 2.06 0.15 0.00 0.00 0.00 175.76 178.25 2cpy s LYS 543 N 2.02 2.39 -0.18 0.00 3.01 -1.26 -4.28 119.74 121.44 2cpy s LYS 543 Ca 0.24 0.66 0.13 0.00 -1.01 0.00 0.00 55.97 55.99 2cpy s LYS 543 Cb -0.16 -4.58 0.41 0.00 -1.01 0.00 0.00 37.83 32.49 2cpy s LYS 543 CO 0.09 -3.12 1.21 1.33 0.51 0.00 0.00 175.35 175.37 2cpy n VAL 544 N 7.65 1.96 -3.76 3.17 0.24 -1.17 -4.41 118.33 122.01 2cpy n VAL 544 Ca 0.30 -2.94 -0.13 0.00 -2.04 0.00 0.00 64.34 59.53 2cpy n VAL 544 Cb 0.51 -0.12 -0.11 0.00 -1.47 0.00 0.00 33.84 32.65 2cpy n VAL 544 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2cpy s ALA 546 N 0.25 1.62 -0.17 0.00 0.00 0.39 -0.25 121.76 123.61 2cpy s ALA 546 Ca -0.01 -0.66 -0.08 0.00 0.00 0.00 0.00 51.96 51.21 2cpy s ALA 546 Cb -0.03 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 2cpy s ALA 546 CO -0.00 0.05 0.12 -1.58 0.00 0.00 0.00 175.76 174.34 2cpy s HIS 547 N 0.77 3.44 -0.24 0.00 5.04 -0.25 -0.84 115.29 123.20 2cpy s HIS 547 Ca -0.11 0.35 -0.03 0.00 -1.54 0.00 0.00 55.06 53.73 2cpy s HIS 547 Cb -0.16 -2.06 0.01 0.00 0.04 0.00 0.00 32.58 30.42 2cpy s HIS 547 CO 0.02 0.42 -0.05 0.42 -2.34 0.00 0.00 174.74 173.22 2cpy s ILE 548 N -0.14 3.09 0.34 0.89 1.01 0.51 -0.62 121.20 126.28 2cpy s ILE 548 Ca 0.10 -0.84 0.06 0.00 0.00 0.00 0.00 60.65 59.97 2cpy s ILE 548 Cb -0.12 -2.52 -0.07 0.00 0.01 0.00 0.00 42.46 39.77 2cpy s ILE 548 CO 0.00 0.26 -0.01 0.42 0.00 0.00 0.00 174.94 175.62 2cpy s THR 549 N 1.38 1.68 -0.65 2.92 -4.23 -0.88 -1.27 115.64 114.60 2cpy s THR 549 Ca 0.02 -2.06 -0.02 0.00 -1.18 0.00 0.00 61.69 58.46 2cpy s THR 549 Cb -0.16 -2.75 0.00 0.00 1.34 0.00 0.00 72.50 70.94 2cpy s THR 549 CO -0.04 -0.11 0.55 -3.20 -0.54 0.00 0.00 174.62 171.29 2cpy n ASN 550 N -0.76 -2.81 -4.20 3.99 2.85 -1.22 -1.78 115.26 111.34 2cpy n ASN 550 Ca -0.04 -0.31 -0.24 0.00 -0.11 0.00 0.00 54.58 53.88 2cpy n ASN 550 Cb 0.65 -2.89 -0.14 0.00 1.24 0.00 0.00 39.78 38.64 2cpy n ASN 550 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 2cpy s ILE 551 N -3.18 1.45 0.11 -1.44 -4.36 -1.20 -4.16 121.20 108.42 2cpy s ILE 551 Ca 0.11 -1.01 -0.36 0.00 -0.26 0.00 0.00 60.65 59.13 2cpy s ILE 551 Cb -0.05 -1.25 -0.17 0.00 1.25 0.00 0.00 42.46 42.24 2cpy s ILE 551 CO 0.38 0.22 1.21 -2.65 0.24 0.00 0.00 174.94 174.34 2cpy n PRO 552 N 2.11 0.94 -0.53 0.37 -0.02 -1.26 -4.48 135.00 132.13 2cpy n PRO 552 Ca -0.17 0.34 -0.10 0.00 -2.02 0.00 0.00 63.50 61.55 2cpy n PRO 552 Cb 0.54 -1.88 0.06 0.00 -0.02 0.00 0.00 33.50 32.19 2cpy n PRO 552 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2cpy n PHE 553 N 1.93 1.16 -0.04 6.00 1.16 -1.26 -3.70 117.46 122.70 2cpy n PHE 553 Ca 0.17 -1.16 -0.04 0.00 -1.87 0.00 0.00 57.45 54.55 2cpy n PHE 553 Cb 0.19 -0.58 -0.06 0.00 -1.61 0.00 0.00 39.48 37.42 2cpy n PHE 553 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 2cpy n SER 554 N 0.02 3.08 -4.63 5.98 2.88 -1.26 -4.91 113.62 114.79 2cpy n SER 554 Ca 0.23 -0.01 -0.29 0.00 -1.33 0.00 0.00 58.87 57.47 2cpy n SER 554 Cb 0.87 0.54 0.17 0.00 -0.75 0.00 0.00 64.21 65.04 2cpy n SER 554 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2cpy s ILE 555 N -2.19 1.97 0.29 2.46 -4.36 -1.24 -5.08 121.20 113.04 2cpy s ILE 555 Ca -0.06 0.00 0.06 0.00 -0.26 0.00 0.00 60.65 60.40 2cpy s ILE 555 Cb 0.03 -2.56 -0.06 0.00 1.25 0.00 0.00 42.46 41.11 2cpy s ILE 555 CO 0.31 0.00 -0.05 0.42 0.24 0.00 0.00 174.94 175.86 2cpy s THR 556 N -3.06 1.63 0.25 8.37 -4.23 -1.26 -4.99 115.64 112.35 2cpy s THR 556 Ca 0.66 -2.12 -0.00 0.00 -1.18 0.00 0.00 61.69 59.05 2cpy s THR 556 Cb -0.17 -2.48 0.36 0.00 1.34 0.00 0.00 72.50 71.55 2cpy s THR 556 CO 0.56 -0.27 1.31 1.17 -0.54 0.00 0.00 174.62 176.84 2cpy n LYS 557 N -0.60 -0.07 -0.23 3.99 4.81 -1.26 0.14 118.16 124.94 2cpy n LYS 557 Ca -0.05 1.26 0.04 0.00 -0.87 0.00 0.00 58.31 58.68 2cpy n LYS 557 Cb 0.64 -1.98 0.14 0.00 0.02 0.00 0.00 35.03 33.85 2cpy n LYS 557 CO 0.00 0.00 0.00 1.98 1.17 0.00 0.00 177.40 180.55 2cpy h MET 558 N 0.00 0.17 -0.27 1.64 4.05 -1.99 -0.34 114.93 118.19 2cpy h MET 558 Ca 0.48 -0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.93 2cpy h MET 558 Cb 0.94 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.67 2cpy h MET 558 CO -0.80 0.11 0.05 -0.44 0.23 0.00 0.00 176.91 176.06 2cpy h ASP 559 N 0.18 0.00 0.21 1.39 3.32 0.89 -2.27 116.42 120.14 2cpy h ASP 559 Ca 0.37 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.48 2cpy h ASP 559 Cb 0.63 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.22 2cpy h ASP 559 CO -0.54 0.03 -0.27 0.58 -1.72 0.00 0.00 179.24 177.32 2cpy h VAL 560 N 0.15 0.42 -0.99 -1.35 2.07 -0.91 -1.42 116.25 114.22 2cpy h VAL 560 Ca 0.12 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.91 2cpy h VAL 560 Cb 0.13 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 2cpy h VAL 560 CO -0.17 0.00 0.68 -0.07 0.02 0.00 0.00 177.57 178.03 2cpy h LEU 561 N -0.54 0.21 -0.62 2.57 3.38 -1.01 0.68 115.31 119.98 2cpy h LEU 561 Ca 0.01 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 2cpy h LEU 561 Cb 0.52 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2cpy h LEU 561 CO -0.10 0.06 -0.61 -0.61 0.09 0.00 0.00 178.44 177.28 2cpy h GLN 562 N 0.19 0.00 0.00 1.13 4.15 -0.69 -3.05 115.11 116.84 2cpy h GLN 562 Ca 0.51 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.81 2cpy h GLN 562 Cb 1.64 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 29.31 2cpy h GLN 562 CO -0.12 0.61 -0.55 0.35 -1.93 0.00 0.00 178.83 177.19 2cpy h PHE 563 N 0.00 0.00 -0.41 3.99 3.57 0.11 -2.99 116.94 121.21 2cpy h PHE 563 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2cpy h PHE 563 Cb 1.18 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.92 2cpy h PHE 563 CO 0.00 0.55 0.00 1.28 -2.23 0.00 0.00 178.31 177.91 2cpy n LEU 564 N -3.47 4.10 -4.69 0.59 4.77 -0.73 -4.97 117.00 112.60 2cpy n LEU 564 Ca 0.00 -2.08 -0.44 0.00 -0.03 0.00 0.00 56.01 53.47 2cpy n LEU 564 Cb 0.65 -0.60 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2cpy n LEU 564 CO 0.40 0.53 1.05 1.21 -1.33 0.00 0.00 177.39 179.25 2cpy n GLU 565 N 0.50 2.19 0.00 3.23 2.13 -1.13 -2.15 120.64 125.40 2cpy n GLU 565 Ca 0.19 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.79 2cpy n GLU 565 Cb 0.85 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 30.11 2cpy n GLU 565 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2cpy n GLY 566 N 1.94 3.09 3.28 8.31 0.00 -1.26 -5.03 105.19 115.51 2cpy n GLY 566 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2cpy n GLY 566 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cpy s ILE 567 N -2.74 4.39 -0.43 -0.61 1.01 -0.91 -5.03 121.20 116.88 2cpy s ILE 567 Ca 0.00 -1.43 -0.38 0.00 0.00 0.00 0.00 60.65 58.83 2cpy s ILE 567 Cb 0.00 -3.72 -0.15 0.00 0.01 0.00 0.00 42.46 38.60 2cpy s ILE 567 CO 0.00 -0.58 2.19 -2.65 0.00 0.00 0.00 174.94 173.90 2cpy n PRO 568 N 4.97 0.61 -3.64 2.79 -0.02 -1.26 -4.90 135.00 133.55 2cpy n PRO 568 Ca -0.10 0.16 -0.10 0.00 -2.02 0.00 0.00 63.50 61.44 2cpy n PRO 568 Cb 0.42 -2.06 -0.07 0.00 -0.02 0.00 0.00 33.50 31.77 2cpy n PRO 568 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2cpy s VAL 569 N 6.92 0.00 0.75 -1.45 0.11 -1.26 -4.95 120.40 120.51 2cpy s VAL 569 Ca 1.14 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 60.07 2cpy s VAL 569 Cb -1.11 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 32.78 2cpy s VAL 569 CO 0.55 0.00 1.13 -1.81 -3.33 0.00 0.00 175.10 171.64 2cpy s ASP 570 N 0.84 4.41 0.15 3.54 1.01 -1.26 -4.95 116.67 120.41 2cpy s ASP 570 Ca -0.03 2.04 -0.15 0.00 0.71 0.00 0.00 52.55 55.12 2cpy s ASP 570 Cb -0.05 -2.55 0.02 0.00 1.01 0.00 0.00 42.92 41.35 2cpy s ASP 570 CO -0.08 -2.10 1.72 -0.33 0.21 0.00 0.00 175.17 174.59 2cpy h GLU 571 N -0.68 0.65 -0.51 8.23 5.08 -2.00 -2.59 114.58 122.77 2cpy h GLU 571 Ca -0.45 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 57.80 2cpy h GLU 571 Cb 1.25 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.36 2cpy h GLU 571 CO 0.50 0.56 0.29 -0.91 -1.00 0.00 0.00 179.01 178.46 2cpy h ASN 572 N 0.58 0.61 -0.25 1.42 2.35 -2.00 -2.06 115.58 116.23 2cpy h ASN 572 Ca 0.15 -0.04 0.07 0.00 -0.55 0.00 0.00 56.30 55.94 2cpy h ASN 572 Cb 0.13 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 2cpy h ASN 572 CO -0.02 0.49 0.79 0.00 -1.65 0.00 0.00 177.43 177.04 2cpy h ALA 573 N 1.62 2.02 -2.89 -0.83 0.00 -1.75 -3.35 119.26 114.08 2cpy h ALA 573 Ca 0.18 -0.01 -0.65 0.00 0.00 0.00 0.00 54.91 54.44 2cpy h ALA 573 Cb -0.00 0.02 -0.18 0.00 0.00 0.00 0.00 17.79 17.62 2cpy h ALA 573 CO -0.03 -0.92 -0.54 0.08 0.00 0.00 0.00 179.25 177.84 2cpy s VAL 574 N -4.18 5.09 -0.41 0.00 1.01 -0.78 0.08 120.40 121.22 2cpy s VAL 574 Ca -0.02 0.03 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 2cpy s VAL 574 Cb 0.07 -3.45 0.09 0.00 0.00 0.00 0.00 36.38 33.09 2cpy s VAL 574 CO 0.23 0.23 0.22 -1.00 0.00 0.00 0.00 175.10 174.78 2cpy s HIS 575 N 1.72 3.42 0.13 5.22 0.09 0.17 -4.94 115.29 121.11 2cpy s HIS 575 Ca 0.07 -1.92 -0.30 0.00 -0.00 0.00 0.00 55.06 52.91 2cpy s HIS 575 Cb -0.16 -3.00 -0.06 0.00 -0.00 0.00 0.00 32.58 29.36 2cpy s HIS 575 CO 0.09 -0.90 0.98 0.08 -0.00 0.00 0.00 174.74 174.99 2cpy s VAL 576 N 1.30 4.38 0.67 -0.90 1.01 -1.26 -0.87 120.40 124.73 2cpy s VAL 576 Ca 0.04 2.02 -0.12 0.00 0.00 0.00 0.00 61.98 63.92 2cpy s VAL 576 Cb -0.23 -4.29 -0.00 0.00 0.00 0.00 0.00 36.38 31.86 2cpy s VAL 576 CO -0.01 0.33 1.06 -0.76 0.00 0.00 0.00 175.10 175.72 2cpy s LEU 577 N -0.16 3.22 0.03 3.92 1.43 -0.85 -4.97 118.68 121.29 2cpy s LEU 577 Ca 0.47 1.67 -0.12 0.00 -1.03 0.00 0.00 54.13 55.12 2cpy s LEU 577 Cb -0.24 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.48 2cpy s LEU 577 CO 0.31 -1.40 0.25 0.68 0.23 0.00 0.00 176.35 176.42 2cpy s VAL 578 N -2.90 0.09 0.36 -1.59 -7.23 -1.26 -4.43 120.40 103.43 2cpy s VAL 578 Ca 0.59 -0.71 0.01 0.00 -1.81 0.00 0.00 61.98 60.06 2cpy s VAL 578 Cb -0.15 -0.82 0.01 0.00 0.56 0.00 0.00 36.38 35.99 2cpy s VAL 578 CO 0.51 -0.39 0.10 -0.67 -0.31 0.00 0.00 175.10 174.33 2cpy n ASP 579 N 0.84 2.69 -0.31 4.85 2.03 -1.25 -4.74 116.55 120.65 2cpy n ASP 579 Ca -0.20 -2.44 0.16 0.00 0.52 0.00 0.00 54.79 52.84 2cpy n ASP 579 Cb 0.58 0.15 0.35 0.00 -0.72 0.00 0.00 41.12 41.48 2cpy n ASP 579 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2cpy h ASN 580 N 0.70 0.29 1.85 1.67 2.35 -2.02 0.94 