#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 2.51 -0.12 1.61 0.15 -1.26 -5.05 113.70 111.54 2cpy s SER 530 Ca 0.00 -0.46 -0.24 0.00 0.70 0.00 0.00 55.95 55.96 2cpy s SER 530 Cb 0.00 -0.24 -0.26 0.00 -1.71 0.00 0.00 66.02 63.80 2cpy s SER 530 CO 0.00 0.21 0.67 -1.28 1.20 0.00 0.00 173.24 174.05 2cpy h SER 531 N 5.23 0.19 0.00 5.45 0.87 -2.10 -3.50 113.55 119.68 2cpy h SER 531 Ca -0.41 -0.88 0.00 0.00 -1.23 0.00 0.00 61.79 59.27 2cpy h SER 531 Cb 1.15 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 2cpy h SER 531 CO 0.46 1.29 0.00 0.61 -0.53 0.00 0.00 176.83 178.66 2cpy n GLY 532 N 1.62 2.96 3.55 5.77 0.00 -1.26 -5.02 105.19 112.81 2cpy n GLY 532 Ca -0.17 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 44.82 2cpy n GLY 532 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cpy n SER 533 N 0.00 2.22 -4.77 1.61 7.64 -1.26 -4.92 113.62 114.14 2cpy n SER 533 Ca 0.00 -0.54 -0.37 0.00 1.01 0.00 0.00 58.87 58.98 2cpy n SER 533 Cb 0.00 -1.57 -0.00 0.00 -1.01 0.00 0.00 64.21 61.63 2cpy n SER 533 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2cpy s SER 534 N 12.11 6.05 0.00 6.43 0.01 -1.26 -4.26 113.70 132.78 2cpy s SER 534 Ca 0.99 2.31 0.00 0.00 1.31 0.00 0.00 55.95 60.56 2cpy s SER 534 Cb -0.21 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.42 2cpy s SER 534 CO 0.26 -1.00 0.00 0.61 0.41 0.00 0.00 173.24 173.52 2cpy n GLY 535 N 0.42 2.20 3.31 3.44 0.00 -1.26 -5.06 105.19 108.24 2cpy n GLY 535 Ca 0.08 -0.66 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 2cpy n GLY 535 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2cpy s GLU 536 N 0.00 2.02 0.61 1.61 -1.05 -1.26 -5.14 118.70 115.48 2cpy s GLU 536 Ca 0.00 -0.96 0.09 0.00 -0.15 0.00 0.00 54.97 53.94 2cpy s GLU 536 Cb 0.00 -2.01 0.10 0.00 -0.44 0.00 0.00 34.13 31.79 2cpy s GLU 536 CO 0.00 0.54 0.84 0.41 0.95 0.00 0.00 175.26 178.00 2cpy n GLY 537 N 2.29 1.80 3.22 -3.83 0.00 -1.26 -4.95 105.19 102.46 2cpy n GLY 537 Ca -0.16 -2.20 -0.29 0.00 0.00 0.00 0.00 46.02 43.37 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 -4.70 2.64 -0.15 1.61 -4.77 -1.26 -5.02 116.67 105.02 2cpy s ASP 538 Ca 0.62 -0.43 -0.00 0.00 -3.30 0.00 0.00 52.55 49.44 2cpy s ASP 538 Cb -0.05 -0.57 0.11 0.00 -1.09 0.00 0.00 42.92 41.32 2cpy s ASP 538 CO 0.40 0.23 1.96 1.33 0.70 0.00 0.00 175.17 179.78 2cpy n VAL 539 N 2.86 2.33 -0.97 2.11 0.24 -1.26 -4.97 118.33 118.67 2cpy n VAL 539 Ca -0.17 -1.03 -0.33 0.00 -2.04 0.00 0.00 64.34 60.77 2cpy n VAL 539 Cb 0.52 -1.38 0.03 0.00 -1.47 0.00 0.00 33.84 31.54 2cpy n VAL 539 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2cpy n ASN 540 N 0.88 -4.84 -4.32 -1.34 0.23 -1.26 -4.31 115.26 100.30 2cpy n ASN 540 Ca 0.15 0.29 -0.38 0.00 -0.53 0.00 0.00 54.58 54.10 2cpy n ASN 540 Cb 0.55 -0.71 -0.15 0.00 -2.08 0.00 0.00 39.78 37.40 2cpy n ASN 540 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2cpy n SER 541 N 2.90 0.17 -4.32 0.53 3.41 -1.26 -4.87 113.62 110.17 2cpy n SER 541 Ca 0.01 0.13 -0.32 0.00 -0.26 0.00 0.00 58.87 58.42 2cpy n SER 541 Cb 0.48 -0.86 -0.15 0.00 -0.26 0.00 0.00 64.21 63.42 2cpy n SER 541 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cpy s ALA 542 N 8.06 2.39 -0.56 7.33 0.00 -1.26 -5.09 121.76 132.63 2cpy s ALA 542 Ca 1.30 -0.97 -0.25 0.00 0.00 0.00 0.00 51.96 52.04 2cpy s ALA 542 Cb -1.18 -0.91 0.04 0.00 0.00 0.00 0.00 23.12 21.06 2cpy s ALA 542 CO 0.48 0.36 0.99 0.15 0.00 0.00 0.00 175.76 177.74 2cpy s LYS 543 N -0.00 3.36 -0.21 0.00 1.02 -1.26 -4.44 119.74 118.20 2cpy s LYS 543 Ca -0.06 -0.18 0.18 0.00 0.02 0.00 0.00 55.97 55.93 2cpy s LYS 543 Cb -0.15 -4.05 0.47 0.00 -0.52 0.00 0.00 37.83 33.58 2cpy s LYS 543 CO 0.05 -1.53 1.15 1.33 -0.92 0.00 0.00 175.35 175.43 2cpy n VAL 544 N 6.28 1.43 -3.72 3.17 0.24 -1.23 -4.20 118.33 120.30 2cpy n VAL 544 Ca 0.03 -2.89 -0.13 0.00 -2.04 0.00 0.00 64.34 59.31 2cpy n VAL 544 Cb 0.48 0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 33.22 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 0.47 1.52 -0.13 0.00 0.00 -0.50 -1.11 121.76 122.01 2cpy s ALA 546 Ca -0.02 -0.62 -0.05 0.00 0.00 0.00 0.00 51.96 51.27 2cpy s ALA 546 Cb -0.04 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 2cpy s ALA 546 CO -0.02 0.21 0.03 -1.58 0.00 0.00 0.00 175.76 174.41 2cpy s HIS 547 N 0.33 3.23 -0.13 0.00 5.04 0.51 -1.01 115.29 123.26 2cpy s HIS 547 Ca -0.10 0.13 -0.01 0.00 -1.54 0.00 0.00 55.06 53.54 2cpy s HIS 547 Cb -0.14 -1.92 -0.02 0.00 0.04 0.00 0.00 32.58 30.53 2cpy s HIS 547 CO 0.04 0.34 -0.10 0.42 -2.34 0.00 0.00 174.74 173.09 2cpy s ILE 548 N -0.33 3.32 0.40 0.89 1.01 0.22 -0.91 121.20 125.80 2cpy s ILE 548 Ca 0.08 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.21 2cpy s ILE 548 Cb -0.12 -2.41 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 2cpy s ILE 548 CO 0.02 0.52 0.19 0.42 0.00 0.00 0.00 174.94 176.09 2cpy s THR 549 N 0.27 0.34 -1.94 2.92 -4.23 -0.34 -1.99 115.64 110.67 2cpy s THR 549 Ca -0.07 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.44 2cpy s THR 549 Cb -0.15 -2.33 0.00 0.00 1.34 0.00 0.00 72.50 71.36 2cpy s THR 549 CO 0.05 0.00 0.00 -3.20 -0.54 0.00 0.00 174.62 170.93 2cpy n ASN 550 N -1.53 -5.72 -4.88 3.99 2.85 -1.25 -2.12 115.26 106.59 2cpy n ASN 550 Ca -0.02 0.19 -0.27 0.00 -0.11 0.00 0.00 54.58 54.38 2cpy n ASN 550 Cb 0.64 -4.85 -0.04 0.00 1.24 0.00 0.00 39.78 36.76 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 -2.92 5.00 0.18 -1.44 -4.36 -1.19 -4.36 121.20 112.11 2cpy s ILE 551 Ca 0.00 -0.81 -0.30 0.00 -0.26 0.00 0.00 60.65 59.28 2cpy s ILE 551 Cb 0.00 -3.55 -0.08 0.00 1.25 0.00 0.00 42.46 40.08 2cpy s ILE 551 CO 0.00 -0.07 1.15 -2.16 0.24 0.00 0.00 174.94 174.10 2cpy s PRO 552 N -3.10 4.53 -0.11 0.37 0.04 -1.26 -4.48 135.00 130.99 2cpy s PRO 552 Ca 0.33 1.81 0.01 0.00 0.04 0.00 0.00 61.00 63.19 2cpy s PRO 552 Cb -0.11 -3.26 0.16 0.00 0.04 0.00 0.00 34.50 31.34 2cpy s PRO 552 CO 0.26 -0.02 1.21 1.97 0.04 0.00 0.00 177.00 180.46 2cpy n PHE 553 N 2.45 0.73 -0.02 0.56 1.16 -1.26 -3.48 117.46 117.61 2cpy n PHE 553 Ca 0.04 -0.80 0.04 0.00 -1.87 0.00 0.00 57.45 54.85 2cpy n PHE 553 Cb 0.45 -0.41 -0.09 0.00 -1.61 0.00 0.00 39.48 37.82 2cpy n PHE 553 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 2cpy n SER 554 N 0.11 2.30 -4.90 5.98 3.41 -1.26 -4.70 113.62 114.56 2cpy n SER 554 Ca 0.14 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.47 2cpy n SER 554 Cb 0.77 1.39 0.04 0.00 -0.26 0.00 0.00 64.21 66.15 2cpy n SER 554 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2cpy s ILE 555 N -2.71 3.48 0.42 -1.33 -4.36 -1.23 -5.10 121.20 110.37 2cpy s ILE 555 Ca -0.05 0.24 0.07 0.00 -0.26 0.00 0.00 60.65 60.66 2cpy s ILE 555 Cb 0.07 -3.44 -0.06 0.00 1.25 0.00 0.00 42.46 40.27 2cpy s ILE 555 CO 0.48 -0.53 0.09 0.42 0.24 0.00 0.00 174.94 175.65 2cpy s THR 556 N -3.21 2.12 0.28 8.37 -4.23 -1.26 -4.99 115.64 112.72 2cpy s THR 556 Ca 0.56 -1.85 -0.05 0.00 -1.18 0.00 0.00 61.69 59.17 2cpy s THR 556 Cb -0.11 -2.97 0.41 0.00 1.34 0.00 0.00 72.50 71.18 2cpy s THR 556 CO 0.49 0.00 1.57 0.50 -0.54 0.00 0.00 174.62 176.64 2cpy h LYS 557 N 1.59 0.01 -0.52 3.99 3.64 -1.99 0.28 116.57 123.56 2cpy h LYS 557 Ca -0.43 -0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.05 2cpy h LYS 557 Cb 1.25 -0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.96 2cpy h LYS 557 CO 0.75 0.01 -0.24 0.52 -2.27 0.00 0.00 179.45 178.22 2cpy h MET 558 N 0.01 -0.11 0.01 1.90 2.86 -2.00 -1.79 114.93 115.82 2cpy h MET 558 Ca 0.50 0.01 0.02 0.00 -2.06 0.00 0.00 59.70 58.17 2cpy h MET 558 Cb 0.86 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.49 2cpy h MET 558 CO -0.94 -0.07 -0.53 -0.44 