#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 2.45 0.77 1.61 1.04 -1.26 -5.13 113.70 113.19 2cpy s SER 530 Ca 0.00 -0.43 -0.14 0.00 0.48 0.00 0.00 55.95 55.86 2cpy s SER 530 Cb 0.00 -1.12 0.06 0.00 0.10 0.00 0.00 66.02 65.06 2cpy s SER 530 CO 0.00 0.06 1.20 -0.94 0.98 0.00 0.00 173.24 174.54 2cpy s SER 531 N 0.70 3.92 0.00 7.02 1.04 -1.26 -4.86 113.70 120.27 2cpy s SER 531 Ca -0.12 2.33 0.00 0.00 0.48 0.00 0.00 55.95 58.63 2cpy s SER 531 Cb -0.16 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.37 2cpy s SER 531 CO 0.03 -2.44 0.00 0.61 0.98 0.00 0.00 173.24 172.42 2cpy n GLY 532 N 0.35 0.59 3.64 7.32 0.00 -1.26 -5.08 105.19 110.75 2cpy n GLY 532 Ca 0.13 -2.12 -0.23 0.00 0.00 0.00 0.00 46.02 43.80 2cpy n GLY 532 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cpy s SER 533 N -4.00 4.46 0.30 1.61 0.15 -1.26 -5.08 113.70 109.87 2cpy s SER 533 Ca 0.00 -0.73 -0.28 0.00 0.70 0.00 0.00 55.95 55.64 2cpy s SER 533 Cb 0.00 -0.76 -0.14 0.00 -1.71 0.00 0.00 66.02 63.42 2cpy s SER 533 CO 0.00 -0.07 0.95 -1.54 1.20 0.00 0.00 173.24 173.78 2cpy n SER 534 N -0.92 1.01 0.00 5.45 3.41 -1.26 -4.96 113.62 116.35 2cpy n SER 534 Ca -0.06 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.71 2cpy n SER 534 Cb 0.60 -1.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 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 1.30 -0.00 3.92 5.00 0.00 -1.26 -5.00 105.19 109.15 2cpy n GLY 535 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 2cpy n GLY 535 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cpy s GLU 536 N -0.54 3.52 0.00 1.61 8.01 -1.26 -4.84 118.70 125.19 2cpy s GLU 536 Ca 0.00 -0.06 0.00 0.00 0.01 0.00 0.00 54.97 54.92 2cpy s GLU 536 Cb 0.00 -2.51 0.00 0.00 -4.31 0.00 0.00 34.13 27.31 2cpy s GLU 536 CO 0.00 -0.03 0.00 0.41 0.01 0.00 0.00 175.26 175.65 2cpy n GLY 537 N -2.03 0.39 3.06 -1.39 0.00 -1.26 -5.10 105.19 98.86 2cpy n GLY 537 Ca -0.02 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 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 -4.00 1.14 -0.49 1.61 1.47 -1.26 -5.05 116.67 110.09 2cpy s ASP 538 Ca 0.00 -0.34 0.03 0.00 1.18 0.00 0.00 52.55 53.41 2cpy s ASP 538 Cb 0.00 -0.07 0.47 0.00 -0.34 0.00 0.00 42.92 42.99 2cpy s ASP 538 CO 0.00 0.00 1.68 0.55 0.68 0.00 0.00 175.17 178.08 2cpy n VAL 539 N 2.21 3.12 -0.08 2.11 3.14 -1.26 -4.70 118.33 122.87 2cpy n VAL 539 Ca -0.17 -3.29 -0.10 0.00 -2.96 0.00 0.00 64.34 57.81 2cpy n VAL 539 Cb 0.56 -1.02 -0.03 0.00 -1.06 0.00 0.00 33.84 32.28 2cpy n VAL 539 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2cpy h ASN 540 N 1.90 0.39 -4.20 6.55 7.08 -2.04 -3.37 115.58 121.89 2cpy h ASN 540 Ca 0.49 -0.21 -0.64 0.00 -3.08 0.00 0.00 56.30 52.86 2cpy h ASN 540 Cb 1.27 -0.10 -0.41 0.00 -2.08 0.00 0.00 38.32 37.00 2cpy h ASN 540 CO 1.16 0.50 -0.65 -0.44 -2.08 0.00 0.00 177.43 175.91 2cpy s SER 541 N -5.77 4.30 -0.25 6.14 0.01 -1.26 -5.08 113.70 111.79 2cpy s SER 541 Ca -0.14 -2.86 -0.11 0.00 1.31 0.00 0.00 55.95 54.16 2cpy s SER 541 Cb 0.08 -1.57 -0.05 0.00 0.21 0.00 0.00 66.02 64.69 2cpy s SER 541 CO 0.73 -0.26 0.18 0.00 0.41 0.00 0.00 173.24 174.31 2cpy s ALA 542 N -0.06 3.58 -0.73 1.44 0.00 -1.26 -5.03 121.76 119.71 2cpy s ALA 542 Ca 0.16 -0.93 -0.26 0.00 0.00 0.00 0.00 51.96 50.94 2cpy s ALA 542 Cb -0.25 -2.39 -0.01 0.00 0.00 0.00 0.00 23.12 20.47 2cpy s ALA 542 CO -0.01 -0.31 1.74 0.15 0.00 0.00 0.00 175.76 177.33 2cpy s LYS 543 N 1.29 2.78 -0.30 0.00 3.01 -1.26 -4.70 119.74 120.56 2cpy s LYS 543 Ca 0.08 0.13 0.08 0.00 -1.01 0.00 0.00 55.97 55.24 2cpy s LYS 543 Cb -0.14 -4.57 0.46 0.00 -1.01 0.00 0.00 37.83 32.56 2cpy s LYS 543 CO 0.07 -2.73 1.34 1.33 0.51 0.00 0.00 175.35 175.86 2cpy n VAL 544 N 7.18 2.54 -3.75 3.17 0.24 -1.25 -4.39 118.33 122.08 2cpy n VAL 544 Ca 0.23 -3.49 -0.13 0.00 -2.04 