115.58 121.36 2cpy h ASN 580 Ca -0.27 0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2cpy h ASN 580 Cb 0.87 0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.41 2cpy h ASN 580 CO 0.44 -0.09 -0.14 0.78 -1.65 0.00 0.00 177.43 176.77 2cpy h ASN 581 N 0.33 0.00 0.00 5.81 2.35 -1.99 -3.48 115.58 118.60 2cpy h ASN 581 Ca 0.61 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.36 2cpy h ASN 581 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 2cpy h ASN 581 CO -0.59 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 175.80 2cpy n GLY 582 N 1.11 2.93 0.32 2.83 0.00 0.33 -4.90 105.19 107.80 2cpy n GLY 582 Ca 0.03 -0.08 0.19 0.00 0.00 0.00 0.00 46.02 46.16 2cpy n GLY 582 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2cpy h GLN 583 N 0.00 0.22 0.00 1.61 3.07 -1.92 -3.34 115.11 114.75 2cpy h GLN 583 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.73 2cpy h GLN 583 Cb 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 27.51 2cpy h GLN 583 CO 0.00 0.15 0.00 0.41 0.09 0.00 0.00 178.83 179.48 2cpy n GLY 584 N -1.34 0.36 1.60 0.06 0.00 -1.26 -4.65 105.19 99.96 2cpy n GLY 584 Ca 0.27 -2.03 -0.02 0.00 0.00 0.00 0.00 46.02 44.24 2cpy n GLY 584 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cpy n LEU 585 N -0.16 5.26 -2.94 0.99 4.32 -1.26 -4.68 117.00 118.53 2cpy n LEU 585 Ca 0.00 -3.27 -0.13 0.00 -0.02 0.00 0.00 56.01 52.59 2cpy n LEU 585 Cb 0.00 -0.68 0.07 0.00 -1.62 0.00 0.00 43.42 41.19 2cpy n LEU 585 CO 0.00 0.85 0.08 0.61 -1.22 0.00 0.00 177.39 177.71 2cpy n GLY 586 N -0.40 -0.30 3.28 -0.72 0.00 -1.26 -4.88 105.19 100.91 2cpy n GLY 586 Ca 0.35 0.06 -0.14 0.00 0.00 0.00 0.00 46.02 46.30 2cpy n GLY 586 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cpy s GLN 587 N -4.92 0.75 -0.09 1.61 -0.21 -1.26 -3.22 119.66 112.32 2cpy s GLN 587 Ca 0.06 -0.20 -0.13 0.00 0.02 0.00 0.00 55.36 55.12 2cpy s GLN 587 Cb -0.01 0.33 0.03 0.00 1.00 0.00 0.00 33.01 34.36 2cpy s GLN 587 CO 0.59 -0.22 0.32 0.00 -2.12 0.00 0.00 175.29 173.86 2cpy s ALA 588 N -1.56 -0.80 0.11 6.09 0.00 -0.40 -2.00 121.76 123.20 2cpy s ALA 588 Ca -0.12 0.73 0.05 0.00 0.00 0.00 0.00 51.96 52.63 2cpy s ALA 588 Cb -0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 2cpy s ALA 588 CO 0.03 -0.19 0.02 -0.51 0.00 0.00 0.00 175.76 175.12 2cpy s LEU 589 N -0.31 3.52 -0.03 0.00 1.43 -0.05 -0.36 118.68 122.88 2cpy s LEU 589 Ca -0.04 -0.19 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 2cpy s LEU 589 Cb -0.03 -2.22 0.01 0.00 0.03 0.00 0.00 46.19 43.98 2cpy s LEU 589 CO 0.02 0.15 -0.05 -0.69 0.23 0.00 0.00 176.35 176.00 2cpy s VAL 590 N -1.44 0.52 0.03 -1.59 1.01 -0.02 0.46 120.40 119.37 2cpy s VAL 590 Ca 0.27 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.14 2cpy s VAL 590 Cb -0.11 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 2cpy s VAL 590 CO 0.19 0.19 -0.22 -1.58 0.00 0.00 0.00 175.10 173.68 2cpy s GLN 591 N 0.44 1.99 0.36 2.72 0.74 0.11 -0.47 119.66 125.56 2cpy s GLN 591 Ca -0.06 -1.01 0.05 0.00 0.05 0.00 0.00 55.36 54.40 2cpy s GLN 591 Cb -0.09 -2.10 -0.07 0.00 1.10 0.00 0.00 33.01 31.84 2cpy s GLN 591 CO -0.00 0.54 0.04 -0.06 -0.55 0.00 0.00 175.29 175.25 2cpy s PHE 592 N -0.83 2.21 0.01 1.67 0.08 0.92 -4.74 117.98 117.29 2cpy s PHE 592 Ca 0.13 -0.83 -0.15 0.00 0.12 0.00 0.00 56.93 56.19 2cpy s PHE 592 Cb -0.10 -1.50 -0.35 0.00 -0.57 0.00 0.00 43.02 40.50 2cpy s PHE 592 CO 0.03 0.20 0.93 0.87 -0.10 0.00 0.00 