#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d2p s THR 536 N 0.00 2.56 0.20 6.31 -4.23 -1.26 -1.81 115.64 117.41 1d2p s THR 536 Ca 0.00 -1.32 -0.02 0.00 -1.18 0.00 0.00 61.69 59.18 1d2p s THR 536 Cb 0.00 -2.87 -0.04 0.00 1.34 0.00 0.00 72.50 70.93 1d2p s THR 536 CO 0.00 0.00 0.15 -0.89 -0.54 0.00 0.00 174.62 173.34 1d2p s THR 537 N -2.50 0.01 -0.04 3.99 2.01 0.50 -4.74 115.64 114.87 1d2p s THR 537 Ca 0.48 -1.95 0.04 0.00 0.31 0.00 0.00 61.69 60.57 1d2p s THR 537 Cb -0.04 -2.45 -0.00 0.00 0.01 0.00 0.00 72.50 70.02 1d2p s THR 537 CO 0.28 -0.03 -0.14 -0.55 -0.69 0.00 0.00 174.62 173.49 1d2p s SER 538 N -3.14 1.84 -0.26 3.53 0.15 -1.26 -1.15 113.70 113.41 1d2p s SER 538 Ca 0.37 -0.30 0.02 0.00 0.70 0.00 0.00 55.95 56.74 1d2p s SER 538 Cb 0.06 -0.52 0.06 0.00 -1.71 0.00 0.00 66.02 63.91 1d2p s SER 538 CO 0.11 0.12 -0.07 -0.55 1.20 0.00 0.00 173.24 174.05 1d2p s SER 539 N 0.12 4.28 0.18 5.45 0.15 0.21 -4.99 113.70 119.11 1d2p s SER 539 Ca -0.04 -1.40 0.11 0.00 0.70 0.00 0.00 55.95 55.32 1d2p s SER 539 Cb -0.11 -1.43 -0.04 0.00 -1.71 0.00 0.00 66.02 62.73 1d2p s SER 539 CO 0.02 -0.22 -0.24 0.27 1.20 0.00 0.00 173.24 174.26 1d2p s ILE 540 N 1.18 2.27 0.00 6.45 -4.36 -1.26 -0.71 121.20 124.77 1d2p s ILE 540 Ca -0.06 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.37 1d2p s ILE 540 Cb -0.20 -2.06 0.00 0.00 1.25 0.00 0.00 42.46 41.46 1d2p s ILE 540 CO -0.06 -0.10 0.00 0.61 0.24 0.00 0.00 174.94 175.63 1d2p n GLY 541 N 0.40 1.44 3.23 6.27 0.00 -0.81 -4.77 105.19 110.95 1d2p n GLY 541 Ca -0.14 -0.92 -0.09 0.00 0.00 0.00 0.00 46.02 44.87 1d2p n GLY 541 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1d2p s GLU 542 N -1.84 0.91 -0.20 1.61 -1.05 -1.14 -1.56 118.70 115.44 1d2p s GLU 542 Ca 0.00 -1.05 -0.06 0.00 -0.15 0.00 0.00 54.97 53.71 1d2p s GLU 542 Cb 0.00 0.34 -0.03 0.00 -0.44 0.00 0.00 34.13 34.00 1d2p s GLU 542 CO 0.00 -0.30 0.02 0.21 0.95 0.00 0.00 175.26 176.14 1d2p s LYS 543 N -3.90 3.71 -0.07 -4.83 2.47 0.43 -2.02 119.74 115.54 1d2p s LYS 543 Ca 0.09 -0.47 0.05 0.00 -1.56 0.00 0.00 55.97 54.08 1d2p s LYS 543 Cb 0.05 -3.13 -0.01 0.00 -1.46 0.00 0.00 37.83 33.28 1d2p s LYS 543 CO -0.08 0.07 -0.23 0.54 0.16 0.00 0.00 175.35 175.81 1d2p s VAL 544 N 0.88 2.20 -0.11 4.02 0.11 -0.03 -4.83 120.40 122.63 1d2p s VAL 544 Ca 0.02 -1.01 -0.12 0.00 -2.93 0.00 0.00 61.98 57.94 1d2p s VAL 544 Cb -0.14 -1.81 -0.05 0.00 -1.53 0.00 0.00 36.38 32.85 1d2p s VAL 544 CO 0.02 0.57 0.27 0.26 -3.33 0.00 0.00 175.10 172.89 1d2p s TRP 545 N -0.11 3.56 -0.68 1.54 0.52 -1.26 -1.82 118.94 120.68 1d2p s TRP 545 Ca -0.05 0.66 0.05 0.00 0.02 0.00 0.00 56.10 56.78 1d2p s TRP 545 Cb -0.14 -2.22 0.18 0.00 -1.15 0.00 0.00 33.47 30.14 1d2p s TRP 545 CO 0.04 0.46 0.52 -3.47 0.02 0.00 0.00 176.95 174.52 1d2p n ASP 546 N 2.76 2.84 -1.83 2.95 2.03 -0.65 -4.84 116.55 119.82 1d2p n ASP 546 Ca -0.15 -3.18 0.01 0.00 0.52 0.00 0.00 54.79 52.00 1d2p n ASP 546 Cb 0.53 -0.73 0.02 0.00 -0.72 0.00 0.00 41.12 40.21 1d2p n ASP 546 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1d2p n ASP 547 N 1.88 0.64 -3.76 1.67 5.68 -1.26 -1.71 116.55 119.69 1d2p n ASP 547 Ca 0.22 -2.02 -0.26 0.00 -0.50 0.00 0.00 54.79 52.23 1d2p n ASP 547 Cb 0.37 -0.18 0.04 0.00 -1.14 0.00 0.00 41.12 40.22 1d2p n ASP 547 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1d2p n LYS 548 N 0.01 -6.00 -2.69 0.11 4.76 -1.26 -1.71 118.16 111.38 1d2p n LYS 548 Ca -0.01 0.67 -0.16 0.00 -2.87 0.00 0.00 58.31 55.94 1d2p n LYS 548 Cb 0.98 -5.53 0.02 0.00 -1.84 0.00 0.00 35.03 28.65 1d2p n LYS 548 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1d2p n ASP 549 N -2.95 -4.84 -3.35 4.39 9.92 -1.26 -3.01 116.55 115.45 1d2p n ASP 549 Ca -0.08 -0.16 -0.23 0.00 -0.53 0.00 0.00 54.79 53.80 1d2p n ASP 549 Cb 0.58 -3.76 0.07 0.00 -0.64 0.00 0.00 41.12 37.37 1d2p n ASP 549 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1d2p n ASN 550 N -1.26 -6.15 -0.21 -2.24 5.15 -0.69 -4.90 115.26 104.96 1d2p n ASN 550 Ca -0.11 -0.47 0.01 0.00 -0.60 0.00 0.00 54.58 53.41 1d2p n ASN 550 Cb 0.60 -4.81 0.12 0.00 -0.53 0.00 0.00 39.78 35.16 1d2p n ASN 550 CO 0.00 