0.00 0.00 64.34 58.91 2cpy n VAL 544 Cb 0.50 -0.70 -0.11 0.00 -1.47 0.00 0.00 33.84 32.07 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 0.39 1.21 -0.13 0.00 0.00 0.83 -1.31 121.76 122.75 2cpy s ALA 546 Ca -0.02 -0.46 -0.14 0.00 0.00 0.00 0.00 51.96 51.34 2cpy s ALA 546 Cb -0.04 -0.87 -0.05 0.00 0.00 0.00 0.00 23.12 22.17 2cpy s ALA 546 CO -0.02 -0.41 0.32 -1.58 0.00 0.00 0.00 175.76 174.08 2cpy s HIS 547 N 1.72 3.52 -0.20 0.00 5.04 0.14 -0.55 115.29 124.97 2cpy s HIS 547 Ca 0.04 0.68 -0.04 0.00 -1.54 0.00 0.00 55.06 54.20 2cpy s HIS 547 Cb -0.13 -2.33 -0.02 0.00 0.04 0.00 0.00 32.58 30.14 2cpy s HIS 547 CO -0.07 0.32 -0.02 0.42 -2.34 0.00 0.00 174.74 173.05 2cpy s ILE 548 N 0.16 3.76 0.34 0.89 1.01 0.50 -1.21 121.20 126.65 2cpy s ILE 548 Ca 0.19 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.50 2cpy s ILE 548 Cb -0.14 -2.69 -0.07 0.00 0.01 0.00 0.00 42.46 39.57 2cpy s ILE 548 CO 0.06 0.44 0.04 0.42 0.00 0.00 0.00 174.94 175.90 2cpy s THR 549 N 1.03 1.38 -0.79 2.92 -4.23 -0.53 -1.93 115.64 113.49 2cpy s THR 549 Ca 0.01 -2.01 -0.01 0.00 -1.18 0.00 0.00 61.69 58.51 2cpy s THR 549 Cb -0.14 -2.82 0.00 0.00 1.34 0.00 0.00 72.50 70.88 2cpy s THR 549 CO 0.01 -0.02 0.12 -3.20 -0.54 0.00 0.00 174.62 170.99 2cpy n ASN 550 N -0.74 -3.46 -4.73 3.99 2.85 -1.25 -1.84 115.26 110.08 2cpy n ASN 550 Ca -0.03 -0.06 -0.28 0.00 -0.11 0.00 0.00 54.58 54.10 2cpy n ASN 550 Cb 0.66 -2.57 -0.07 0.00 1.24 0.00 0.00 39.78 39.04 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 -2.63 4.19 0.16 -1.44 -4.36 -1.16 -4.40 121.20 111.55 2cpy s ILE 551 Ca 0.06 -1.09 -0.30 0.00 -0.26 0.00 0.00 60.65 59.06 2cpy s ILE 551 Cb -0.03 -3.08 -0.07 0.00 1.25 0.00 0.00 42.46 40.53 2cpy s ILE 551 CO 0.07 -0.01 1.12 -2.16 0.24 0.00 0.00 174.94 174.20 2cpy s PRO 552 N -2.75 4.56 0.00 0.37 0.04 -1.26 -4.43 135.00 131.52 2cpy s PRO 552 Ca 0.28 1.73 0.08 0.00 0.04 0.00 0.00 61.00 63.13 2cpy s PRO 552 Cb -0.11 -3.29 0.45 0.00 0.04 0.00 0.00 34.50 31.60 2cpy s PRO 552 CO 0.21 0.01 1.17 1.97 0.04 0.00 0.00 177.00 180.39 2cpy n PHE 553 N 2.61 0.00 0.06 0.56 1.16 -1.26 -3.02 117.46 117.57 2cpy n PHE 553 Ca 0.04 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.59 2cpy n PHE 553 Cb 0.46 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.26 2cpy n PHE 553 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 2cpy h SER 554 N 0.00 0.00 -3.45 5.98 4.64 -1.91 -3.47 113.55 115.34 2cpy h SER 554 Ca 0.00 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.87 2cpy h SER 554 Cb 0.00 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.16 2cpy h SER 554 CO 0.00 0.75 0.17 0.27 -0.87 0.00 0.00 176.83 177.15 2cpy s ILE 555 N -2.82 2.34 0.27 0.95 -4.36 -1.17 -5.12 121.20 111.30 2cpy s ILE 555 Ca -0.00 -0.36 0.05 0.00 -0.26 0.00 0.00 60.65 60.08 2cpy s ILE 555 Cb 0.09 -2.98 -0.06 0.00 1.25 0.00 0.00 42.46 40.76 2cpy s ILE 555 CO 0.80 0.00 -0.01 0.42 0.24 0.00 0.00 174.94 176.38 2cpy s THR 556 N -3.16 1.34 0.27 8.37 -4.23 -1.26 -5.00 115.64 111.97 2cpy s THR 556 Ca 0.60 -2.06 -0.05 0.00 -1.18 0.00 0.00 61.69 59.00 2cpy s THR 556 Cb -0.10 -2.49 0.42 0.00 1.34 0.00 0.00 72.50 71.66 2cpy s THR 556 CO 0.44 -0.24 1.45 1.17 -0.54 0.00 0.00 174.62 176.89 2cpy n LYS 557 N -0.55 -0.08 -0.31 3.99 4.81 -1.26 0.15 118.16 124.91 2cpy n LYS 557 Ca -0.05 1.43 0.13 0.00 -0.87 0.00 0.00 58.31 58.95 2cpy n LYS 557 Cb 0.64 -2.17 0.31 0.00 0.02 0.00 0.00 35.03 33.83 2cpy n LYS 557 CO 0.00 0.00 0.00 0.52 1.17 0.00 0.00 177.40 179.09 2cpy h MET 558 N 0.00 0.41 -0.28 1.64 2.86 -1.97 0.79 114.93 118.37 2cpy h MET 558 Ca 0.48 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 58.08 2cpy h MET 558 Cb 0.82 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.37 2cpy h MET 558 CO -0.93 0.27 0.10 -0.44 1.06 0.00 0.00 176.91 176.98 2cpy