175.22 177.15 2cpy h LYS 593 N 1.96 0.52 -3.92 0.44 1.57 -1.93 -3.46 116.57 111.74 2cpy h LYS 593 Ca -0.42 -0.88 -0.10 0.00 -1.87 0.00 0.00 60.65 57.38 2cpy h LYS 593 Cb 1.24 0.33 -0.14 0.00 0.08 0.00 0.00 32.23 33.74 2cpy h LYS 593 CO 0.75 1.42 -0.46 0.54 -0.57 0.00 0.00 179.45 181.13 2cpy s ASN 594 N -7.53 0.22 0.48 0.86 2.20 -1.26 -5.03 114.94 104.88 2cpy s ASN 594 Ca -0.11 -0.74 0.21 0.00 -0.94 0.00 0.00 52.86 51.28 2cpy s ASN 594 Cb 0.04 0.30 1.24 0.00 -2.00 0.00 0.00 41.25 40.83 2cpy s ASN 594 CO 0.93 -0.69 1.96 -0.33 -2.94 0.00 0.00 177.10 176.03 2cpy h GLU 595 N 2.89 0.18 -1.14 3.55 5.08 -1.93 -1.34 114.58 121.87 2cpy h GLU 595 Ca -0.34 -0.01 0.37 0.00 -1.00 0.00 0.00 59.36 58.38 2cpy h GLU 595 Cb 1.18 -0.04 -0.13 0.00 0.50 0.00 0.00 28.75 30.26 2cpy h GLU 595 CO 0.59 0.12 0.70 -0.44 -1.00 0.00 0.00 179.01 178.98 2cpy h ASP 596 N 0.19 0.38 0.34 1.42 5.19 -1.96 0.76 116.42 122.74 2cpy h ASP 596 Ca 0.31 0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.86 2cpy h ASP 596 Cb 0.95 0.12 -0.00 0.00 0.18 0.00 0.00 39.33 40.58 2cpy h ASP 596 CO -0.05 -0.14 -1.67 -0.67 -3.12 0.00 0.00 179.24 173.59 2cpy n ASP 597 N -4.84 0.30 0.13 6.45 2.03 -0.53 -4.31 116.55 115.78 2cpy n ASP 597 Ca 0.33 0.12 -0.11 0.00 0.52 0.00 0.00 54.79 55.65 2cpy n ASP 597 Cb 1.17 1.42 -0.07 0.00 -0.72 0.00 0.00 41.12 42.92 2cpy n ASP 597 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cpy h ALA 598 N 1.96 -0.39 0.00 -1.67 0.00 0.64 -3.05 119.26 116.75 2cpy h ALA 598 Ca -0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2cpy h ALA 598 Cb 1.05 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2cpy h ALA 598 CO 0.00 -0.44 0.36 0.00 0.00 0.00 0.00 179.25 179.16 2cpy h ARG 599 N -0.93 0.00 0.02 0.00 3.08 -0.93 0.88 114.38 116.49 2cpy h ARG 599 Ca -0.04 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.87 2cpy h ARG 599 Cb 0.50 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.57 2cpy h ARG 599 CO 0.06 0.00 -0.56 0.87 -1.07 0.00 0.00 179.97 179.27 2cpy h LYS 600 N 0.00 0.36 -0.32 0.04 1.57 -1.72 -3.23 116.57 113.26 2cpy h LYS 600 Ca 0.00 -0.40 0.09 0.00 -1.87 0.00 0.00 60.65 58.47 2cpy h LYS 600 Cb 0.71 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 2cpy h LYS 600 CO 0.00 1.09 0.25 0.66 -0.57 0.00 0.00 179.45 180.88 2cpy h SER 601 N -0.21 0.00 0.33 0.86 4.64 -0.75 0.87 113.55 119.30 2cpy h SER 601 Ca -0.07 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.16 2cpy h SER 601 Cb 1.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 2cpy h SER 601 CO 0.11 0.00 -0.38 1.05 -0.87 0.00 0.00 176.83 176.74 2cpy h GLU 602 N 0.00 0.07 0.00 4.77 -0.00 -1.55 -2.37 114.58 115.50 2cpy h GLU 602 Ca 0.15 -0.03 0.00 0.00 -0.00 0.00 0.00 59.36 59.49 2cpy h GLU 602 Cb 0.66 -0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.41 2cpy h GLU 602 CO -0.00 0.44 0.00 -2.13 -0.00 0.00 0.00 179.01 177.32 2cpy n ARG 603 N -4.07 0.02 -0.76 1.06 3.00 0.30 -0.68 116.66 115.52 2cpy n ARG 603 Ca -0.02 0.47 0.08 0.00 -0.00 0.00 0.00 57.85 58.38 2cpy n ARG 603 Cb 0.43 -1.55 0.38 0.00 0.00 0.00 0.00 32.46 31.72 2cpy n ARG 603 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2cpy n LEU 604 N -1.58 5.25 -4.75 6.15 4.77 -0.89 -4.99 117.00 120.96 2cpy n LEU 604 Ca 0.00 -2.76 -0.35 0.00 -0.03 0.00 0.00 56.01 52.87 2cpy n LEU 604 Cb 0.03 -0.63 0.05 0.00 -2.33 0.00 0.00 43.42 40.54 2cpy n LEU 604 CO 0.03 0.70 0.81 -2.28 -1.33 0.00 0.00 177.39 175.33 