1.06 0.00 0.00 176.91 175.98 2cpy h ASP 559 N -0.12 -1.65 -0.65 1.22 5.19 -0.83 -1.45 116.42 118.15 2cpy h ASP 559 Ca 0.24 0.18 0.12 0.00 -0.62 0.00 0.00 57.03 56.95 2cpy h ASP 559 Cb 0.49 0.62 -0.12 0.00 0.18 0.00 0.00 39.33 40.50 2cpy h ASP 559 CO -0.60 -0.53 -0.31 0.58 -3.12 0.00 0.00 179.24 175.27 2cpy h VAL 560 N -0.68 0.18 -0.92 -1.35 2.07 -1.17 0.41 116.25 114.78 2cpy h VAL 560 Ca 0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.69 2cpy h VAL 560 Cb 0.73 0.18 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 2cpy h VAL 560 CO -0.35 0.00 0.59 -0.07 0.02 0.00 0.00 177.57 177.76 2cpy h LEU 561 N -0.12 0.64 -1.35 2.57 3.38 -0.76 0.52 115.31 120.20 2cpy h LEU 561 Ca 0.26 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2cpy h LEU 561 Cb 0.55 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2cpy h LEU 561 CO -0.72 0.30 0.00 -0.61 0.09 0.00 0.00 178.44 177.50 2cpy h GLN 562 N 0.66 0.00 0.00 1.13 5.75 0.83 -2.51 115.11 120.97 2cpy h GLN 562 Ca 0.48 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.88 2cpy h GLN 562 Cb 0.83 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.37 2cpy h GLN 562 CO -0.23 0.00 -1.15 0.35 -2.65 0.00 0.00 178.83 175.14 2cpy h PHE 563 N 0.00 0.00 -0.62 3.99 3.57 0.84 -3.33 116.94 121.38 2cpy h PHE 563 Ca 0.00 0.00 -0.33 0.00 3.53 0.00 0.00 57.97 61.17 2cpy h PHE 563 Cb 0.46 0.00 -0.20 0.00 2.79 0.00 0.00 35.95 39.01 2cpy h PHE 563 CO 0.00 0.34 0.21 1.28 -2.23 0.00 0.00 178.31 177.91 2cpy n LEU 564 N -2.84 5.24 -4.73 0.59 4.77 -0.67 -5.01 117.00 114.34 2cpy n LEU 564 Ca -0.05 -3.75 -0.42 0.00 -0.03 0.00 0.00 56.01 51.76 2cpy n LEU 564 Cb 0.71 -0.72 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 2cpy n LEU 564 CO 0.41 1.21 1.04 -0.70 -1.33 0.00 0.00 177.39 178.02 2cpy s GLU 565 N -3.29 4.34 0.00 3.23 -6.30 -1.08 -3.16 118.70 112.44 2cpy s GLU 565 Ca 0.50 2.12 0.00 0.00 -2.50 0.00 0.00 54.97 55.09 2cpy s GLU 565 Cb 0.44 -3.19 0.00 0.00 0.00 0.00 0.00 34.13 31.38 2cpy s GLU 565 CO 0.04 -0.36 0.00 0.41 0.02 0.00 0.00 175.26 175.37 2cpy n GLY 566 N 2.73 2.18 3.41 -1.50 0.00 -1.26 -5.06 105.19 105.69 2cpy n GLY 566 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.06 5.21 -0.87 -0.61 1.01 -1.19 -5.00 121.20 117.69 2cpy s ILE 567 Ca 0.00 -0.93 -0.30 0.00 0.00 0.00 0.00 60.65 59.42 2cpy s ILE 567 Cb 0.00 -4.10 -0.18 0.00 0.01 0.00 0.00 42.46 38.19 2cpy s ILE 567 CO 0.00 -0.54 2.63 -2.65 0.00 0.00 0.00 174.94 174.38 2cpy n PRO 568 N 5.28 0.24 -3.58 2.79 -0.02 -1.26 -4.86 135.00 133.60 2cpy n PRO 568 Ca -0.12 -0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.23 2cpy n PRO 568 Cb 0.45 -1.95 -0.05 0.00 -0.02 0.00 0.00 33.50 31.92 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 9.72 0.04 0.45 -1.45 0.11 -1.26 -4.86 120.40 123.15 2cpy s VAL 569 Ca 1.27 -0.30 -0.02 0.00 -2.93 0.00 0.00 61.98 60.00 2cpy s VAL 569 Cb -1.01 -1.01 -0.02 0.00 -1.53 0.00 0.00 36.38 32.81 2cpy s VAL 569 CO 0.44 -0.17 0.71 -0.62 -3.33 0.00 0.00 175.10 172.13 2cpy s ASP 570 N -2.21 6.02 0.06 3.54 -1.08 -1.26 -5.02 116.67 116.73 2cpy s ASP 570 Ca -0.03 0.56 -0.35 0.00 -0.52 0.00 0.00 52.55 52.22 2cpy s ASP 570 Cb -0.00 -1.87 -0.20 0.00 -1.46 0.00 0.00 42.92 39.39 2cpy s ASP 570 CO -0.05 -0.62 1.59 -0.33 0.52 0.00 0.00 175.17 176.28 2cpy h GLU 571 N 0.35 -1.04 -1.01 4.34 4.39 -2.01 -2.76 114.58 116.84 2cpy h GLU 571 Ca -0.47 0.07 0.28 0.00 0.34 0.00 0.00 59.36 59.58 2cpy h GLU 571 Cb 1.23 0.24 -0.13 0.00 -0.10 0.00 0.00 28.75 29.98 2cpy h GLU 571 CO 0.60 -0.69 0.59 -0.91 -1.16 0.00 0.00 179.01 177.44 2cpy h ASN 572 N -1.09 0.60 -1.66 1.42 4.21 -2.01 0.22 115.58 117.28 2cpy h ASN 572 Ca -0.11 0.16 0.48 0.00 1.21 0.00 0.00 56.30 58.04 2cpy h ASN 572 Cb 0.83 0.08 -0.07 0.00 -1.12 0.00 0.00 38.32 38.04 2cpy h ASN 572 CO 0.18 0.00 1.28 0.00 -1.29 0.00 0.00 177.43 