h ASP 559 N 0.43 0.40 0.25 1.22 5.19 0.10 -3.11 116.42 120.90 2cpy h ASP 559 Ca 0.56 -0.18 -0.00 0.00 -0.62 0.00 0.00 57.03 56.79 2cpy h ASP 559 Cb 1.06 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.46 2cpy h ASP 559 CO -0.52 0.47 -0.18 0.58 -3.12 0.00 0.00 179.24 176.48 2cpy h VAL 560 N 0.31 0.61 -1.45 -1.35 2.07 -0.58 -1.82 116.25 114.04 2cpy h VAL 560 Ca 0.09 0.00 0.43 0.00 0.82 0.00 0.00 66.70 68.04 2cpy h VAL 560 Cb 0.21 0.61 -0.07 0.00 -1.52 0.00 0.00 31.29 30.51 2cpy h VAL 560 CO -0.01 0.00 1.03 -0.07 0.02 0.00 0.00 177.57 178.54 2cpy h LEU 561 N -0.43 0.07 0.24 2.57 3.38 -1.07 0.64 115.31 120.71 2cpy h LEU 561 Ca -0.02 0.03 -0.31 0.00 0.09 0.00 0.00 57.88 57.67 2cpy h LEU 561 Cb 0.38 0.02 0.04 0.00 0.09 0.00 0.00 40.66 41.18 2cpy h LEU 561 CO 0.00 -0.02 -1.37 -0.61 0.09 0.00 0.00 178.44 176.53 2cpy h GLN 562 N 0.05 0.50 -0.35 1.13 4.15 -1.29 -3.27 115.11 116.03 2cpy h GLN 562 Ca 0.73 -0.85 0.10 0.00 0.77 0.00 0.00 58.65 59.39 2cpy h GLN 562 Cb 2.74 0.32 -0.01 0.00 0.21 0.00 0.00 27.48 30.74 2cpy h GLN 562 CO -0.09 1.41 0.33 0.35 -1.93 0.00 0.00 178.83 178.89 2cpy h PHE 563 N 0.05 0.00 -0.59 3.99 3.57 0.98 0.33 116.94 125.28 2cpy h PHE 563 Ca -0.24 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.07 2cpy h PHE 563 Cb 2.08 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 40.71 2cpy h PHE 563 CO 0.14 0.00 0.24 1.28 -2.23 0.00 0.00 178.31 177.74 2cpy n LEU 564 N -3.94 5.18 -4.49 0.59 4.77 -0.90 -4.99 117.00 113.22 2cpy n LEU 564 Ca 0.06 -2.69 -0.54 0.00 -0.03 0.00 0.00 56.01 52.81 2cpy n LEU 564 Cb 0.49 -0.70 -0.06 0.00 -2.33 0.00 0.00 43.42 40.83 2cpy n LEU 564 CO 0.30 0.72 0.44 1.21 -1.33 0.00 0.00 177.39 178.73 2cpy n GLU 565 N -0.11 0.24 0.00 3.23 4.07 0.12 -1.73 120.64 126.46 2cpy n GLU 565 Ca 0.33 0.09 0.00 0.00 -0.06 0.00 0.00 57.16 57.51 2cpy n GLU 565 Cb 1.17 -1.45 0.00 0.00 -0.06 0.00 0.00 31.44 31.10 2cpy n GLU 565 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2cpy n GLY 566 N 1.77 2.91 3.59 8.31 0.00 -1.26 -5.04 105.19 115.47 2cpy n GLY 566 Ca 0.19 -0.86 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.76 4.45 -1.15 -0.61 1.01 -0.70 -4.96 121.20 118.47 2cpy s ILE 567 Ca 0.00 1.07 -0.22 0.00 0.00 0.00 0.00 60.65 61.50 2cpy s ILE 567 Cb 0.00 -4.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.02 2cpy s ILE 567 CO 0.00 -0.76 1.80 -2.16 0.00 0.00 0.00 174.94 173.82 2cpy s PRO 568 N 3.82 3.14 0.11 2.79 0.04 -1.26 -4.93 135.00 138.71 2cpy s PRO 568 Ca 0.40 -1.28 0.07 0.00 0.04 0.00 0.00 61.00 60.24 2cpy s PRO 568 Cb -0.10 -5.33 -0.03 0.00 0.04 0.00 0.00 34.50 29.08 2cpy s PRO 568 CO 0.24 -3.07 -0.18 0.54 0.04 0.00 0.00 177.00 174.57 2cpy s VAL 569 N 7.80 1.57 1.35 -0.36 0.11 -1.26 -5.07 120.40 124.54 2cpy s VAL 569 Ca 0.61 -1.56 -0.20 0.00 -2.93 0.00 0.00 61.98 57.89 2cpy s VAL 569 Cb -0.00 -1.49 0.35 0.00 -1.53 0.00 0.00 36.38 33.70 2cpy s VAL 569 CO 0.06 -0.17 0.95 -1.81 -3.33 0.00 0.00 175.10 170.81 2cpy s ASP 570 N -2.03 -0.53 -0.05 3.54 1.11 -1.26 -4.97 116.67 112.47 2cpy s ASP 570 Ca 0.06 1.05 0.01 0.00 0.18 0.00 0.00 52.55 53.85 2cpy s ASP 570 Cb -0.09 -1.55 -0.25 0.00 1.07 0.00 0.00 42.92 42.10 2cpy s ASP 570 CO 0.04 -5.07 0.63 -0.08 1.18 0.00 0.00 175.17 171.88 2cpy h GLU 571 N -3.22 0.16 -0.31 8.23 4.81 -2.00 -3.36 114.58 118.90 2cpy h GLU 571 Ca -0.49 -0.28 -0.16 0.00 -0.13 0.00 0.00 59.36 58.30 2cpy h GLU 571 Cb 1.34 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.82 2cpy h GLU 571 CO 0.35 0.93 -0.43 -2.95 -0.73 0.00 0.00 179.01 176.18 2cpy h ASN 572 N 0.04 0.83 -1.22 1.04 -1.07 -1.99 -3.13 115.58 110.09 2cpy h ASN 572 Ca -0.31 -0.39 0.44 0.00 0.07 0.00 0.00 56.30 56.10 2cpy h ASN 572 Cb 2.02 -0.24 -0.14 0.00 -2.07 0.00 0.00 38.32 37.89 2cpy h ASN 572 CO 0.11 1.15 0.76 0.00 0.07 0.00 0.00 177.43 179.51 