2cpy s HIS 605 N -2.44 2.35 -1.49 -1.77 2.46 0.14 -2.97 115.29 111.58 2cpy s HIS 605 Ca 0.52 1.54 -0.13 0.00 0.47 0.00 0.00 55.06 57.47 2cpy s HIS 605 Cb 0.38 -3.42 0.09 0.00 -0.13 0.00 0.00 32.58 29.50 2cpy s HIS 605 CO 0.18 -2.20 0.76 0.54 -2.47 0.00 0.00 174.74 171.56 2cpy n ARG 606 N -1.99 -4.30 -2.05 2.88 1.74 -1.01 -4.95 116.66 106.98 2cpy n ARG 606 Ca 0.13 0.53 -0.28 0.00 -0.77 0.00 0.00 57.85 57.46 2cpy n ARG 606 Cb 0.50 -5.33 0.09 0.00 -1.02 0.00 0.00 32.46 26.71 2cpy n ARG 606 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2cpy s LYS 607 N -6.44 1.92 -0.39 5.56 -0.14 -1.15 -4.76 119.74 114.34 2cpy s LYS 607 Ca 0.58 -0.13 -0.01 0.00 -1.36 0.00 0.00 55.97 55.04 2cpy s LYS 607 Cb -0.30 -2.04 0.11 0.00 -1.68 0.00 0.00 37.83 33.91 2cpy s LYS 607 CO 0.72 -1.52 0.16 0.15 -0.76 0.00 0.00 175.35 174.09 2cpy s LYS 608 N -5.46 1.90 -0.37 1.68 1.02 -1.26 -0.27 119.74 116.98 2cpy s LYS 608 Ca 0.63 -1.81 -0.13 0.00 0.02 0.00 0.00 55.97 54.68 2cpy s LYS 608 Cb -0.10 -3.48 0.01 0.00 -0.52 0.00 0.00 37.83 33.74 2cpy s LYS 608 CO 0.47 -1.02 0.24 -1.17 -0.92 0.00 0.00 175.35 172.95 2cpy s LEU 609 N 1.09 4.70 -1.72 3.17 0.20 0.10 -4.37 118.68 121.85 2cpy s LEU 609 Ca 0.08 -0.74 0.00 0.00 0.69 0.00 0.00 54.13 54.16 2cpy s LEU 609 Cb -0.22 -2.09 0.00 0.00 -0.43 0.00 0.00 46.19 43.45 2cpy s LEU 609 CO -0.05 -0.34 0.00 -3.20 -0.29 0.00 0.00 176.35 172.47 2cpy n ASN 610 N 5.08 -5.43 0.00 3.68 2.85 -1.26 -1.34 115.26 118.83 2cpy n ASN 610 Ca -0.12 0.10 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 2cpy n ASN 610 Cb 0.48 -4.51 0.00 0.00 1.24 0.00 0.00 39.78 36.99 2cpy n ASN 610 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2cpy n GLY 611 N -0.93 0.59 3.17 8.20 0.00 -1.26 -5.05 105.19 109.91 2cpy n GLY 611 Ca -0.22 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.10 2cpy n GLY 611 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cpy s ARG 612 N -0.88 2.30 -0.28 1.61 1.81 -0.45 -5.09 118.95 117.98 2cpy s ARG 612 Ca 0.00 -0.72 -0.29 0.00 -1.72 0.00 0.00 55.73 53.00 2cpy s ARG 612 Cb 0.00 -1.88 -0.01 0.00 -0.45 0.00 0.00 34.95 32.61 2cpy s ARG 612 CO 0.00 0.22 1.51 -1.21 -0.68 0.00 0.00 175.30 175.14 2cpy s GLU 613 N 0.17 3.77 0.23 3.54 0.41 -1.26 0.01 118.70 125.58 2cpy s GLU 613 Ca -0.10 1.43 0.01 0.00 -0.41 0.00 0.00 54.97 55.90 2cpy s GLU 613 Cb -0.15 -4.00 -0.04 0.00 -1.78 0.00 0.00 34.13 28.17 2cpy s GLU 613 CO 0.05 -1.32 0.40 0.00 -0.49 0.00 0.00 175.26 173.90 2cpy s ALA 614 N 5.10 3.85 -0.18 5.21 0.00 0.63 -4.77 121.76 131.60 2cpy s ALA 614 Ca 0.66 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.69 2cpy s ALA 614 Cb -0.21 -1.94 0.03 0.00 0.00 0.00 0.00 23.12 21.01 2cpy s ALA 614 CO 0.28 0.34 -0.14 -0.06 0.00 0.00 0.00 175.76 176.18 2cpy s PHE 615 N -1.95 2.45 -0.30 0.00 0.08 -0.73 -2.42 117.98 115.11 2cpy s PHE 615 Ca 0.37 -1.51 -0.12 0.00 0.12 0.00 0.00 56.93 55.79 2cpy s PHE 615 Cb -0.10 -1.70 -0.04 0.00 -0.57 0.00 0.00 43.02 40.61 2cpy s PHE 615 CO 0.30 -0.74 0.21 0.08 -0.10 0.00 0.00 175.22 174.97 2cpy s VAL 616 N 1.39 5.28 -0.31 -0.44 1.01 -1.26 -2.06 120.40 124.02 2cpy s VAL 616 Ca 0.02 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.94 2cpy s VAL 616 Cb -0.15 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 32.65 2cpy s VAL 616 CO -0.10 0.15 0.11 -1.00 0.00 0.00 0.00 175.10 174.26 2cpy s HIS 617 N 1.74 3.17 -0.62 5.22 3.76 0.21 -4.84 115.29 123.93 2cpy s HIS 617 Ca 0.07 -0.91 -0.28 0.00 -0.15 0.00 0.00 55.06 53.79 2cpy s HIS 617 Cb -0.17 -2.29 0.03 0.00 1.11 0.00 0.00 32.58 31.26 2cpy s HIS 617 CO 0.11 -0.56 1.21 0.08 -0.85 0.00 0.00 174.74 174.73 2cpy s VAL 618 N 1.52 3.94 0.44 -0.90 1.01 -1.26 -1.09 120.40 124.07 2cpy s VAL 618 Ca 0.03 0.75 0.04 0.00 0.00 0.00 0.00 61.98 62.80 2cpy s VAL 618 Cb -0.17 -4.78 -0.05 0.00 0.00 0.00 0.00 36.38 31.38 2cpy s VAL 618 CO 0.04 -1.48 0.02 0.68 0.00 0.00 0.00 175.10 174.36 2cpy s VAL 619 N 5.15 1.45 0.25 2.92 -7.23 0.66 -4.98 120.40 118.62 2cpy s VAL 619 Ca 0.40 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.48 2cpy s VAL 619 Cb -0.08 -2.59 -0.07 0.00 0.56 0.00 0.00 36.38 34.20 2cpy s VAL 619 CO 0.22 0.00 0.57 0.42 -0.31 0.00 0.00 175.10 176.01 2cpy s THR 620 N -2.89 4.92 0.29 5.32 -4.23 -1.26 -1.68 115.64 116.10 2cpy s THR 620 Ca 0.23 0.46 -0.01 0.00 -1.18 0.00 0.00 61.69 61.19 2cpy s THR 620 Cb 0.06 -3.64 0.39 0.00 1.34 0.00 0.00 72.50 70.66 2cpy s THR 620 CO 0.12 -0.14 1.58 0.25 -0.54 0.00 0.00 174.62 175.89 2cpy h LEU 621 N 2.34 -0.51 -0.34 4.79 5.85 -1.86 0.50 115.31 126.08 2cpy h LEU 621 Ca -0.47 0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.57 2cpy h LEU 621 Cb 1.17 0.48 -0.05 0.00 0.37 0.00 0.00 40.66 42.63 2cpy h LEU 621 CO 0.68 -0.32 0.06 -0.08 -0.34 0.00 0.00 178.44 178.45 2cpy h GLU 622 N 0.03 0.17 0.00 1.25 4.81 -1.93 0.21 114.58 119.12 2cpy h GLU 622 Ca 0.55 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.75 2cpy h GLU 622 Cb 1.06 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 2cpy h GLU 622 CO -0.89 0.11 -0.07 -0.44 -0.73 0.00 0.00 179.01 177.00 2cpy h ASP 623 N 0.17 0.00 0.06 1.04 5.19 -0.49 -2.96 116.42 119.44 2cpy h ASP 623 Ca 0.16 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.47 2cpy h ASP 623 Cb 0.18 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.70 2cpy h ASP 623 CO -0.22 0.07 -0.47 -0.03 -3.12 0.00 0.00 179.24 175.47 2cpy h MET 624 N 0.00 0.14 -0.97 3.56 4.05 0.93 -3.24 114.93 119.40 2cpy h MET 624 Ca -0.00 -0.23 0.23 0.00 -0.28 0.00 0.00 59.70 59.42 2cpy h MET 624 Cb 0.37 0.09 -0.08 0.00 -0.80 0.00 0.00 31.60 31.18 2cpy h MET 624 CO 0.01 1.11 0.63 -0.09 0.23 0.00 0.00 176.91 178.80 2cpy h ARG 625 N -0.71 0.41 -0.29 0.39 1.12 -0.51 0.49 114.38 115.28 2cpy h ARG 625 Ca -0.09 -0.02 -0.07 0.00 -1.11 0.00 0.00 59.98 58.68 2cpy h ARG 625 Cb 1.32 -0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 31.18 2cpy h ARG 625 CO 0.06 0.27 -0.09 0.93 -3.11 0.00 0.00 179.97 178.03 2cpy h GLU 626 N 0.43 0.58 -0.53 0.20 5.08 -1.63 -2.43 114.58 116.28 2cpy h GLU 626 Ca 0.53 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2cpy h GLU 626 Cb 1.30 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 2cpy h GLU 626 CO -0.23 0.79 0.33 0.82 -1.00 0.00 0.00 179.01 179.72 2cpy h ILE 627 N 0.34 1.15 0.56 3.13 2.04 -0.96 0.83 117.51 124.61 2cpy h ILE 627 Ca 0.07 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.60 2cpy h ILE 627 Cb 0.59 0.39 0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2cpy h ILE 627 CO 0.03 0.15 -0.27 -0.08 0.00 0.00 0.00 178.15 177.98 2cpy h GLU 628 N 0.73 -0.73 -0.99 2.37 4.57 -1.19 -2.32 114.58 117.02 2cpy h GLU 628 Ca 0.19 0.05 0.06 0.00 -1.18 0.00 0.00 59.36 58.48 2cpy h GLU 628 Cb -0.05 0.17 -0.06 0.00 -0.16 0.00 0.00 28.75 28.64 2cpy h GLU 628 CO -0.04 -0.44 0.64 1.57 -1.18 0.00 0.00 179.01 179.56 2cpy h LYS 629 N -1.13 1.14 -2.67 1.92 2.10 -1.33 -3.38 116.57 113.21 