177.60 2cpy h ALA 573 N 1.78 3.57 -2.80 -0.83 0.00 -1.80 -3.36 119.26 115.81 2cpy h ALA 573 Ca 0.68 -0.06 -0.57 0.00 0.00 0.00 0.00 54.91 54.97 2cpy h ALA 573 Cb 1.43 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 19.28 2cpy h ALA 573 CO -0.52 -2.13 -0.03 0.08 0.00 0.00 0.00 179.25 176.64 2cpy s VAL 574 N -4.80 5.09 -0.32 0.00 1.01 0.78 -1.61 120.40 120.55 2cpy s VAL 574 Ca -0.05 1.19 0.04 0.00 0.00 0.00 0.00 61.98 63.16 2cpy s VAL 574 Cb 0.24 -3.92 0.09 0.00 0.00 0.00 0.00 36.38 32.79 2cpy s VAL 574 CO 0.80 0.31 0.02 -1.00 0.00 0.00 0.00 175.10 175.23 2cpy s HIS 575 N 0.57 3.65 -0.16 5.22 0.09 0.61 -4.98 115.29 120.29 2cpy s HIS 575 Ca 0.31 -2.86 -0.23 0.00 -0.00 0.00 0.00 55.06 52.28 2cpy s HIS 575 Cb -0.17 -2.72 -0.02 0.00 -0.00 0.00 0.00 32.58 29.67 2cpy s HIS 575 CO 0.14 -0.93 0.72 0.08 -0.00 0.00 0.00 174.74 174.75 2cpy s VAL 576 N 0.95 4.98 0.60 -0.90 1.01 -1.26 -1.03 120.40 124.75 2cpy s VAL 576 Ca 0.07 1.40 -0.17 0.00 0.00 0.00 0.00 61.98 63.28 2cpy s VAL 576 Cb -0.19 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 2cpy s VAL 576 CO -0.07 0.11 1.10 -0.76 0.00 0.00 0.00 175.10 175.48 2cpy s LEU 577 N 1.74 3.54 0.10 3.92 1.43 -0.85 -5.02 118.68 123.55 2cpy s LEU 577 Ca 0.34 2.00 -0.11 0.00 -1.03 0.00 0.00 54.13 55.33 2cpy s LEU 577 Cb -0.16 -4.56 0.01 0.00 0.03 0.00 0.00 46.19 41.51 2cpy s LEU 577 CO 0.13 -1.36 0.25 0.68 0.23 0.00 0.00 176.35 176.28 2cpy s VAL 578 N -2.19 0.12 0.50 -1.59 -7.23 -1.26 -4.54 120.40 104.20 2cpy s VAL 578 Ca 0.68 -1.04 0.03 0.00 -1.81 0.00 0.00 61.98 59.83 2cpy s VAL 578 Cb -0.20 -1.34 -0.01 0.00 0.56 0.00 0.00 36.38 35.39 2cpy s VAL 578 CO 0.35 -0.53 0.08 -0.62 -0.31 0.00 0.00 175.10 174.07 2cpy s ASP 579 N -2.86 4.21 0.30 4.85 2.15 -1.26 -4.78 116.67 119.28 2cpy s ASP 579 Ca 0.05 -1.52 0.04 0.00 0.43 0.00 0.00 52.55 51.56 2cpy s ASP 579 Cb 0.04 0.35 0.79 0.00 -0.30 0.00 0.00 42.92 43.80 2cpy s ASP 579 CO -0.10 -0.84 1.64 0.78 -0.17 0.00 0.00 175.17 176.48 2cpy h ASN 580 N 1.29 0.04 1.24 -0.34 2.35 -2.02 1.26 115.58 119.40 2cpy h ASN 580 Ca -0.43 0.21 -0.06 0.00 -0.55 0.00 0.00 56.30 55.47 2cpy h ASN 580 Cb 1.30 0.27 -0.01 0.00 0.05 0.00 0.00 38.32 39.93 2cpy h ASN 580 CO 0.72 -0.18 -0.28 0.78 -1.65 0.00 0.00 177.43 176.82 2cpy h ASN 581 N 0.20 0.00 0.00 5.81 2.35 -2.00 -3.47 115.58 118.46 2cpy h ASN 581 Ca 0.59 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.34 2cpy h ASN 581 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 2cpy h ASN 581 CO -0.68 0.28 0.00 0.61 -1.65 0.00 0.00 177.43 175.99 2cpy n GLY 582 N 0.60 2.74 0.29 2.83 0.00 0.43 -4.92 105.19 107.16 2cpy n GLY 582 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.09 2cpy n GLY 582 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2cpy h GLN 583 N 0.07 0.09 0.00 1.61 4.20 -1.88 -3.36 115.11 115.83 2cpy h GLN 583 Ca 0.00 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2cpy h GLN 583 Cb 0.00 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.76 2cpy h GLN 583 CO 0.00 0.06 0.00 0.41 -0.67 0.00 0.00 178.83 178.63 2cpy n GLY 584 N -1.43 0.68 0.08 3.46 0.00 -1.26 -4.70 105.19 102.01 2cpy n GLY 584 Ca 0.15 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.21 2cpy n GLY 584 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cpy h LEU 585 N 0.00 0.04 0.00 0.99 3.38 -1.88 -3.45 115.31 114.39 2cpy h LEU 585 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2cpy h LEU 585 Cb 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2cpy h LEU 585 CO 0.00 1.06 0.00 0.61 0.09 0.00 0.00 178.44 180.20 2cpy n GLY 586 N 1.51 0.86 3.32 0.83 0.00 -1.26 -4.75 105.19 105.69 2cpy n GLY 586 Ca -0.12 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 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 0.22 1.07 -0.14 1.61 -0.21 -1.26 -3.16 119.66 117.79 2cpy s GLN 587 Ca 