2cpy n ALA 573 N -2.53 1.22 -2.66 4.14 0.00 -1.26 -4.04 120.51 115.38 2cpy n ALA 573 Ca -0.02 0.87 -0.41 0.00 0.00 0.00 0.00 53.44 53.87 2cpy n ALA 573 Cb 0.55 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.96 2cpy n ALA 573 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2cpy s VAL 574 N -5.24 4.90 -0.35 0.00 1.01 -1.18 -1.51 120.40 118.02 2cpy s VAL 574 Ca -0.07 1.50 -0.02 0.00 0.00 0.00 0.00 61.98 63.39 2cpy s VAL 574 Cb 0.30 -4.08 0.08 0.00 0.00 0.00 0.00 36.38 32.68 2cpy s VAL 574 CO 0.77 0.02 0.10 -1.00 0.00 0.00 0.00 175.10 174.99 2cpy s HIS 575 N 2.27 3.47 0.42 5.22 3.76 0.92 -4.95 115.29 126.39 2cpy s HIS 575 Ca 0.35 -2.23 -0.22 0.00 -0.15 0.00 0.00 55.06 52.81 2cpy s HIS 575 Cb -0.16 -2.70 -0.10 0.00 1.11 0.00 0.00 32.58 30.73 2cpy s HIS 575 CO 0.11 -0.89 0.99 0.08 -0.85 0.00 0.00 174.74 174.17 2cpy s VAL 576 N 1.17 4.12 0.21 -0.90 1.01 -1.26 -0.61 120.40 124.13 2cpy s VAL 576 Ca 0.03 1.42 -0.09 0.00 0.00 0.00 0.00 61.98 63.33 2cpy s VAL 576 Cb -0.21 -3.63 -0.07 0.00 0.00 0.00 0.00 36.38 32.47 2cpy s VAL 576 CO -0.03 -0.19 0.52 -0.76 0.00 0.00 0.00 175.10 174.64 2cpy s LEU 577 N -3.02 4.19 0.02 3.92 1.43 -0.91 -4.93 118.68 119.39 2cpy s LEU 577 Ca 0.61 0.88 -0.03 0.00 -1.03 0.00 0.00 54.13 54.56 2cpy s LEU 577 Cb -0.14 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 2cpy s LEU 577 CO 0.18 -0.04 0.05 0.68 0.23 0.00 0.00 176.35 177.45 2cpy s VAL 578 N -1.77 0.12 0.52 -1.59 -7.23 -1.26 -4.15 120.40 105.04 2cpy s VAL 578 Ca 0.46 -0.98 0.02 0.00 -1.81 0.00 0.00 61.98 59.68 2cpy s VAL 578 Cb -0.12 -0.57 0.00 0.00 0.56 0.00 0.00 36.38 36.25 2cpy s VAL 578 CO 0.21 -0.54 0.12 -0.62 -0.31 0.00 0.00 175.10 173.97 2cpy s ASP 579 N -1.73 4.28 0.40 4.85 2.15 -1.26 -4.67 116.67 120.69 2cpy s ASP 579 Ca -0.11 -1.53 0.25 0.00 0.43 0.00 0.00 52.55 51.59 2cpy s ASP 579 Cb -0.06 0.48 1.35 0.00 -0.30 0.00 0.00 42.92 44.39 2cpy s ASP 579 CO -0.02 -0.92 1.62 -1.13 -0.17 0.00 0.00 175.17 174.54 2cpy h ASN 580 N 1.17 0.31 1.12 -0.34 -1.24 -2.02 1.82 115.58 116.41 2cpy h ASN 580 Ca -0.42 0.18 -0.14 0.00 0.71 0.00 0.00 56.30 56.64 2cpy h ASN 580 Cb 1.31 0.17 -0.02 0.00 0.73 0.00 0.00 38.32 40.51 2cpy h ASN 580 CO 0.69 -0.25 -0.93 -1.13 -1.29 0.00 0.00 177.43 174.53 2cpy h ASN 581 N 0.10 0.00 0.00 1.15 -0.73 -1.99 -3.48 115.58 110.63 2cpy h ASN 581 Ca 0.82 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.99 2cpy h ASN 581 Cb 2.33 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.92 2cpy h ASN 581 CO -0.55 0.56 0.00 0.61 -0.37 0.00 0.00 177.43 177.67 2cpy n GLY 582 N 1.30 2.74 0.15 1.57 0.00 0.62 -4.90 105.19 106.67 2cpy n GLY 582 Ca -0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.08 2cpy n GLY 582 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cpy n GLN 583 N -0.67 0.12 -1.39 1.61 10.64 -1.26 -4.11 117.38 122.32 2cpy n GLN 583 Ca 0.00 0.61 0.17 0.00 -1.83 0.00 0.00 57.00 55.95 2cpy n GLN 583 Cb 0.00 -1.95 -0.06 0.00 -0.86 0.00 0.00 30.24 27.37 2cpy n GLN 583 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2cpy n GLY 584 N -1.31 -2.38 1.87 2.61 0.00 -1.26 -4.04 105.19 100.68 2cpy n GLY 584 Ca -0.01 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 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 -4.13 6.17 -3.97 0.99 4.77 -1.26 -4.72 117.00 114.84 2cpy n LEU 585 Ca -0.03 -3.18 -0.38 0.00 -0.03 0.00 0.00 56.01 52.39 2cpy n LEU 585 Cb 0.67 -1.11 0.01 0.00 -2.33 0.00 0.00 43.42 40.66 2cpy n LEU 585 CO 0.03 1.25 -0.18 0.61 -1.33 0.00 0.00 177.39 177.77 2cpy n GLY 586 N 0.76 -0.73 3.32 -0.72 0.00 -1.26 -4.90 105.19 101.66 2cpy n GLY 586 Ca 0.26 0.33 -0.10 0.00 0.00 0.00 0.00 46.02 46.52 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 -6.89 1.07 -0.20 1.61 -0.21 -1.26 -3.00 119.66 110.78 2cpy s GLN 587 Ca 0.37 -0.94 -0.27 0.00 0.02 