2cpy h LYS 629 Ca -0.08 -0.07 -0.42 0.00 -2.00 0.00 0.00 60.65 58.08 2cpy h LYS 629 Cb 0.62 -0.26 -0.38 0.00 -0.90 0.00 0.00 32.23 31.32 2cpy h LYS 629 CO 0.13 0.75 -0.71 1.21 -2.00 0.00 0.00 179.45 178.83 2cpy s ASN 630 N -5.91 2.36 0.45 7.07 2.47 0.28 -5.11 114.94 116.55 2cpy s ASN 630 Ca -0.13 -0.76 -0.22 0.00 0.42 0.00 0.00 52.86 52.18 2cpy s ASN 630 Cb 0.20 0.01 -0.09 0.00 -1.45 0.00 0.00 41.25 39.93 2cpy s ASN 630 CO 0.81 -0.38 1.05 -2.16 -3.72 0.00 0.00 177.10 172.71 2cpy s PRO 631 N 2.21 3.93 -0.04 0.43 0.04 -0.87 -4.02 135.00 136.68 2cpy s PRO 631 Ca 0.07 1.46 -0.38 0.00 0.04 0.00 0.00 61.00 62.18 2cpy s PRO 631 Cb -0.16 -2.29 -0.17 0.00 0.04 0.00 0.00 34.50 31.92 2cpy s PRO 631 CO -0.23 -0.33 1.44 -2.30 0.04 0.00 0.00 177.00 175.62 2cpy n PRO 632 N -0.58 1.04 -3.70 0.56 -0.02 -1.26 -4.96 135.00 126.07 2cpy n PRO 632 Ca 0.07 0.38 -0.28 0.00 -2.02 0.00 0.00 63.50 61.65 2cpy n PRO 632 Cb 0.51 -2.02 -0.16 0.00 -0.02 0.00 0.00 33.50 31.81 2cpy n PRO 632 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2cpy s ALA 633 N 1.38 0.99 -1.57 3.55 0.00 -1.26 -4.86 121.76 119.99 2cpy s ALA 633 Ca 0.89 -0.85 -0.08 0.00 0.00 0.00 0.00 51.96 51.92 2cpy s ALA 633 Cb -1.02 -1.26 0.07 0.00 0.00 0.00 0.00 23.12 20.91 2cpy s ALA 633 CO 0.54 -1.30 0.51 1.04 0.00 0.00 0.00 175.76 176.54 2cpy n GLN 634 N 5.06 -2.76 0.00 0.00 6.02 -1.26 -4.85 117.38 119.59 2cpy n GLN 634 Ca -0.07 0.33 0.00 0.00 -0.01 0.00 0.00 57.00 57.25 2cpy n GLN 634 Cb 0.46 -4.61 0.00 0.00 1.02 0.00 0.00 30.24 27.11 2cpy n GLN 634 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cpy n GLY 635 N -1.81 4.03 3.33 1.08 0.00 -1.26 -5.19 105.19 105.38 2cpy n GLY 635 Ca -0.14 -0.50 -0.17 0.00 0.00 0.00 0.00 46.02 45.21 2cpy n GLY 635 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cpy s LYS 636 N 2.94 1.70 -0.08 1.61 -0.14 -1.26 -5.09 119.74 119.42 2cpy s LYS 636 Ca 0.00 -1.87 -0.18 0.00 -1.36 0.00 0.00 55.97 52.57 2cpy s LYS 636 Cb 0.00 0.35 -0.14 0.00 -1.68 0.00 0.00 37.83 36.36 2cpy s LYS 636 CO 0.00 -0.64 0.64 0.66 -0.76 0.00 0.00 175.35 175.25 2cpy h SER 637 N 2.21 -0.11 0.00 2.83 4.64 -2.03 -3.46 113.55 117.63 2cpy h SER 637 Ca -0.28 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.64 2cpy h SER 637 Cb 1.24 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2cpy h SER 637 CO 0.40 0.52 0.00 0.61 -0.87 0.00 0.00 176.83 177.49 2cpy n GLY 638 N 1.09 -0.59 3.73 -0.77 0.00 -1.26 -5.04 105.19 102.35 2cpy n GLY 638 Ca -0.06 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 2cpy n GLY 638 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cpy s PRO 639 N -1.53 4.56 -0.86 1.61 0.04 -1.26 -4.97 135.00 132.58 2cpy s PRO 639 Ca 0.00 1.69 -0.25 0.00 0.04 0.00 0.00 61.00 62.48 2cpy s PRO 639 Cb 0.00 -3.31 0.03 0.00 0.04 0.00 0.00 34.50 31.26 2cpy s PRO 639 CO 0.00 -0.00 1.40 -1.54 0.04 0.00 0.00 177.00 176.90 2cpy s SER 640 N 0.24 6.24 0.04 6.66 1.04 -1.26 -4.93 113.70 121.73 2cpy s SER 640 Ca 0.51 -0.87 -0.22 0.00 0.48 0.00 0.00 55.95 55.85 2cpy s SER 640 Cb -0.28 -2.56 0.05 0.00 0.10 0.00 0.00 66.02 63.32 2cpy s SER 640 CO 0.33 -1.75 0.51 -0.55 0.98 0.00 0.00 173.24 172.76 2cpy s SER 641 N 4.63 -0.43 0.00 7.02 0.15 -1.26 -5.32 113.70 118.49 2cpy s SER 641 Ca 0.43 0.19 0.00 0.00 0.70 0.00 0.00 55.95 57.26 2cpy s SER 641 Cb -0.05 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 2cpy s SER 641 CO 0.04 -0.70 0.00 0.61 1.20 0.00 0.00 173.24 174.39