0.00 -0.73 -0.28 0.00 0.02 0.00 0.00 55.36 54.37 2cpy s GLN 587 Cb 0.00 0.47 0.07 0.00 1.00 0.00 0.00 33.01 34.55 2cpy s GLN 587 CO 0.00 -0.42 0.69 0.00 -2.12 0.00 0.00 175.29 173.44 2cpy s ALA 588 N -3.81 -1.75 0.24 6.09 0.00 -0.84 -2.00 121.76 119.68 2cpy s ALA 588 Ca 0.03 1.59 0.08 0.00 0.00 0.00 0.00 51.96 53.67 2cpy s ALA 588 Cb 0.02 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 2cpy s ALA 588 CO -0.11 -0.35 0.07 -0.51 0.00 0.00 0.00 175.76 174.85 2cpy s LEU 589 N -0.54 3.44 -0.04 0.00 1.43 -0.19 -0.61 118.68 122.16 2cpy s LEU 589 Ca -0.06 -0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.58 2cpy s LEU 589 Cb -0.02 -1.99 0.03 0.00 0.03 0.00 0.00 46.19 44.24 2cpy s LEU 589 CO 0.06 0.01 0.00 -0.69 0.23 0.00 0.00 176.35 175.96 2cpy s VAL 590 N -2.13 0.22 -0.35 -1.59 1.01 -0.18 -0.28 120.40 117.09 2cpy s VAL 590 Ca 0.31 0.12 -0.11 0.00 0.00 0.00 0.00 61.98 62.30 2cpy s VAL 590 Cb -0.08 -0.35 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2cpy s VAL 590 CO 0.21 0.18 0.20 -1.58 0.00 0.00 0.00 175.10 174.11 2cpy s GLN 591 N 1.39 3.06 0.29 2.72 0.74 -0.64 -1.41 119.66 125.81 2cpy s GLN 591 Ca -0.04 -0.92 0.04 0.00 0.05 0.00 0.00 55.36 54.48 2cpy s GLN 591 Cb -0.13 -3.70 -0.03 0.00 1.10 0.00 0.00 33.01 30.26 2cpy s GLN 591 CO -0.03 -0.59 0.44 -0.06 -0.55 0.00 0.00 175.29 174.51 2cpy s PHE 592 N 1.59 3.41 -0.11 1.67 0.08 0.15 -4.80 117.98 119.97 2cpy s PHE 592 Ca 0.03 0.07 -0.25 0.00 0.12 0.00 0.00 56.93 56.90 2cpy s PHE 592 Cb -0.18 -1.75 -0.22 0.00 -0.57 0.00 0.00 43.02 40.30 2cpy s PHE 592 CO 0.07 0.25 0.76 0.87 -0.10 0.00 0.00 175.22 177.07 2cpy h LYS 593 N 0.98 -0.02 -4.63 0.44 6.56 -1.89 -3.44 116.57 114.58 2cpy h LYS 593 Ca -0.50 0.00 -0.22 0.00 -1.06 0.00 0.00 60.65 58.87 2cpy h LYS 593 Cb 1.23 0.00 -0.15 0.00 -0.57 0.00 0.00 32.23 32.75 2cpy h LYS 593 CO 0.60 0.77 -0.68 -0.80 -2.06 0.00 0.00 179.45 177.28 2cpy s ASN 594 N -6.03 1.03 0.58 0.86 0.01 -1.26 -4.96 114.94 105.17 2cpy s ASN 594 Ca -0.16 -1.05 0.29 0.00 -0.71 0.00 0.00 52.86 51.23 2cpy s ASN 594 Cb -0.02 0.12 1.47 0.00 0.41 0.00 0.00 41.25 43.23 2cpy s ASN 594 CO 0.60 -0.52 1.89 -0.33 -1.51 0.00 0.00 177.10 177.23 2cpy h GLU 595 N 2.92 0.00 -1.03 -0.60 5.08 -1.93 0.20 114.58 119.23 2cpy h GLU 595 Ca -0.35 0.00 0.30 0.00 -1.00 0.00 0.00 59.36 58.30 2cpy h GLU 595 Cb 1.17 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.38 2cpy h GLU 595 CO 0.64 0.00 0.75 -0.44 -1.00 0.00 0.00 179.01 178.96 2cpy h ASP 596 N 0.00 0.00 0.01 1.42 3.32 -1.95 0.25 116.42 119.46 2cpy h ASP 596 Ca 0.26 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 57.00 2cpy h ASP 596 Cb 1.29 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.79 2cpy h ASP 596 CO -0.00 0.00 -1.66 0.47 -1.72 0.00 0.00 179.24 176.32 2cpy n ASP 597 N -4.18 1.90 0.09 6.45 8.00 0.05 -4.38 116.55 124.48 2cpy n ASP 597 Ca 0.22 0.38 -0.12 0.00 0.71 0.00 0.00 54.79 55.97 2cpy n ASP 597 Cb 1.10 -0.91 -0.05 0.00 -0.02 0.00 0.00 41.12 41.23 2cpy n ASP 597 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cpy h ALA 598 N -0.60 -0.47 -0.99 2.24 0.00 -1.33 -0.42 119.26 117.70 2cpy h ALA 598 Ca -0.45 -0.03 0.29 0.00 0.00 0.00 0.00 54.91 54.71 2cpy h ALA 598 Cb 1.43 0.49 -0.04 0.00 0.00 0.00 0.00 17.79 19.68 2cpy h ALA 598 CO -0.26 -0.82 1.14 0.00 0.00 0.00 0.00 179.25 179.32 2cpy h ARG 599 N -0.48 0.00 0.12 0.00 3.08 -0.76 1.53 114.38 117.87 2cpy h ARG 599 Ca 0.04 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.75 2cpy h ARG 599 Cb 0.53 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 2cpy h ARG 599 CO -0.20 0.00 -1.86 0.87 -1.07 0.00 0.00 179.97 177.71 2cpy h LYS 600 N 0.00 0.25 0.00 0.04 1.57 -1.29 -3.29 116.57 113.84 2cpy h LYS 600 Ca 0.47 -0.43 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2cpy h LYS 600 Cb 2.75 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 35.22 2cpy h LYS 600 CO -0.00 1.12 -0.09 0.66 -0.57 0.00 0.00 179.45 180.56 2cpy h SER 601 N 0.07 0.00 0.87 0.86 4.64 0.27 -1.92 113.55 118.34 2cpy h SER 601 Ca -0.37 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.73 2cpy h SER 601 Cb 2.