0.00 0.00 55.36 54.55 2cpy s GLN 587 Cb -0.18 0.41 0.07 0.00 1.00 0.00 0.00 33.01 34.31 2cpy s GLN 587 CO 0.93 -0.40 0.71 0.00 -2.12 0.00 0.00 175.29 174.41 2cpy s ALA 588 N -3.88 -1.77 0.13 6.09 0.00 -0.81 -2.14 121.76 119.38 2cpy s ALA 588 Ca 0.09 1.80 0.04 0.00 0.00 0.00 0.00 51.96 53.89 2cpy s ALA 588 Cb 0.03 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 2cpy s ALA 588 CO -0.07 -0.35 0.10 -0.51 0.00 0.00 0.00 175.76 174.93 2cpy s LEU 589 N -0.11 3.74 -0.08 0.00 1.43 0.22 -0.37 118.68 123.52 2cpy s LEU 589 Ca -0.03 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 2cpy s LEU 589 Cb -0.03 -2.39 0.02 0.00 0.03 0.00 0.00 46.19 43.82 2cpy s LEU 589 CO 0.04 0.11 -0.06 -0.69 0.23 0.00 0.00 176.35 175.98 2cpy s VAL 590 N -1.59 0.80 -0.22 -1.59 1.01 0.29 -0.06 120.40 119.05 2cpy s VAL 590 Ca 0.30 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 2cpy s VAL 590 Cb -0.11 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 2cpy s VAL 590 CO 0.22 0.31 -0.02 -1.58 0.00 0.00 0.00 175.10 174.04 2cpy s GLN 591 N 1.32 3.48 0.55 2.72 0.74 -0.57 -0.12 119.66 127.80 2cpy s GLN 591 Ca -0.03 -0.58 0.07 0.00 0.05 0.00 0.00 55.36 54.87 2cpy s GLN 591 Cb -0.14 -3.07 0.06 0.00 1.10 0.00 0.00 33.01 30.96 2cpy s GLN 591 CO -0.03 -0.13 0.58 -0.06 -0.55 0.00 0.00 175.29 175.10 2cpy s PHE 592 N 1.35 1.56 -0.14 1.67 0.08 0.37 -4.70 117.98 118.17 2cpy s PHE 592 Ca 0.04 -0.78 0.18 0.00 0.12 0.00 0.00 56.93 56.50 2cpy s PHE 592 Cb -0.14 -2.06 -0.25 0.00 -0.57 0.00 0.00 43.02 40.00 2cpy s PHE 592 CO -0.00 -0.78 0.33 1.63 -0.10 0.00 0.00 175.22 176.30 2cpy n LYS 593 N -1.98 0.67 -3.92 0.44 4.76 -1.26 -4.83 118.16 112.04 2cpy n LYS 593 Ca 0.07 0.02 -0.09 0.00 -2.87 0.00 0.00 58.31 55.44 2cpy n LYS 593 Cb 0.63 -1.59 -0.03 0.00 -1.84 0.00 0.00 35.03 32.20 2cpy n LYS 593 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2cpy s ASN 594 N -5.41 -0.08 0.25 4.39 2.20 -1.26 -5.02 114.94 110.00 2cpy s ASN 594 Ca -0.08 -0.86 -0.05 0.00 -0.94 0.00 0.00 52.86 50.93 2cpy s ASN 594 Cb 0.08 0.69 0.26 0.00 -2.00 0.00 0.00 41.25 40.29 2cpy s ASN 594 CO 0.84 -1.32 1.84 -0.33 -2.94 0.00 0.00 177.10 175.20 2cpy h GLU 595 N 2.10 1.14 -1.56 3.55 5.08 -1.95 -2.47 114.58 120.47 2cpy h GLU 595 Ca -0.24 -0.16 0.49 0.00 -1.00 0.00 0.00 59.36 58.45 2cpy h GLU 595 Cb 1.25 -0.21 -0.11 0.00 0.50 0.00 0.00 28.75 30.18 2cpy h GLU 595 CO 0.31 0.88 1.06 0.22 -1.00 0.00 0.00 179.01 180.48 2cpy h ASP 596 N 1.12 0.14 0.11 1.42 1.82 -1.96 0.55 116.42 119.63 2cpy h ASP 596 Ca 0.27 0.09 -0.36 0.00 -0.39 0.00 0.00 57.03 56.64 2cpy h ASP 596 Cb 0.12 0.09 -0.05 0.00 0.68 0.00 0.00 39.33 40.17 2cpy h ASP 596 CO -0.03 -0.13 -2.19 0.47 -1.61 0.00 0.00 179.24 175.74 2cpy n ASP 597 N -4.42 1.57 0.49 2.28 8.00 -0.97 -4.31 116.55 119.18 2cpy n ASP 597 Ca 0.40 0.08 -0.19 0.00 0.71 0.00 0.00 54.79 55.79 2cpy n ASP 597 Cb 1.67 -0.30 -0.09 0.00 -0.02 0.00 0.00 41.12 42.38 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 0.32 -1.27 -0.88 2.24 0.00 0.34 -3.18 119.26 116.84 2cpy h ALA 598 Ca -0.48 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 54.27 2cpy h ALA 598 Cb 2.02 0.48 -0.12 0.00 0.00 0.00 0.00 17.79 20.16 2cpy h ALA 598 CO 0.01 -1.18 -0.43 0.54 0.00 0.00 0.00 179.25 178.20 2cpy n ARG 599 N -5.52 -0.30 -0.35 0.00 5.12 0.84 0.48 116.66 116.94 2cpy n ARG 599 Ca -0.15 1.34 0.06 0.00 -1.93 0.00 0.00 57.85 57.16 2cpy n ARG 599 Cb 0.49 -1.97 0.14 0.00 -1.16 0.00 0.00 32.46 29.96 2cpy n ARG 599 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2cpy n LYS 600 N -5.19 -0.09 -0.30 5.56 5.02 -1.20 0.66 118.16 122.61 2cpy n LYS 600 Ca 0.05 1.52 0.11 0.00 -2.02 0.00 0.00 58.31 57.97 2cpy n LYS 600 Cb 0.29 -2.27 0.25 0.00 -0.02 0.00 0.00 35.03 33.27 2cpy n LYS 600 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2cpy h SER 601 