0.00 0.00 1.56 1.40 0.00 0.00 177.26 180.22 1d2p h GLN 551 N -2.37 0.28 -0.02 1.20 4.20 -1.49 0.13 115.11 117.04 1d2p h GLN 551 Ca -0.54 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.16 1d2p h GLN 551 Cb 1.35 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.07 1d2p h GLN 551 CO 0.53 0.19 0.00 -0.25 -0.67 0.00 0.00 178.83 178.63 1d2p n ASP 552 N -5.11 0.28 -4.00 1.46 9.92 -1.26 -4.92 116.55 112.92 1d2p n ASP 552 Ca 0.10 -1.38 -0.27 0.00 -0.53 0.00 0.00 54.79 52.71 1d2p n ASP 552 Cb 0.34 -0.01 -0.03 0.00 -0.64 0.00 0.00 41.12 40.77 1d2p n ASP 552 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1d2p n GLY 553 N 0.89 -0.23 0.04 0.44 0.00 0.46 -4.88 105.19 101.91 1d2p n GLY 553 Ca 0.16 0.15 0.01 0.00 0.00 0.00 0.00 46.02 46.34 1d2p n GLY 553 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d2p n LYS 554 N -4.42 2.96 -2.42 1.61 4.76 -1.26 -5.02 118.16 114.37 1d2p n LYS 554 Ca -0.28 -1.56 -0.42 0.00 -2.87 0.00 0.00 58.31 53.18 1d2p n LYS 554 Cb 0.67 -1.03 -0.03 0.00 -1.84 0.00 0.00 35.03 32.81 1d2p n LYS 554 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1d2p s ARG 555 N -1.04 4.42 0.91 1.97 3.52 -1.26 -5.03 118.95 122.44 1d2p s ARG 555 Ca 0.02 1.76 -0.12 0.00 -0.13 0.00 0.00 55.73 57.26 1d2p s ARG 555 Cb 0.01 -3.38 0.14 0.00 -1.56 0.00 0.00 34.95 30.16 1d2p s ARG 555 CO 0.01 -0.29 1.09 -1.25 -0.81 0.00 0.00 175.30 174.05 1d2p s PRO 556 N 1.24 1.14 0.40 5.12 0.04 -1.26 -4.96 135.00 136.73 1d2p s PRO 556 Ca 0.58 0.81 0.22 0.00 0.04 0.00 0.00 61.00 62.65 1d2p s PRO 556 Cb -0.29 -1.80 0.53 0.00 0.04 0.00 0.00 34.50 32.98 1d2p s PRO 556 CO 0.28 -2.32 1.66 0.93 0.04 0.00 0.00 177.00 177.59 1d2p h GLU 557 N -1.60 0.00 -3.24 4.56 3.07 -1.96 -3.47 114.58 111.94 1d2p h GLU 557 Ca -0.50 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.38 1d2p h GLU 557 Cb 1.29 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.13 1d2p h GLU 557 CO 0.55 0.21 0.10 -1.59 -1.40 0.00 0.00 179.01 176.88 1d2p s LYS 558 N -3.30 1.70 0.10 2.33 0.00 -1.26 -4.29 119.74 115.02 1d2p s LYS 558 Ca 0.04 -1.09 0.02 0.00 0.00 0.00 0.00 55.97 54.95 1d2p s LYS 558 Cb 0.08 0.56 -0.04 0.00 0.00 0.00 0.00 37.83 38.43 1d2p s LYS 558 CO 0.67 -0.76 -0.08 0.14 0.00 0.00 0.00 175.35 175.32 1d2p s VAL 559 N -3.95 0.77 -0.30 1.79 -7.23 -0.75 -4.97 120.40 105.76 1d2p s VAL 559 Ca 0.15 -1.79 -0.03 0.00 -1.81 0.00 0.00 61.98 58.51 1d2p s VAL 559 Cb -0.04 -1.51 0.04 0.00 0.56 0.00 0.00 36.38 35.43 1d2p s VAL 559 CO 0.08 -0.74 0.01 -0.44 -0.31 0.00 0.00 175.10 173.70 1d2p s SER 560 N -2.76 4.87 -0.14 4.85 0.01 -1.26 -0.90 113.70 118.36 1d2p s SER 560 Ca 0.08 -1.15 -0.10 0.00 1.31 0.00 0.00 55.95 56.10 1d2p s SER 560 Cb 0.02 -1.74 -0.05 0.00 0.21 0.00 0.00 66.02 64.46 1d2p s SER 560 CO -0.03 -0.24 0.18 0.68 0.41 0.00 0.00 173.24 174.24 1d2p s VAL 561 N 1.30 5.41 -0.05 3.43 -7.23 -0.19 -2.00 120.40 121.08 1d2p s VAL 561 Ca -0.03 0.30 -0.02 0.00 -1.81 0.00 0.00 61.98 60.41 1d2p s VAL 561 Cb -0.19 -3.48 -0.04 0.00 0.56 0.00 0.00 36.38 33.23 1d2p s VAL 561 CO -0.01 0.52 0.08 0.20 -0.31 0.00 0.00 175.10 175.59 1d2p s ASN 562 N -0.36 5.78 -0.22 4.85 0.01 0.17 -1.31 114.94 123.86 1d2p s ASN 562 Ca 0.13 0.23 -0.07 0.00 -0.71 0.00 0.00 52.86 52.45 1d2p s ASN 562 Cb -0.12 -1.72 -0.03 0.00 0.41 0.00 0.00 41.25 39.79 1d2p s ASN 562 CO 0.03 0.33 0.05 -0.22 -1.51 0.00 0.00 177.10 175.78 1d2p s LEU 563 N -1.38 3.48 -0.11 0.60 2.96 0.76 -2.03 118.68 122.97 1d2p s LEU 563 Ca 0.19 -0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 53.95 1d2p s LEU 563 Cb -0.12 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 1d2p s LEU 563 CO 0.09 0.03 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.32 1d2p s LEU 564 N 1.20 3.08 -0.38 -0.68 1.02 0.97 -1.52 118.68 122.37 1d2p s LEU 564 Ca 0.04 -0.13 -0.07 0.00 0.02 0.00 0.00 54.13 54.00 1d2p s LEU 564 Cb -0.14 -1.70 0.06 0.00 0.02 0.00 0.00 46.19 44.43 1d2p s LEU 564 CO 0.03 0.26 0.17 0.00 0.02 0.00 0.00 176.35 176.83 1d2p s ALA 565 N -0.20 3.14 -1.48 4.21 0.00 0.14 -1.53 121.76 126.04 1d2p s ALA 565 Ca 0.02 -2.00 -0.12 0.00 0.00 0.00 0.00 51.96 49.87 1d2p s ALA 565 Cb -0.13 -2.42 0.06 0.00 0.00 0.00 0.00 23.12 20.63 1d2p s ALA 565 CO 0.03 -1.51 0.95 0.09 0.00 0.00 0.00 175.76 175.32 1d2p n ASN 566 N 4.82 -5.25 0.00 0.00 5.03 0.81 -1.64 115.26 119.02 1d2p n ASN 566 Ca -0.10 -0.64 0.00 0.00 0.87 0.00 0.00 54.58 54.71 1d2p n ASN 566 Cb 0.43 -4.19 0.00 0.00 -1.02 0.00 0.00 39.78 35.01 1d2p n ASN 566 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1d2p n GLY 567 N -1.71 0.73 3.22 7.41 0.00 -1.26 -4.25 105.19 109.33 1d2p n GLY 567 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1d2p n GLY 567 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1d2p s GLU 568 N -0.39 3.10 -0.03 1.61 2.12 -0.65 -4.33 118.70 120.13 1d2p s GLU 568 Ca 0.00 -0.82 -0.30 0.00 0.36 0.00 0.00 54.97 54.21 1d2p s GLU 568 Cb 0.00 -2.46 -0.06 0.00 0.26 0.00 0.00 34.13 31.87 1d2p s GLU 568 CO 0.00 0.06 1.64 0.21 -0.54 0.00 0.00 175.26 176.63 1d2p s LYS 569 N 0.65 4.19 0.00 4.30 2.20 -1.26 0.23 119.74 130.05 1d2p s LYS 569 Ca -0.10 2.20 0.00 0.00 -0.36 0.00 0.00 55.97 57.71 1d2p s LYS 569 Cb -0.16 -3.89 0.00 0.00 -1.51 0.00 0.00 37.83 32.27 1d2p s LYS 569 CO 0.02 -0.81 0.15 1.33 -0.36 0.00 0.00 175.35 175.69 1d2p n VAL 570 N 5.28 0.00 -3.64 4.02 0.24 -0.58 -4.93 118.33 118.72 1d2p n VAL 570 Ca 0.17 -0.37 -0.07 0.00 -2.04 0.00 0.00 64.34 62.03 1d2p n VAL 570 Cb 0.42 1.11 -0.07 0.00 -1.47 0.00 0.00 33.84 33.83 1d2p n VAL 570 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1d2p s LYS 571 N -0.44 0.41 0.29 7.34 2.20 -1.22 -5.01 119.74 123.31 1d2p s LYS 571 Ca 0.00 0.52 0.11 0.00 -0.36 0.00 0.00 55.97 56.24 1d2p s LYS 571 Cb 0.00 0.18 -0.05 0.00 -1.51 0.00 0.00 37.83 36.45 1d2p s LYS 571 CO 0.00 -0.05 -0.13 0.99 -0.36 0.00 0.00 175.35 175.80 1d2p s THR 572 N 0.38 2.70 -0.25 3.43 2.01 -1.26 -0.17 115.64 122.49 1d2p s THR 572 Ca 0.02 -2.24 -0.21 0.00 0.31 0.00 0.00 61.69 59.57 1d2p s THR 572 Cb -0.05 -2.50 0.07 0.00 0.01 0.00 0.00 72.50 70.03 1d2p s THR 572 CO -0.09 -0.36 0.65 -0.22 -0.69 0.00 0.00 174.62 173.91 1d2p s LEU 573 N -3.58 -0.55 -0.15 4.42 2.96 -0.43 -4.99 118.68 116.38 1d2p s LEU 573 Ca 0.31 1.33 -0.17 0.00 -0.22 0.00 0.00 54.13 55.37 1d2p s LEU 573 Cb -0.04 2.22 -0.04 0.00 0.50 0.00 0.00 46.19 48.83 1d2p s LEU 573 CO 0.17 -0.23 0.45 -1.81 -1.32 0.00 0.00 176.35 173.61 1d2p s ASP 574 N 0.60 6.60 -0.07 3.68 1.01 -1.26 -1.02 116.67 126.21 1d2p s ASP 574 Ca -0.02 0.71 0.02 0.00 0.71 0.00 0.00 52.55 53.97 1d2p s ASP 574 Cb -0.05 -2.26 -0.03 0.00 1.01 0.00 0.00 42.92 41.59 1d2p s ASP 574 CO -0.03 -0.02 -0.11 -0.69 0.21 0.00 0.00 175.17 174.53 1d2p s VAL 575 N 0.85 3.36 0.25 -1.27 1.01 -0.08 -4.96 120.40 119.56 1d2p s VAL 575 Ca 0.23 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.66 1d2p s VAL 575 Cb -0.15 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 1d2p s VAL 575 CO 0.09 0.59 0.23 0.35 0.00 0.00 0.00 175.10 176.36 1d2p n THR 576 N 2.40 0.00 0.92 3.92 -2.24 -1.26 -1.82 114.28 116.21 1d2p n THR 576 Ca -0.18 -1.76 0.10 0.00 -2.27 0.00 0.00 64.05 59.94 1d2p n THR 576 Cb 0.53 0.90 0.50 0.00 -2.10 0.00 0.00 70.33 70.15 1d2p n THR 576 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1d2p n SER 577 N -1.98 0.00 -0.33 3.42 3.41 -1.26 -1.44 113.62 115.44 1d2p n SER 577 Ca 0.05 0.04 -0.04 0.00 -0.26 0.00 0.00 58.87 58.66 1d2p n SER 577 Cb 0.45 -0.30 0.09 0.00 -0.26 0.00 0.00 64.21 64.18 1d2p n SER 577 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1d2p h GLU 578 N 0.00 1.26 -0.56 4.33 5.08 -1.95 -2.51 114.58 120.24 1d2p h GLU 578 Ca 0.00 -0.16 -0.23 0.00 -1.00 0.00 0.00 59.36 57.97 1d2p h GLU 578 Cb 0.20 -0.24 -0.14 0.00 0.50 0.00 0.00 28.75 29.07 1d2p h GLU 578 CO 0.00 0.93 0.17 0.25 -1.00 0.00 0.00 179.01 179.36 1d2p n THR 579 N -4.32 2.73 -3.76 1.13 -2.24 -1.15 -4.91 114.28 101.76 1d2p n THR 579 Ca 0.09 -2.19 -0.26 0.00 -2.27 0.00 0.00 64.05 59.43 1d2p n THR 579 Cb 0.11 -0.35 0.04 0.00 -2.10 0.00 0.00 70.33 68.04 1d2p n THR 579 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1d2p n ASN 580 N -0.82 -3.84 -3.84 3.42 5.03 -0.94 -1.83 115.26 112.44 1d2p n ASN 580 Ca 0.39 -0.74 -0.30 0.00 0.87 0.00 0.00 54.58 54.80 1d2p n ASN 580 Cb 1.22 -4.23 -0.00 0.00 -1.02 0.00 0.00 39.78 35.75 1d2p n ASN 580 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1d2p n TRP 581 N -4.59 -1.92 -4.27 3.10 7.02 -0.52 -4.87 117.44 111.39 1d2p n TRP 581 Ca -0.09 0.71 -0.25 0.00 -1.02 0.00 0.00 57.50 56.85 1d2p n TRP 581 Cb 0.59 -3.23 -0.08 0.00 -2.42 0.00 0.00 31.31 26.17 1d2p n TRP 581 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1d2p s LYS 582 N -6.53 2.22 0.04 -0.99 1.02 -0.76 -0.43 119.74 114.31 1d2p s LYS 582 Ca 0.61 -1.29 -0.08 0.00 0.02 0.00 0.00 55.97 55.22 1d2p s LYS 582 Cb -0.32 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 34.79 1d2p s LYS 582 CO 0.75 0.41 0.17 1.52 -0.92 0.00 0.00 175.35 177.28 1d2p s TYR 583 N -1.94 0.09 -0.11 3.18 1.13 -0.60 -4.80 117.35 114.29 1d2p s TYR 583 Ca 0.28 -0.32 -0.06 0.00 -1.41 0.00 0.00 57.07 55.56 1d2p s TYR 583 Cb -0.08 -0.05 0.04 0.00 -1.10 0.00 0.00 41.96 40.77 1d2p s TYR 583 CO 0.18 -0.41 0.27 -1.21 -2.51 0.00 0.00 175.55 171.87 1d2p s GLU 584 N -2.52 0.25 -0.31 -3.49 2.02 -1.26 -1.93 118.70 111.46 1d2p s GLU 584 Ca -0.05 0.54 -0.05 0.00 0.02 0.00 0.00 54.97 55.43 1d2p s GLU 584 Cb -0.01 -0.07 0.03 0.00 0.10 0.00 0.00 34.13 34.18 1d2p s GLU 584 CO -0.04 -0.14 0.06 -0.06 0.02 0.00 0.00 175.26 175.09 1d2p s PHE 585 N 1.11 3.20 0.39 1.61 0.08 0.11 -4.99 117.98 119.50 1d2p s PHE 585 Ca -0.08 -1.42 0.08 0.00 0.12 0.00 0.00 56.93 55.63 1d2p s PHE 585 Cb -0.09 -2.21 -0.07 0.00 -0.57 0.00 0.00 43.02 40.09 1d2p s PHE 585 CO -0.08 -0.71 0.04 -1.59 -0.10 0.00 0.00 175.22 172.79 1d2p s LYS 586 N 1.39 2.03 -0.91 0.44 -2.85 -1.26 -0.62 119.74 117.96 1d2p s LYS 586 Ca -0.01 -1.95 -0.02 0.00 -1.00 0.00 0.00 55.97 52.99 1d2p s LYS 586 Cb -0.19 -1.79 0.00 0.00 -2.06 0.00 0.00 37.83 33.80 1d2p s LYS 586 CO 0.01 -0.00 0.78 -0.25 0.10 0.00 0.00 175.35 175.98 1d2p n ASP 587 N -1.01 -3.15 -4.86 0.03 8.00 -1.18 -5.01 116.55 109.37 1d2p n ASP 587 Ca -0.04 -0.43 -0.37 0.00 0.71 0.00 0.00 54.79 54.67 1d2p n ASP 587 Cb 0.65 -3.84 -0.06 0.00 -0.02 0.00 0.00 41.12 37.85 1d2p n ASP 587 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1d2p s LEU 588 N -5.32 4.35 0.13 0.64 1.43 -0.30 -4.86 118.68 114.75 1d2p s LEU 588 Ca 0.15 0.43 -0.31 0.00 -1.03 0.00 0.00 54.13 53.37 1d2p s LEU 588 Cb -0.07 -2.07 -0.09 0.00 0.03 0.00 0.00 46.19 43.99 1d2p s LEU 588 CO 0.53 0.38 1.52 -2.84 0.23 0.00 0.00 176.35 176.17 1d2p s PRO 589 N -0.83 4.25 0.33 1.29 0.02 -1.26 0.19 135.00 138.99 1d2p s PRO 589 Ca 0.14 2.26 0.22 0.00 0.02 0.00 0.00 61.00 63.63 1d2p s PRO 589 Cb -0.12 -3.26 0.18 0.00 0.02 0.00 0.00 34.50 31.33 1d2p s PRO 589 CO 0.03 -0.57 1.38 -0.22 -0.33 0.00 0.00 177.00 177.29 1d2p h LYS 590 N 7.04 0.00 -4.48 5.54 3.64 -1.65 -3.44 116.57 123.22 1d2p h LYS 590 Ca -0.42 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 58.70 1d2p h LYS 590 Cb 1.20 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.81 1d2p h LYS 590 CO 0.90 0.08 -0.73 0.71 -2.27 0.00 0.00 179.45 178.14 1d2p s TYR 591 N -3.21 0.61 -0.06 1.91 1.51 -1.26 -1.99 117.35 114.86 1d2p s TYR 591 Ca 0.04 -0.50 -0.01 0.00 -1.01 0.00 0.00 57.07 55.59 1d2p s TYR 591 Cb 0.07 -0.37 0.03 0.00 -0.11 0.00 0.00 41.96 41.58 1d2p s TYR 591 CO 0.72 -0.10 0.01 0.34 -1.11 0.00 0.00 175.55 175.42 1d2p s ASP 592 N -1.54 1.27 -1.45 2.29 -1.08 -0.41 -4.74 116.67 111.01 1d2p s ASP 592 Ca -0.11 -0.04 -0.06 0.00 -0.52 0.00 0.00 52.55 51.82 1d2p s ASP 592 Cb -0.10 -0.34 0.01 0.00 -1.46 0.00 0.00 42.92 41.03 1d2p s ASP 592 CO 0.00 -0.19 0.80 1.21 0.52 0.00 0.00 175.17 177.52 1d2p n GLU 593 N 4.97 -5.89 -0.97 4.34 2.13 -1.26 -1.75 120.64 122.21 1d2p n GLU 593 Ca -0.10 0.86 0.00 0.00 0.66 0.00 0.00 57.16 58.58 1d2p n GLU 593 Cb 0.50 -5.74 0.00 0.00 0.27 0.00 0.00 31.44 26.47 1d2p n GLU 593 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1d2p n GLY 594 N -1.68 0.22 3.46 8.31 0.00 -1.26 -4.99 105.19 109.24 1d2p n GLY 594 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 1d2p n GLY 594 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2p s LYS 595 N -1.15 2.11 0.13 1.61 -0.14 -0.72 -5.05 119.74 116.52 1d2p s LYS 595 Ca 0.00 -0.95 -0.31 0.00 -1.36 0.00 0.00 55.97 