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.11 2cpy h SER 601 CO 0.11 0.09 -1.04 1.05 -0.87 0.00 0.00 176.83 176.17 2cpy h GLU 602 N 0.00 0.08 0.00 4.77 4.11 -1.37 -3.21 114.58 118.95 2cpy h GLU 602 Ca -0.00 -0.13 -0.01 0.00 0.07 0.00 0.00 59.36 59.29 2cpy h GLU 602 Cb 0.23 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 2cpy h GLU 602 CO 0.01 1.04 -0.02 -0.09 0.07 0.00 0.00 179.01 180.02 2cpy h ARG 603 N 0.03 0.00 -0.18 1.06 2.43 -1.41 0.43 114.38 116.74 2cpy h ARG 603 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2cpy h ARG 603 Cb 1.79 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.34 2cpy h ARG 603 CO 0.15 0.02 0.00 1.28 -1.51 0.00 0.00 179.97 179.91 2cpy n LEU 604 N -3.71 0.88 -4.75 3.80 4.77 -1.21 -4.91 117.00 111.87 2cpy n LEU 604 Ca -0.03 -0.44 -0.40 0.00 -0.03 0.00 0.00 56.01 55.11 2cpy n LEU 604 Cb 0.11 -0.12 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 2cpy n LEU 604 CO 0.27 0.22 1.03 1.57 -1.33 0.00 0.00 177.39 179.15 2cpy n HIS 605 N -0.03 2.60 -3.39 -1.77 -0.00 0.14 -2.86 115.22 109.91 2cpy n HIS 605 Ca 0.05 0.46 -0.17 0.00 0.46 0.00 0.00 57.72 58.52 2cpy n HIS 605 Cb 0.14 -2.45 0.08 0.00 -0.12 0.00 0.00 29.99 27.65 2cpy n HIS 605 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2cpy n ARG 606 N -0.06 -6.54 -3.98 1.57 1.74 -1.06 -4.96 116.66 103.37 2cpy n ARG 606 Ca 0.05 0.80 -0.21 0.00 -0.77 0.00 0.00 57.85 57.72 2cpy n ARG 606 Cb 0.41 -5.69 -0.02 0.00 -1.02 0.00 0.00 32.46 26.14 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 -5.49 3.39 -0.61 5.56 -0.14 -1.13 -4.86 119.74 116.45 2cpy s LYS 607 Ca 0.12 -0.79 -0.14 0.00 -1.36 0.00 0.00 55.97 53.80 2cpy s LYS 607 Cb -0.05 -2.86 0.15 0.00 -1.68 0.00 0.00 37.83 33.39 2cpy s LYS 607 CO 0.69 0.42 0.55 0.15 -0.76 0.00 0.00 175.35 176.41 2cpy s LYS 608 N -3.97 3.09 -0.43 1.68 1.02 -1.26 -0.64 119.74 119.23 2cpy s LYS 608 Ca 0.34 -1.94 -0.19 0.00 0.02 0.00 0.00 55.97 54.19 2cpy s LYS 608 Cb -0.09 -4.28 0.02 0.00 -0.52 0.00 0.00 37.83 32.97 2cpy s LYS 608 CO 0.29 -1.30 0.55 -1.17 -0.92 0.00 0.00 175.35 172.80 2cpy s LEU 609 N 1.13 4.67 -1.55 3.17 0.20 0.18 -4.17 118.68 122.32 2cpy s LEU 609 Ca 0.08 -0.50 -0.01 0.00 0.69 0.00 0.00 54.13 54.39 2cpy s LEU 609 Cb -0.24 -2.57 0.00 0.00 -0.43 0.00 0.00 46.19 42.95 2cpy s LEU 609 CO -0.01 -0.69 0.08 0.59 -0.29 0.00 0.00 176.35 176.04 2cpy n ASN 610 N 5.96 -5.40 0.00 3.68 4.13 -1.26 -1.45 115.26 120.91 2cpy n ASN 610 Ca -0.04 -0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.16 2cpy n ASN 610 Cb 0.48 -4.43 0.00 0.00 -1.54 0.00 0.00 39.78 34.29 2cpy n ASN 610 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2cpy n GLY 611 N -1.08 0.58 3.23 7.41 0.00 -1.26 -5.04 105.19 109.03 2cpy n GLY 611 Ca -0.20 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.48 2.37 -0.16 1.61 0.52 -0.53 -5.07 118.95 117.21 2cpy s ARG 612 Ca 0.00 -0.83 -0.29 0.00 -0.52 0.00 0.00 55.73 54.09 2cpy s ARG 612 Cb 0.00 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.44 2cpy s ARG 612 CO 0.00 0.34 1.24 -1.21 0.02 0.00 0.00 175.30 175.69 2cpy s GLU 613 N -0.09 4.25 0.15 3.54 8.01 -1.26 0.52 118.70 133.82 2cpy s GLU 613 Ca -0.04 1.64 0.07 0.00 0.01 0.00 0.00 54.97 56.65 2cpy s GLU 613 Cb -0.13 -3.73 -0.04 0.00 -4.31 0.00 0.00 34.13 25.92 2cpy s GLU 613 CO 0.03 -0.67 -0.05 0.00 0.01 0.00 0.00 175.26 174.59 2cpy s ALA 614 N 3.31 3.08 -0.09 5.21 0.00 0.19 -4.67 121.76 128.79 2cpy s ALA 614 Ca 0.54 -1.35 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2cpy s ALA 614 Cb -0.22 -0.92 -0.00 0.00 