N 0.00 -0.33 -0.67 4.39 4.64 -0.00 1.02 113.55 122.60 2cpy h SER 601 Ca 0.47 0.23 0.09 0.00 -0.47 0.00 0.00 61.79 62.12 2cpy h SER 601 Cb 0.73 0.39 -0.04 0.00 -0.31 0.00 0.00 62.40 63.17 2cpy h SER 601 CO -1.00 -0.25 0.45 -0.33 -0.87 0.00 0.00 176.83 174.82 2cpy h GLU 602 N 0.08 0.54 -0.00 4.77 5.08 0.20 0.93 114.58 126.18 2cpy h GLU 602 Ca 0.53 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.86 2cpy h GLU 602 Cb 1.03 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.16 2cpy h GLU 602 CO -0.78 0.35 0.05 -0.09 -1.00 0.00 0.00 179.01 177.54 2cpy h ARG 603 N 0.55 0.00 -0.60 2.33 2.43 0.12 0.24 114.38 119.44 2cpy h ARG 603 Ca 0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 2cpy h ARG 603 Cb 0.47 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2cpy h ARG 603 CO -0.10 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.64 2cpy n LEU 604 N -3.13 4.47 -4.77 3.80 4.77 0.32 -4.99 117.00 117.47 2cpy n LEU 604 Ca -0.03 -2.41 -0.40 0.00 -0.03 0.00 0.00 56.01 53.15 2cpy n LEU 604 Cb 0.12 -0.54 -0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2cpy n LEU 604 CO 0.20 0.82 1.00 -2.28 -1.33 0.00 0.00 177.39 175.79 2cpy s HIS 605 N -1.76 2.76 -1.45 -1.77 2.46 0.83 -2.70 115.29 113.66 2cpy s HIS 605 Ca 0.48 1.36 -0.07 0.00 0.47 0.00 0.00 55.06 57.30 2cpy s HIS 605 Cb 0.30 -3.75 0.01 0.00 -0.13 0.00 0.00 32.58 29.01 2cpy s HIS 605 CO 0.24 -2.31 0.90 0.54 -2.47 0.00 0.00 174.74 171.64 2cpy n ARG 606 N 0.18 -6.45 -1.80 2.88 1.74 -0.97 -4.95 116.66 107.29 2cpy n ARG 606 Ca 0.03 0.87 -0.23 0.00 -0.77 0.00 0.00 57.85 57.74 2cpy n ARG 606 Cb 0.43 -5.81 0.15 0.00 -1.02 0.00 0.00 32.46 26.21 2cpy n ARG 606 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2cpy n LYS 607 N -4.51 -0.80 -3.88 5.56 4.76 -0.86 -4.77 118.16 113.67 2cpy n LYS 607 Ca -0.05 -1.91 -0.30 0.00 -2.87 0.00 0.00 58.31 53.18 2cpy n LYS 607 Cb 0.59 -1.00 -0.15 0.00 -1.84 0.00 0.00 35.03 32.63 2cpy n LYS 607 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2cpy s LYS 608 N -5.26 1.12 -0.32 1.97 1.02 -1.26 -0.33 119.74 116.68 2cpy s LYS 608 Ca 0.62 -1.51 -0.11 0.00 0.02 0.00 0.00 55.97 55.00 2cpy s LYS 608 Cb -0.02 -2.62 -0.01 0.00 -0.52 0.00 0.00 37.83 34.66 2cpy s LYS 608 CO 0.43 -0.97 0.18 -1.17 -0.92 0.00 0.00 175.35 172.90 2cpy s LEU 609 N 1.22 4.23 -1.76 3.17 0.20 -0.44 -4.38 118.68 120.93 2cpy s LEU 609 Ca 0.11 -0.50 0.00 0.00 0.69 0.00 0.00 54.13 54.43 2cpy s LEU 609 Cb -0.18 -2.04 0.00 0.00 -0.43 0.00 0.00 46.19 43.54 2cpy s LEU 609 CO -0.16 -0.21 0.00 0.59 -0.29 0.00 0.00 176.35 176.28 2cpy n ASN 610 N 5.02 -5.50 0.00 3.68 3.02 -1.26 -1.24 115.26 118.99 2cpy n ASN 610 Ca -0.13 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 2cpy n ASN 610 Cb 0.49 -4.58 0.00 0.00 -0.61 0.00 0.00 39.78 35.08 2cpy n ASN 610 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cpy n GLY 611 N -0.91 0.49 2.99 7.41 0.00 -1.26 -5.03 105.19 108.88 2cpy n GLY 611 Ca -0.22 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.12 2.06 -0.10 1.61 0.52 -0.37 -5.09 118.95 116.46 2cpy s ARG 612 Ca 0.00 -0.47 -0.36 0.00 -0.52 0.00 0.00 55.73 54.38 2cpy s ARG 612 Cb 0.00 -1.92 -0.13 0.00 0.52 0.00 0.00 34.95 33.42 2cpy s ARG 612 CO 0.00 -0.22 1.80 0.39 0.02 0.00 0.00 175.30 177.29 2cpy n GLU 613 N 4.73 1.89 -3.80 3.54 1.02 -1.26 -1.33 120.64 125.43 2cpy n GLU 613 Ca -0.16 0.69 -0.36 0.00 -0.02 0.00 0.00 57.16 57.31 2cpy n GLU 613 Cb 0.50 -2.48 -0.13 0.00 -0.02 0.00 0.00 31.44 29.31 2cpy n GLU 613 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cpy s ALA 614 N 3.49 3.06 -0.18 0.62 0.00 0.55 -4.64 121.76 124.65 2cpy s ALA 614 Ca 0.92 -1.14 -0.15 0.00 0.00 0.00 0.00 51.96 51.59 2cpy s ALA 614 Cb -0.79 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 2cpy s ALA 614 CO 0.53 -0.47 0.36 -0.06 0.00 0.00 0.00 175.76 