53.34 1d2p s LYS 595 Cb 0.00 -2.20 -0.10 0.00 -1.68 0.00 0.00 37.83 33.85 1d2p s LYS 595 CO 0.00 0.55 1.67 0.21 -0.76 0.00 0.00 175.35 177.02 1d2p s LYS 596 N -1.37 4.18 -0.13 1.68 2.47 -1.26 -1.29 119.74 124.02 1d2p s LYS 596 Ca 0.14 2.43 -0.29 0.00 -1.56 0.00 0.00 55.97 56.70 1d2p s LYS 596 Cb -0.10 -3.40 -0.01 0.00 -1.46 0.00 0.00 37.83 32.86 1d2p s LYS 596 CO 0.05 -0.72 0.98 0.42 0.16 0.00 0.00 175.35 176.24 1d2p s ILE 597 N 2.03 4.79 -0.54 5.43 1.01 -0.84 -4.91 121.20 128.16 1d2p s ILE 597 Ca 0.74 1.98 -0.21 0.00 0.00 0.00 0.00 60.65 63.16 1d2p s ILE 597 Cb -0.43 -4.29 0.05 0.00 0.01 0.00 0.00 42.46 37.80 1d2p s ILE 597 CO 0.33 -0.02 0.78 -0.70 0.00 0.00 0.00 174.94 175.33 1d2p s GLU 598 N 2.19 3.20 0.00 2.79 2.56 -1.26 -4.91 118.70 123.26 1d2p s GLU 598 Ca 0.46 -0.65 -0.11 0.00 0.00 0.00 0.00 54.97 54.66 1d2p s GLU 598 Cb -0.18 -4.09 -0.05 0.00 2.00 0.00 0.00 34.13 31.81 1d2p s GLU 598 CO 0.15 -1.38 0.35 0.71 -0.56 0.00 0.00 175.26 174.54 1d2p s TYR 599 N 3.25 3.66 0.12 5.30 2.02 -1.26 -0.14 117.35 130.30 1d2p s TYR 599 Ca 0.21 0.83 -0.06 0.00 -0.37 0.00 0.00 57.07 57.68 1d2p s TYR 599 Cb -0.17 -2.17 -0.02 0.00 -0.40 0.00 0.00 41.96 39.21 1d2p s TYR 599 CO 0.14 0.63 0.16 0.95 -1.57 0.00 0.00 175.55 175.86 1d2p s THR 600 N -1.17 0.12 0.07 -0.71 -4.23 -0.58 -4.98 115.64 104.15 1d2p s THR 600 Ca 0.25 -1.50 0.08 0.00 -1.18 0.00 0.00 61.69 59.33 1d2p s THR 600 Cb -0.15 -1.70 -0.03 0.00 1.34 0.00 0.00 72.50 71.96 1d2p s THR 600 CO 0.13 -0.53 -0.21 0.68 -0.54 0.00 0.00 174.62 174.15 1d2p s VAL 601 N -3.95 1.67 0.30 2.29 -7.23 -1.26 -0.02 120.40 112.21 1d2p s VAL 601 Ca 0.14 -1.36 0.02 0.00 -1.81 0.00 0.00 61.98 58.97 1d2p s VAL 601 Cb 0.05 -1.49 -0.05 0.00 0.56 0.00 0.00 36.38 35.46 1d2p s VAL 601 CO -0.04 0.07 0.11 0.42 -0.31 0.00 0.00 175.10 175.35 1d2p s THR 602 N -0.98 0.64 -0.01 5.32 -4.23 -0.86 -4.96 115.64 110.56 1d2p s THR 602 Ca 0.07 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.60 1d2p s THR 602 Cb -0.09 -2.61 -0.00 0.00 1.34 0.00 0.00 72.50 71.13 1d2p s THR 602 CO 0.03 0.00 -0.09 -0.70 -0.54 0.00 0.00 174.62 173.32 1d2p s GLU 603 N -3.92 0.77 0.43 3.99 2.12 -1.26 -0.65 118.70 120.18 1d2p s GLU 603 Ca 0.35 -0.31 -0.24 0.00 0.36 0.00 0.00 54.97 55.14 1d2p s GLU 603 Cb 0.07 -0.74 -0.08 0.00 0.26 0.00 0.00 34.13 33.64 1d2p s GLU 603 CO 0.15 0.17 1.19 -0.51 -0.54 0.00 0.00 175.26 175.72 1d2p s ASP 604 N -0.09 6.29 0.07 -1.70 1.01 -0.85 -4.15 116.67 117.25 1d2p s ASP 604 Ca 0.02 2.38 -0.37 0.00 0.71 0.00 0.00 52.55 55.28 1d2p s ASP 604 Cb -0.05 -2.61 -0.17 0.00 1.01 0.00 0.00 42.92 41.10 1d2p s ASP 604 CO -0.00 -0.84 1.26 1.57 0.21 0.00 0.00 175.17 177.37 1d2p n HIS 605 N -0.22 1.28 -4.53 4.23 -0.00 -1.26 -4.76 115.22 109.97 1d2p n HIS 605 Ca 0.06 0.74 -0.33 0.00 -0.00 0.00 0.00 57.72 58.18 1d2p n HIS 605 Cb 0.47 -2.27 -0.14 0.00 -0.00 0.00 0.00 29.99 28.04 1d2p n HIS 605 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1d2p s VAL 606 N 0.31 3.01 0.30 3.57 1.01 -1.26 -5.00 120.40 122.34 1d2p s VAL 606 Ca 0.85 -0.66 -0.30 0.00 0.00 0.00 0.00 61.98 61.88 1d2p s VAL 606 Cb -1.02 -2.29 -0.12 0.00 0.00 0.00 0.00 36.38 32.95 1d2p s VAL 606 CO 0.50 0.50 1.48 1.17 0.00 0.00 0.00 175.10 178.75 1d2p n LYS 607 N 3.91 2.41 -2.23 2.72 3.00 -1.26 -2.46 118.16 124.25 1d2p n LYS 607 Ca -0.18 0.85 -0.16 0.00 -0.00 0.00 0.00 58.31 58.82 1d2p n LYS 607 Cb 0.52 -2.56 -0.02 0.00 0.00 0.00 0.00 35.03 32.97 1d2p n LYS 607 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1d2p n ASP 608 N 1.69 -4.76 -4.07 3.14 8.00 -1.26 -4.97 116.55 114.32 1d2p n ASP 608 Ca 0.08 0.16 -0.19 0.00 0.71 0.00 0.00 54.79 55.54 1d2p n ASP 608 Cb 0.35 -4.05 -0.14 0.00 -0.02 0.00 0.00 41.12 37.26 1d2p n ASP 608 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1d2p s TYR 609 N -2.73 0.98 -0.11 1.24 2.02 -1.03 -1.22 117.35 116.49 1d2p s TYR 609 Ca 0.00 -0.23 -0.02 0.00 -0.37 0.00 0.00 57.07 56.45 1d2p s TYR 609 Cb 0.00 -0.61 -0.03 0.00 -0.40 0.00 0.00 41.96 40.92 1d2p s TYR 609 CO 0.00 -0.01 -0.03 0.99 -1.57 0.00 0.00 175.55 174.93 1d2p s THR 610 N -0.44 3.96 -0.03 -0.71 2.01 -0.17 -4.28 115.64 