0.00 0.00 0.00 23.12 21.98 2cpy s ALA 614 CO 0.15 0.53 -0.23 -0.06 0.00 0.00 0.00 175.76 176.15 2cpy s PHE 615 N -1.58 2.56 -0.18 0.00 0.08 -0.90 -2.57 117.98 115.38 2cpy s PHE 615 Ca 0.25 -0.93 -0.01 0.00 0.12 0.00 0.00 56.93 56.36 2cpy s PHE 615 Cb -0.10 -1.70 -0.00 0.00 -0.57 0.00 0.00 43.02 40.66 2cpy s PHE 615 CO 0.17 -0.35 -0.12 0.08 -0.10 0.00 0.00 175.22 174.90 2cpy s VAL 616 N 0.21 2.85 -0.09 -0.44 1.01 -1.26 -1.20 120.40 121.48 2cpy s VAL 616 Ca -0.14 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2cpy s VAL 616 Cb -0.17 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.95 2cpy s VAL 616 CO 0.07 0.49 -0.14 -1.00 0.00 0.00 0.00 175.10 174.51 2cpy s HIS 617 N 1.14 2.74 -0.19 5.22 3.76 -0.09 -4.82 115.29 123.04 2cpy s HIS 617 Ca 0.01 -0.42 -0.16 0.00 -0.15 0.00 0.00 55.06 54.33 2cpy s HIS 617 Cb -0.14 -1.73 -0.04 0.00 1.11 0.00 0.00 32.58 31.78 2cpy s HIS 617 CO -0.04 -0.03 0.42 0.08 -0.85 0.00 0.00 174.74 174.33 2cpy s VAL 618 N -0.19 5.19 0.30 -0.90 1.01 -1.26 -0.36 120.40 124.18 2cpy s VAL 618 Ca -0.00 0.76 0.07 0.00 0.00 0.00 0.00 61.98 62.81 2cpy s VAL 618 Cb -0.13 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2cpy s VAL 618 CO 0.03 0.25 0.25 1.33 0.00 0.00 0.00 175.10 176.96 2cpy n VAL 619 N 4.29 0.00 -2.25 2.92 0.24 -0.26 -5.01 118.33 118.25 2cpy n VAL 619 Ca -0.08 -2.18 -0.25 0.00 -2.04 0.00 0.00 64.34 59.79 2cpy n VAL 619 Cb 0.51 1.08 0.06 0.00 -1.47 0.00 0.00 33.84 34.02 2cpy n VAL 619 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2cpy s THR 620 N -3.20 2.35 0.06 3.34 -4.23 -1.26 -2.81 115.64 109.89 2cpy s THR 620 Ca 0.35 -0.31 -0.34 0.00 -1.18 0.00 0.00 61.69 60.22 2cpy s THR 620 Cb 0.02 -3.01 -0.17 0.00 1.34 0.00 0.00 72.50 70.67 2cpy s THR 620 CO 0.25 -0.01 1.51 0.25 -0.54 0.00 0.00 174.62 176.08 2cpy h LEU 621 N -0.52 -1.16 -0.63 4.79 6.46 -1.89 -2.57 115.31 119.80 2cpy h LEU 621 Ca -0.44 0.07 0.09 0.00 -0.12 0.00 0.00 57.88 57.47 2cpy h LEU 621 Cb 1.31 0.34 -0.11 0.00 -0.73 0.00 0.00 40.66 41.48 2cpy h LEU 621 CO 0.59 -0.68 -0.46 -0.08 -0.62 0.00 0.00 178.44 177.19 2cpy h GLU 622 N -1.09 -0.20 -0.82 1.25 4.81 -1.96 0.11 114.58 116.67 2cpy h GLU 622 Ca -0.09 0.01 0.19 0.00 -0.13 0.00 0.00 59.36 59.34 2cpy h GLU 622 Cb 0.88 0.05 -0.15 0.00 0.63 0.00 0.00 28.75 30.16 2cpy h GLU 622 CO 0.08 -0.13 -0.04 -0.44 -0.73 0.00 0.00 179.01 177.75 2cpy h ASP 623 N -0.21 -0.47 -0.44 1.04 3.32 -1.94 0.24 116.42 117.97 2cpy h ASP 623 Ca 0.18 0.22 0.06 0.00 0.02 0.00 0.00 57.03 57.51 2cpy h ASP 623 Cb 0.55 0.41 -0.05 0.00 0.22 0.00 0.00 39.33 40.46 2cpy h ASP 623 CO -0.73 -0.23 0.13 -0.03 -1.72 0.00 0.00 179.24 176.66 2cpy h MET 624 N 0.06 0.28 0.38 3.56 4.05 -0.39 -1.34 114.93 121.53 2cpy h MET 624 Ca 0.45 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.83 2cpy h MET 624 Cb 0.80 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 31.53 2cpy h MET 624 CO -0.76 0.18 -0.21 -0.09 0.23 0.00 0.00 176.91 176.26 2cpy h ARG 625 N 0.28 -0.54 -0.90 0.39 1.12 0.01 -1.18 114.38 113.57 2cpy h ARG 625 Ca 0.21 0.04 0.20 0.00 -1.11 0.00 0.00 59.98 59.31 2cpy h ARG 625 Cb 0.22 0.12 -0.07 0.00 -0.01 0.00 0.00 29.97 30.24 2cpy h ARG 625 CO -0.23 -0.36 0.60 0.93 -3.11 0.00 0.00 179.97 177.79 2cpy h GLU 626 N -0.56 0.42 -0.26 0.20 5.08 -0.87 0.67 114.58 119.27 2cpy h GLU 626 Ca -0.05 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.16 2cpy h GLU 626 Cb 0.45 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 2cpy h GLU 626 CO 0.06 0.28 -0.34 0.82 -1.00 0.00 0.00 179.01 178.83 2cpy h ILE 627 N 0.43 1.31 0.18 3.13 2.04 -0.70 -2.15 117.51 121.74 2cpy h ILE 627 Ca 0.47 -1.53 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 2cpy h ILE 627 Cb 1.14 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 2cpy h ILE 627 CO -0.19 0.49 -0.09 -0.08 0.00 0.00 0.00 178.15 178.28 