176.13 2cpy s PHE 615 N 1.56 3.41 -0.31 0.00 0.40 -0.76 -2.03 117.98 120.26 2cpy s PHE 615 Ca 0.06 0.62 -0.03 0.00 -0.60 0.00 0.00 56.93 56.98 2cpy s PHE 615 Cb -0.15 -2.46 0.04 0.00 0.51 0.00 0.00 43.02 40.97 2cpy s PHE 615 CO 0.02 0.09 0.03 0.08 0.70 0.00 0.00 175.22 176.14 2cpy s VAL 616 N 0.95 3.26 -0.07 -0.44 1.01 -1.26 -1.46 120.40 122.39 2cpy s VAL 616 Ca 0.18 -1.28 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 2cpy s VAL 616 Cb -0.14 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 2cpy s VAL 616 CO 0.07 -0.12 0.08 -1.00 0.00 0.00 0.00 175.10 174.13 2cpy s HIS 617 N 1.31 3.37 -0.24 5.22 3.76 -0.35 -4.81 115.29 123.54 2cpy s HIS 617 Ca -0.04 0.32 -0.12 0.00 -0.15 0.00 0.00 55.06 55.07 2cpy s HIS 617 Cb -0.20 -1.83 -0.05 0.00 1.11 0.00 0.00 32.58 31.62 2cpy s HIS 617 CO 0.00 0.59 0.24 0.08 -0.85 0.00 0.00 174.74 174.80 2cpy s VAL 618 N -1.04 5.30 0.27 -0.90 1.01 -1.26 -0.68 120.40 123.10 2cpy s VAL 618 Ca 0.17 0.33 0.02 0.00 0.00 0.00 0.00 61.98 62.50 2cpy s VAL 618 Cb -0.12 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2cpy s VAL 618 CO 0.07 0.29 0.14 0.68 0.00 0.00 0.00 175.10 176.27 2cpy s VAL 619 N 1.35 0.31 0.12 2.92 -7.23 -0.42 -5.00 120.40 112.45 2cpy s VAL 619 Ca 0.11 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.25 2cpy s VAL 619 Cb -0.14 -2.55 -0.05 0.00 0.56 0.00 0.00 36.38 34.20 2cpy s VAL 619 CO 0.07 0.00 0.33 0.42 -0.31 0.00 0.00 175.10 175.61 2cpy s THR 620 N -3.77 5.23 0.17 5.32 -4.23 -1.26 -2.67 115.64 114.43 2cpy s THR 620 Ca 0.37 -0.12 -0.23 0.00 -1.18 0.00 0.00 61.69 60.53 2cpy s THR 620 Cb 0.06 -3.63 0.06 0.00 1.34 0.00 0.00 72.50 70.33 2cpy s THR 620 CO 0.15 0.05 1.41 -0.11 -0.54 0.00 0.00 174.62 175.58 2cpy n LEU 621 N 0.08 -0.79 -0.32 4.79 7.94 -1.26 0.14 117.00 127.57 2cpy n LEU 621 Ca -0.03 1.60 0.16 0.00 -1.11 0.00 0.00 56.01 56.63 2cpy n LEU 621 Cb 0.52 -0.28 0.36 0.00 0.53 0.00 0.00 43.42 44.55 2cpy n LEU 621 CO 0.50 -1.37 1.08 1.05 -1.11 0.00 0.00 177.39 177.54 2cpy h GLU 622 N 0.00 0.41 -0.13 1.96 4.11 -1.98 0.26 114.58 119.20 2cpy h GLU 622 Ca 0.22 -0.02 -0.17 0.00 0.07 0.00 0.00 59.36 59.46 2cpy h GLU 622 Cb 0.45 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.61 2cpy h GLU 622 CO -0.88 0.27 -0.57 -0.44 0.07 0.00 0.00 179.01 177.47 2cpy h ASP 623 N 0.42 0.73 -0.90 3.06 3.32 0.77 -2.99 116.42 120.84 2cpy h ASP 623 Ca 0.62 -0.62 0.01 0.00 0.02 0.00 0.00 57.03 57.05 2cpy h ASP 623 Cb 1.22 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.51 2cpy h ASP 623 CO -0.54 1.24 0.59 -0.03 -1.72 0.00 0.00 179.24 178.78 2cpy h MET 624 N 0.27 1.18 -0.65 3.56 4.05 0.21 -2.16 114.93 121.39 2cpy h MET 624 Ca -0.03 -0.07 -0.05 0.00 -0.28 0.00 0.00 59.70 59.26 2cpy h MET 624 Cb 1.21 -0.27 -0.03 0.00 -0.80 0.00 0.00 31.60 31.71 2cpy h MET 624 CO 0.12 0.78 0.20 -0.09 0.23 0.00 0.00 176.91 178.15 2cpy h ARG 625 N 1.21 1.01 0.00 0.39 2.43 -0.64 -2.21 114.38 116.57 2cpy h ARG 625 Ca 0.33 -0.22 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 2cpy h ARG 625 Cb -0.14 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.26 2cpy h ARG 625 CO -0.07 0.88 -0.18 0.93 -1.51 0.00 0.00 179.97 180.02 2cpy h GLU 626 N 0.94 0.00 -0.06 0.20 4.39 -1.27 -2.03 114.58 116.76 2cpy h GLU 626 Ca 0.21 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.67 2cpy h GLU 626 Cb 0.29 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.96 2cpy h GLU 626 CO -0.01 0.18 -0.91 0.82 -1.16 0.00 0.00 179.01 177.93 2cpy h ILE 627 N 0.00 1.31 0.07 3.13 2.04 -0.82 -2.38 117.51 120.86 2cpy h ILE 627 Ca -0.00 -2.19 -0.00 0.00 1.00 0.00 0.00 64.86 63.67 2cpy h ILE 627 Cb 0.43 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2cpy h ILE 627 CO 0.02 0.68 -0.04 -0.08 0.00 0.00 0.00 178.15 178.73 2cpy h GLU 628 N 0.40 -0.10 -0.49 2.37 4.81 -1.09 -1.75 114.58 118.73 2cpy h GLU 628 Ca -0.09 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.19 2cpy h GLU 628 Cb 1.55 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.91 2cpy h GLU 628 CO 0.18 0.35 0.25 1.57 -0.73 0.00 0.00 179.01 180.63 2cpy h LYS 629 N -0.59 0.48 -2.87 1.92 2.10 -1.48 -3.33 116.57 112.79 2cpy h LYS 629 Ca -0.01 -0.03 -0.61 0.00 -2.00 0.00 0.00 60.65 58.00 2cpy h LYS 629 Cb 0.49 -0.11 -0.40 0.00 -0.90 0.00 0.00 32.23 31.31 2cpy h LYS 629 CO 0.02 0.32 -0.73 1.21 -2.00 0.00 0.00 179.45 178.26 2cpy s ASN 630 N -5.50 3.55 0.44 7.07 3.84 -0.90 -5.11 114.94 118.33 2cpy s ASN 630 Ca -0.13 -3.28 -0.22 0.00 0.21 0.00 0.00 52.86 49.45 2cpy s ASN 630 Cb 0.13 -1.15 -0.09 0.00 -0.55 0.00 0.00 41.25 39.59 2cpy s ASN 630 CO 0.73 -0.16 1.01 -2.16 -2.79 0.00 0.00 177.10 173.73 2cpy s PRO 631 N -0.51 4.08 0.70 0.43 0.04 -0.66 -4.54 135.00 134.54 2cpy s PRO 631 Ca 0.25 1.33 -0.11 0.00 0.04 0.00 0.00 61.00 62.51 2cpy s PRO 631 Cb -0.08 -2.29 0.01 0.00 0.04 0.00 0.00 34.50 32.18 2cpy s PRO 631 CO -0.12 -0.19 1.06 -1.25 0.04 0.00 0.00 177.00 176.54 2cpy s PRO 632 N -2.94 2.95 -0.15 0.56 0.04 -1.26 -5.03 135.00 129.16 2cpy s PRO 632 Ca 0.62 0.79 -0.12 0.00 0.04 0.00 0.00 61.00 62.32 2cpy s PRO 632 Cb -0.16 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 32.30 2cpy s PRO 632 CO 0.20 -1.05 -0.01 0.00 0.04 0.00 0.00 177.00 176.19 2cpy h ALA 633 N -0.67 0.07 -2.41 8.56 0.00 -1.99 -3.49 119.26 119.33 2cpy h ALA 633 Ca -0.45 -0.64 -0.17 0.00 0.00 0.00 0.00 54.91 53.65 2cpy h ALA 633 Cb 1.22 0.49 -0.16 0.00 0.00 0.00 0.00 17.79 19.34 2cpy h ALA 633 CO 0.59 0.48 -0.69 -1.14 0.00 0.00 0.00 179.25 178.49 2cpy s GLN 634 N -2.19 0.64 -0.49 0.00 2.00 -1.26 -5.02 119.66 113.33 2cpy s GLN 634 Ca -0.17 -1.14 0.07 0.00 -2.00 0.00 0.00 55.36 52.12 2cpy s GLN 634 Cb 0.03 0.02 0.19 0.00 0.80 0.00 0.00 33.01 34.04 2cpy s GLN 634 CO 0.31 -0.06 0.67 0.20 -0.50 0.00 0.00 175.29 175.91 2cpy s GLY 635 N -2.66 -0.96 -0.39 2.59 0.00 -1.26 -5.10 107.32 99.54 2cpy s GLY 635 Ca 0.04 -0.61 -0.05 0.00 0.00 0.00 0.00 44.72 44.11 2cpy s GLY 635 CO -0.06 3.47 0.18 0.54 0.00 0.00 0.00 173.10 177.22 2cpy s LYS 636 N 0.88 2.28 0.22 2.90 -0.14 -1.26 -5.02 119.74 119.59 2cpy s LYS 636 Ca 0.29 -1.59 -0.22 0.00 -1.36 0.00 0.00 55.97 53.08 2cpy s LYS 636 Cb -0.00 -3.56 0.06 0.00 -1.68 0.00 0.00 37.83 32.64 2cpy s LYS 636 CO -0.07 -0.94 0.93 -1.54 -0.76 0.00 0.00 175.35 172.96 2cpy s SER 637 N 1.81 -0.11 0.16 2.83 1.04 -1.26 -5.16 113.70 113.01 2cpy s SER 637 Ca 0.04 -0.63 -0.27 0.00 0.48 0.00 0.00 55.95 55.58 2cpy s SER 637 Cb -0.22 0.58 -0.08 0.00 0.10 0.00 0.00 66.02 66.40 2cpy s SER 637 CO -0.02 -1.11 0.82 -0.83 0.98 0.00 0.00 173.24 173.09 2cpy s GLY 638 N -3.09 2.95 0.61 7.32 0.00 -1.26 -4.92 107.32 108.93 2cpy s GLY 638 Ca 0.15 0.42 0.27 0.00 0.00 0.00 0.00 44.72 45.56 2cpy s GLY 638 CO 0.05 1.01 1.62 -2.55 0.00 0.00 0.00 173.10 173.23 2cpy h PRO 639 N 4.59 0.00 -6.66 2.90 0.11 -2.02 -3.40 132.00 127.52 2cpy h PRO 639 Ca -0.46 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.15 2cpy h PRO 639 Cb 1.21 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.32 2cpy h PRO 639 CO 0.68 0.00 -0.04 -1.54 -0.21 0.00 0.00 178.00 176.89 2cpy s SER 640 N -4.32 6.40 -0.05 -2.05 1.04 -1.26 -5.04 113.70 108.42 2cpy s SER 640 Ca -0.03 0.82 -0.09 0.00 0.48 0.00 0.00 55.95 57.12 2cpy s SER 640 Cb 0.13 -2.19 -0.03 0.00 0.10 0.00 0.00 66.02 64.03 2cpy s SER 640 CO 0.46 -0.33 -0.18 -0.24 0.98 0.00 0.00 173.24 173.93 2cpy n SER 641 N -1.40 1.47 0.00 7.02 2.88 -1.26 -5.13 113.62 117.19 2cpy n SER 641 Ca -0.01 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 2cpy n SER 641 Cb 0.54 -0.53 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 2cpy n SER 641 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42