2cpy h GLU 628 N 0.42 -0.23 -0.68 2.37 4.81 0.20 0.60 114.58 122.07 2cpy h GLU 628 Ca 0.03 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.36 2cpy h GLU 628 Cb 0.93 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.29 2cpy h GLU 628 CO 0.08 0.05 0.34 1.57 -0.73 0.00 0.00 179.01 180.32 2cpy h LYS 629 N -0.51 0.58 -2.60 1.92 2.10 -1.03 -3.33 116.57 113.70 2cpy h LYS 629 Ca -0.02 -0.03 -0.60 0.00 -2.00 0.00 0.00 60.65 57.99 2cpy h LYS 629 Cb 0.39 -0.13 -0.39 0.00 -0.90 0.00 0.00 32.23 31.20 2cpy h LYS 629 CO 0.04 0.38 -0.85 -0.80 -2.00 0.00 0.00 179.45 176.22 2cpy s ASN 630 N -5.51 2.53 0.51 7.07 0.01 -0.81 -5.11 114.94 113.63 2cpy s ASN 630 Ca -0.13 -3.08 -0.19 0.00 -0.71 0.00 0.00 52.86 48.75 2cpy s ASN 630 Cb 0.17 -0.74 -0.12 0.00 0.41 0.00 0.00 41.25 40.97 2cpy s ASN 630 CO 0.76 -0.18 0.34 -2.65 -1.51 0.00 0.00 177.10 173.86 2cpy n PRO 631 N 2.88 0.37 -2.61 -0.60 -0.02 0.20 -4.55 135.00 130.66 2cpy n PRO 631 Ca 0.23 0.14 -0.42 0.00 -2.02 0.00 0.00 63.50 61.44 2cpy n PRO 631 Cb 0.43 -1.43 -0.03 0.00 -0.02 0.00 0.00 33.50 32.44 2cpy n PRO 631 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2cpy s PRO 632 N -1.62 4.55 0.30 0.52 0.04 -1.26 -4.94 135.00 132.59 2cpy s PRO 632 Ca 0.64 1.56 0.06 0.00 0.04 0.00 0.00 61.00 63.30 2cpy s PRO 632 Cb -0.51 -3.39 0.79 0.00 0.04 0.00 0.00 34.50 31.43 2cpy s PRO 632 CO 0.59 -0.05 1.69 0.00 0.04 0.00 0.00 177.00 179.26 2cpy h ALA 633 N 6.39 1.53 -2.94 8.56 0.00 -2.01 -3.44 119.26 127.36 2cpy h ALA 633 Ca -0.42 0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.68 2cpy h ALA 633 Cb 1.22 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 19.09 2cpy h ALA 633 CO 0.76 -0.38 0.12 -0.65 0.00 0.00 0.00 179.25 179.10 2cpy s GLN 634 N -5.85 1.65 -0.84 0.00 -0.21 -1.26 -5.11 119.66 108.04 2cpy s GLN 634 Ca -0.11 -1.01 -0.01 0.00 0.02 0.00 0.00 55.36 54.25 2cpy s GLN 634 Cb 0.26 0.56 0.21 0.00 1.00 0.00 0.00 33.01 35.04 2cpy s GLN 634 CO 0.78 -0.73 0.70 0.20 -2.12 0.00 0.00 175.29 174.12 2cpy s GLY 635 N -2.93 3.00 -0.05 3.09 0.00 -1.26 -5.06 107.32 104.11 2cpy s GLY 635 Ca 0.13 -3.79 -0.38 0.00 0.00 0.00 0.00 44.72 40.68 2cpy s GLY 635 CO 0.05 1.17 1.46 0.58 0.00 0.00 0.00 173.10 176.36 2cpy n LYS 636 N 2.38 1.06 -3.46 2.90 2.85 -1.26 -4.90 118.16 117.73 2cpy n LYS 636 Ca 0.20 0.38 -0.43 0.00 -1.05 0.00 0.00 58.31 57.41 2cpy n LYS 636 Cb 0.37 -2.03 -0.05 0.00 -0.65 0.00 0.00 35.03 32.67 2cpy n LYS 636 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2cpy s SER 637 N 1.50 6.16 -0.46 -5.58 0.01 -1.26 -4.92 113.70 109.15 2cpy s SER 637 Ca 0.90 -2.52 0.06 0.00 1.31 0.00 0.00 55.95 55.70 2cpy s SER 637 Cb -1.02 -2.09 0.21 0.00 0.21 0.00 0.00 66.02 63.32 2cpy s SER 637 CO 0.54 -0.57 0.61 0.61 0.41 0.00 0.00 173.24 174.84 2cpy n GLY 638 N 4.13 0.95 1.43 3.44 0.00 -1.26 -5.00 105.19 108.88 2cpy n GLY 638 Ca 0.06 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2cpy n GLY 638 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cpy n PRO 639 N 2.36 0.93 -1.73 1.61 -0.04 -1.26 -4.93 135.00 131.94 2cpy n PRO 639 Ca 0.20 0.00 -0.63 0.00 -0.04 0.00 0.00 63.50 63.03 2cpy n PRO 639 Cb 0.55 -1.04 -0.09 0.00 -0.04 0.00 0.00 33.50 32.88 2cpy n PRO 639 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cpy n SER 640 N 1.34 1.80 -4.10 3.54 2.88 -1.26 -4.94 113.62 112.89 2cpy n SER 640 Ca 0.00 1.13 -0.11 0.00 -1.33 0.00 0.00 58.87 58.56 2cpy n SER 640 Cb 0.46 -1.01 -0.11 0.00 -0.75 0.00 0.00 64.21 62.81 2cpy n SER 640 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2cpy s SER 641 N 3.29 0.87 0.00 -3.46 0.01 -1.26 -5.32 113.70 107.83 2cpy s SER 641 Ca 1.02 -0.75 0.00 0.00 1.31 0.00 0.00 55.95 57.53 2cpy s SER 641 Cb -1.29 0.08 0.00 0.00 0.21 0.00 0.00 66.02 65.02 2cpy s SER 641 CO 0.74 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 174.66