115.99 1d2p s THR 610 Ca 0.03 -0.36 -0.00 0.00 0.31 0.00 0.00 61.69 61.67 1d2p s THR 610 Cb -0.05 -2.68 -0.04 0.00 0.01 0.00 0.00 72.50 69.74 1d2p s THR 610 CO 0.00 0.55 0.02 -0.89 -0.69 0.00 0.00 174.62 173.61 1d2p s THR 611 N -0.29 4.37 -0.06 -0.82 2.01 -1.26 -0.65 115.64 118.95 1d2p s THR 611 Ca 0.05 -0.43 0.01 0.00 0.31 0.00 0.00 61.69 61.63 1d2p s THR 611 Cb -0.13 -2.93 0.02 0.00 0.01 0.00 0.00 72.50 69.48 1d2p s THR 611 CO 0.02 0.44 -0.05 -0.62 -0.69 0.00 0.00 174.62 173.73 1d2p s ASP 612 N -1.38 1.24 -0.22 3.53 2.15 0.28 -4.92 116.67 117.34 1d2p s ASP 612 Ca 0.18 -0.16 -0.04 0.00 0.43 0.00 0.00 52.55 52.97 1d2p s ASP 612 Cb -0.12 -0.53 -0.01 0.00 -0.30 0.00 0.00 42.92 41.97 1d2p s ASP 612 CO 0.09 -0.07 -0.04 -0.63 -0.17 0.00 0.00 175.17 174.35 1d2p s ILE 613 N 1.08 3.38 -0.37 4.11 1.01 -1.26 -0.75 121.20 128.40 1d2p s ILE 613 Ca -0.08 -0.49 0.02 0.00 0.00 0.00 0.00 60.65 60.09 1d2p s ILE 613 Cb -0.14 -2.53 0.11 0.00 0.01 0.00 0.00 42.46 39.91 1d2p s ILE 613 CO -0.01 0.43 0.13 0.21 0.00 0.00 0.00 174.94 175.70 1d2p s ASN 614 N 1.43 4.19 1.54 3.58 2.47 -0.64 -5.00 114.94 122.51 1d2p s ASN 614 Ca 0.05 -2.13 0.00 0.00 0.42 0.00 0.00 52.86 51.20 1d2p s ASN 614 Cb -0.14 -1.20 0.00 0.00 -1.45 0.00 0.00 41.25 38.46 1d2p s ASN 614 CO -0.03 -0.36 0.00 0.61 -3.72 0.00 0.00 177.10 173.60 1d2p n GLY 615 N 4.24 2.50 0.68 1.21 0.00 -1.26 -1.18 105.19 111.38 1d2p n GLY 615 Ca 0.03 -0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.08 1d2p n GLY 615 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1d2p n THR 616 N 0.00 0.67 -3.27 2.61 -2.24 -1.26 -4.65 114.28 106.14 1d2p n THR 616 Ca 0.00 -0.83 -0.43 0.00 -2.27 0.00 0.00 64.05 60.52 1d2p n THR 616 Cb 0.00 0.76 -0.08 0.00 -2.10 0.00 0.00 70.33 68.91 1d2p n THR 616 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1d2p s THR 617 N -1.03 5.03 -0.33 4.28 2.01 -0.32 -2.88 115.64 122.40 1d2p s THR 617 Ca 0.23 -0.15 -0.11 0.00 0.31 0.00 0.00 61.69 61.97 1d2p s THR 617 Cb 0.13 -4.05 -0.01 0.00 0.01 0.00 0.00 72.50 68.58 1d2p s THR 617 CO 0.18 -0.41 0.20 -0.63 -0.69 0.00 0.00 174.62 173.26 1d2p s ILE 618 N 2.30 4.98 -0.18 1.82 1.01 -0.85 -1.62 121.20 128.66 1d2p s ILE 618 Ca 0.15 -0.29 -0.07 0.00 0.00 0.00 0.00 60.65 60.44 1d2p s ILE 618 Cb -0.16 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 1d2p s ILE 618 CO 0.15 0.03 0.05 -0.89 0.00 0.00 0.00 174.94 174.28 1d2p s THR 619 N 1.68 4.65 -0.28 2.92 2.01 0.07 -0.85 115.64 125.84 1d2p s THR 619 Ca 0.05 -0.08 0.01 0.00 0.31 0.00 0.00 61.69 61.98 1d2p s THR 619 Cb -0.17 -3.10 0.05 0.00 0.01 0.00 0.00 72.50 69.30 1d2p s THR 619 CO 0.09 0.45 -0.06 0.20 -0.69 0.00 0.00 174.62 174.61 1d2p s ASN 620 N 0.47 4.63 -0.18 3.53 0.02 -0.76 -0.56 114.94 122.09 1d2p s ASN 620 Ca 0.02 -1.31 -0.08 0.00 -1.02 0.00 0.00 52.86 50.48 1d2p s ASN 620 Cb -0.13 -1.63 -0.04 0.00 0.02 0.00 0.00 41.25 39.47 1d2p s ASN 620 CO 0.01 -0.22 0.07 -1.59 0.02 0.00 0.00 177.10 175.40 1d2p s LYS 621 N 1.18 3.97 -0.05 -0.60 0.00 0.18 -1.63 119.74 122.80 1d2p s LYS 621 Ca -0.07 -0.32 -0.30 0.00 0.00 0.00 0.00 55.97 55.29 1d2p s LYS 621 Cb -0.20 -3.24 -0.06 0.00 0.00 0.00 0.00 37.83 34.33 1d2p s LYS 621 CO -0.03 0.31 1.79 -0.47 0.00 0.00 0.00 175.35 176.94 1d2p s TYR 622 N 0.28 1.71 -0.39 1.78 5.04 -0.70 -1.00 117.35 124.08 1d2p s TYR 622 Ca 0.05 0.04 0.02 0.00 -2.44 0.00 0.00 57.07 54.73 1d2p s TYR 622 Cb -0.12 -4.03 0.16 0.00 0.35 0.00 0.00 41.96 38.31 1d2p s TYR 622 CO -0.00 -4.34 0.28 0.95 -1.34 0.00 0.00 175.55 171.10 1d2p s THR 623 N 4.57 0.31 -0.13 4.34 -4.23 -0.36 -4.94 115.64 115.21 1d2p s THR 623 Ca 0.80 -2.25 -0.41 0.00 -1.18 0.00 0.00 61.69 58.65 1d2p s THR 623 Cb -0.35 -1.23 -0.18 0.00 1.34 0.00 0.00 72.50 72.07 1d2p s THR 623 CO 0.34 -1.12 1.37 -2.65 -0.54 0.00 0.00 174.62 172.03 1d2p n PRO 624 N 3.39 0.52 -0.74 3.99 -0.02 -1.26 -1.11 135.00 139.77 1d2p n PRO 624 Ca 0.21 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1d2p n PRO 624 Cb 0.43 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1d2p n PRO 624 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2p n GLY 625 N 2.78 1.10 3.10 -1.23 0.00 -1.26 -5.01 105.19 104.68 1d2p n GLY 625 Ca 0.23 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.10 1d2p n GLY 625 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d2p s GLU 626 N -0.16 0.65 0.00 1.61 0.41 -0.27 -2.28 118.70 118.67 1d2p s GLU 626 Ca 0.00 -0.81 0.00 0.00 -0.41 0.00 0.00 54.97 53.75 1d2p s GLU 626 Cb 0.00 -0.53 0.00 0.00 -1.78 0.00 0.00 34.13 31.82 1d2p s GLU 626 CO 0.00 0.11 0.00 0.25 -0.49 0.00 0.00 175.26 175.13 1d2p n THR 627 N 1.48 0.00 -4.49 3.63 -2.24 -0.61 -3.73 114.28 108.32 1d2p n THR 627 Ca -0.22 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.33 1d2p n THR 627 Cb 0.55 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.68 1d2p n THR 627 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1d2p s SER 628 N 0.39 2.59 -0.11 3.42 1.04 -1.26 -1.48 113.70 118.30 1d2p s SER 628 Ca 0.00 -1.50 -0.06 0.00 0.48 0.00 0.00 55.95 54.86 1d2p s SER 628 Cb 0.00 0.18 0.04 0.00 0.10 0.00 0.00 66.02 66.34 1d2p s SER 628 CO 0.00 -0.75 0.26 0.00 0.98 0.00 0.00 173.24 173.74 1d2p s ALA 629 N -3.25 -0.62 -0.07 5.32 0.00 -0.79 -4.67 121.76 117.67 1d2p s ALA 629 Ca 0.30 0.98 0.04 0.00 0.00 0.00 0.00 51.96 53.28 1d2p s ALA 629 Cb 0.06 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 1d2p s ALA 629 CO 0.14 -0.19 -0.19 0.99 0.00 0.00 0.00 175.76 176.52 1d2p s THR 630 N 1.00 2.60 -0.04 0.00 2.01 -0.12 -0.92 115.64 120.17 1d2p s THR 630 Ca -0.07 -0.87 0.04 0.00 0.31 0.00 0.00 61.69 61.10 1d2p s THR 630 Cb -0.08 -2.00 -0.00 0.00 0.01 0.00 0.00 72.50 70.43 1d2p s THR 630 CO -0.07 0.57 -0.16 0.54 -0.69 0.00 0.00 174.62 174.81 1d2p s VAL 631 N -0.29 1.34 0.12 3.82 0.11 -0.52 -0.47 120.40 124.50 1d2p s VAL 631 Ca 0.01 -0.66 0.08 0.00 -2.93 0.00 0.00 61.98 58.48 1d2p s VAL 631 Cb -0.13 -1.16 -0.04 0.00 -1.53 0.00 0.00 36.38 33.53 1d2p s VAL 631 CO 0.03 0.39 -0.19 -0.89 -3.33 0.00 0.00 175.10 171.11 1d2p s THR 632 N 0.10 1.64 -0.19 5.04 2.01 -0.61 -2.01 115.64 121.62 1d2p s THR 632 Ca -0.05 -1.65 -0.06 0.00 0.31 0.00 0.00 61.69 60.25 1d2p s THR 632 Cb -0.11 -1.59 -0.03 0.00 0.01 0.00 0.00 72.50 70.78 1d2p s THR 632 CO 0.02 -0.19 0.02 -0.75 -0.69 0.00 0.00 174.62 173.03 1d2p s LYS 633 N -2.23 3.77 -0.30 4.92 2.47 -0.64 -1.27 119.74 126.46 1d2p s LYS 633 Ca 0.08 -0.45 -0.08 0.00 -1.56 0.00 0.00 55.97 53.97 1d2p s LYS 633 Cb -0.08 -3.11 0.00 0.00 -1.46 0.00 0.00 37.83 33.18 1d2p s LYS 633 CO 0.05 0.15 0.10 1.21 0.16 0.00 0.00 175.35 177.02 1d2p s ASN 634 N 0.65 5.25 -0.44 1.43 2.47 0.25 -4.46 114.94 120.09 1d2p s ASN 634 Ca 0.01 -0.66 -0.17 0.00 0.42 0.00 0.00 52.86 52.45 1d2p s ASN 634 Cb -0.14 -1.92 0.03 0.00 -1.45 0.00 0.00 41.25 37.78 1d2p s ASN 634 CO 0.02 -0.20 0.46 0.26 -3.72 0.00 0.00 177.10 173.93 1d2p s TRP 635 N 1.53 3.16 -0.96 0.43 0.52 -1.26 -0.90 118.94 121.46 1d2p s TRP 635 Ca 0.03 -0.46 -0.05 0.00 0.02 0.00 0.00 56.10 55.64 1d2p s TRP 635 Cb -0.17 -3.02 0.24 0.00 -1.15 0.00 0.00 33.47 29.36 1d2p s TRP 635 CO 0.03 -0.76 0.88 0.34 0.02 0.00 0.00 176.95 177.46 1d2p s ASP 636 N 2.03 6.45 -0.02 2.95 -1.08 -0.40 -4.71 116.67 121.89 1d2p s ASP 636 Ca 0.12 -3.63 0.16 0.00 -0.52 0.00 0.00 52.55 48.68 1d2p s ASP 636 Cb -0.18 -2.02 0.27 0.00 -1.46 0.00 0.00 42.92 39.53 1d2p s ASP 636 CO 0.13 -0.23 1.11 -0.90 0.52 0.00 0.00 175.17 175.80 1d2p n ASP 637 N 2.53 0.21 -3.45 -0.34 5.75 -1.26 -1.70 116.55 118.29 1d2p n ASP 637 Ca 0.22 -2.01 -0.22 0.00 -0.01 0.00 0.00 54.79 52.77 1d2p n ASP 637 Cb 0.38 -0.06 0.05 0.00 -1.03 0.00 0.00 41.12 40.46 1d2p n ASP 637 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1d2p n ASN 638 N 0.22 -6.11 -3.59 -1.12 3.02 -1.26 -2.58 115.26 103.85 1d2p n ASN 638 Ca -0.07 -0.81 -0.27 0.00 -0.03 0.00 0.00 54.58 53.40 1d2p n ASN 638 Cb 0.96 -4.28 0.00 0.00 -0.61 0.00 0.00 39.78 35.85 1d2p n ASN 638 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1d2p n ASN 639 N -2.83 -4.09 -3.07 6.41 5.03 -1.26 -1.21 115.26 114.23 1d2p n ASN 639 Ca -0.08 -0.56 -0.22 0.00 0.87 0.00 0.00 54.58 54.59 1d2p n ASN 639 Cb 0.60 -3.34 0.05 0.00 -1.02 0.00 0.00 39.78 36.06 1d2p n ASN 639 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1d2p n ASN 640 N -2.48 -6.04 -0.30 6.41 5.15 -1.07 -4.88 115.26 112.06 1d2p n ASN 640 Ca 0.01 -0.35 0.12 0.00 -0.60 0.00 0.00 54.58 53.75 1d2p n ASN 640 Cb 0.54 -4.79 0.26 0.00 -0.53 0.00 0.00 39.78 35.25 1d2p n ASN 640 CO 0.00 0.00 0.00 -0.61 1.40 0.00 0.00 177.26 178.05 1d2p h GLN 641 N -1.74 0.12 -0.35 1.20 4.15 -1.09 0.34 115.11 117.74 1d2p h GLN 641 Ca -0.52 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.89 1d2p h GLN 641 Cb 1.35 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.01 1d2p h GLN 641 CO 0.54 0.08 0.00 -0.25 -1.93 0.00 0.00 178.83 177.27 1d2p n ASP 642 N -5.33 1.84 -3.60 -0.69 9.92 -1.26 -0.86 116.55 116.58 1d2p n ASP 642 Ca 0.20 -2.00 -0.27 0.00 -0.53 0.00 0.00 54.79 52.19 1d2p n ASP 642 Cb 0.66 -0.23 -0.00 0.00 -0.64 0.00 0.00 41.12 40.90 1d2p n ASP 642 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1d2p n GLY 643 N 1.04 -0.48 0.44 0.44 0.00 0.12 -4.69 105.19 102.06 1d2p n GLY 643 Ca 0.11 0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1d2p n GLY 643 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d2p n LYS 644 N -4.01 1.06 -2.04 1.61 4.01 -1.26 -4.98 118.16 112.55 1d2p n LYS 644 Ca 0.01 -0.88 -0.42 0.00 -0.51 0.00 0.00 58.31 56.51 1d2p n LYS 644 Cb 0.53 -1.48 -0.03 0.00 -0.51 0.00 0.00 35.03 33.54 1d2p n LYS 644 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 1d2p s ARG 645 N -2.54 4.27 0.75 1.97 3.52 -1.26 -4.96 118.95 120.69 1d2p s ARG 645 Ca 0.17 2.24 -0.11 0.00 -0.13 0.00 0.00 55.73 57.90 1d2p s ARG 645 Cb 0.18 -3.18 0.04 0.00 -1.56 0.00 0.00 34.95 30.42 1d2p s ARG 645 CO 0.61 -0.51 1.08 -1.25 -0.81 0.00 0.00 175.30 174.42 1d2p s PRO 646 N 0.90 2.48 0.44 5.12 0.04 -1.26 -4.96 135.00 137.76 1d2p s PRO 646 Ca 0.66 0.80 0.28 0.00 0.04 0.00 0.00 61.00 62.78 1d2p s PRO 646 Cb -0.41 -1.95 0.86 0.00 0.04 0.00 0.00 34.50 33.05 1d2p s PRO 646 CO 0.32 -1.38 1.79 1.79 0.04 0.00 0.00 177.00 179.56 1d2p h THR 647 N -0.92 0.00 -2.06 1.26 1.35 -1.96 -3.47 112.91 107.11 1d2p h THR 647 Ca -0.45 -0.67 0.12 0.00 -0.55 0.00 0.00 66.41 64.86 1d2p h THR 647 Cb 1.24 1.64 -0.17 0.00 -1.73 0.00 0.00 68.15 69.13 1d2p h THR 647 CO 0.58 0.00 0.54 -1.83 -0.25 0.00 0.00 175.52 174.56 1d2p s GLU 648 N -3.39 0.72 0.03 4.72 -1.05 -1.26 -4.32 118.70 114.14 1d2p s GLU 648 Ca 0.05 -0.20 -0.01 0.00 -0.15 0.00 0.00 54.97 54.66 1d2p s GLU 648 Cb 0.08 0.33 -0.03 0.00 -0.44 0.00 0.00 34.13 34.07 1d2p s GLU 648 CO 0.58 -0.30 -0.02 0.96 0.95 0.00 0.00 175.26 177.43 1d2p s ILE 649 N -2.70 0.14 0.04 1.83 -5.25 -0.67 -5.00 121.20 109.60 1d2p s ILE 649 Ca 0.04 -1.19 0.05 0.00 -0.99 0.00 0.00 60.65 58.56 1d2p s ILE 649 Cb -0.01 -0.68 -0.04 0.00 2.95 0.00 0.00 42.46 44.68 1d2p s ILE 649 CO -0.07 -0.66 -0.08 -0.54 -1.79 0.00 0.00 174.94 171.81 1d2p s LYS 650 N -2.27 2.42 0.12 0.37 1.02 -1.26 -0.83 119.74 119.31 1d2p s LYS 650 Ca -0.08 -0.82 0.02 0.00 0.02 0.00 0.00 55.97 55.11 1d2p s LYS 650 Cb -0.04 -2.44 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1d2p s LYS 650 CO -0.04 0.57 -0.06 0.14 -0.92 0.00 0.00 175.35 175.04 1d2p s VAL 651 N -1.07 0.75 -0.01 3.17 -7.23 -0.48 -1.34 120.40 114.19 1d2p s VAL 651 Ca 0.19 -1.96 0.02 0.00 -1.81 0.00 0.00 61.98 58.42 1d2p s VAL 651 Cb -0.11 -1.79 -0.00 0.00 0.56 0.00 0.00 36.38 35.03 1d2p s VAL 651 CO 0.10 -0.78 -0.07 -0.70 -0.31 0.00 0.00 175.10 173.34 1d2p s GLU 652 N -3.84 0.58 0.06 4.82 2.12 0.28 -1.67 118.70 121.05 1d2p s GLU 652 Ca 0.15 -0.24 -0.28 0.00 0.36 0.00 0.00 54.97 54.95 1d2p s GLU 652 Cb 0.05 -0.56 -0.05 0.00 0.26 0.00 0.00 34.13 33.83 1d2p s GLU 652 CO -0.02 0.14 0.90 -1.17 -0.54 0.00 0.00 175.26 174.57 1d2p s LEU 653 N -0.11 4.45 0.11 2.70 2.96 -0.08 -1.99 118.68 126.73 1d2p s LEU 653 Ca 0.02 1.64 0.06 0.00 -0.22 0.00 0.00 54.13 55.64 1d2p s LEU 653 Cb -0.03 -3.47 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 1d2p s LEU 653 CO -0.00 -0.09 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.58 1d2p s TYR 654 N 0.26 2.84 -0.16 5.38 1.51 0.59 -1.82 117.35 125.94 1d2p s TYR 654 Ca 0.45 -0.11 0.00 0.00 -1.01 0.00 0.00 57.07 56.41 1d2p s TYR 654 Cb -0.22 -1.45 0.03 0.00 -0.11 0.00 0.00 41.96 40.21 1d2p s TYR 654 CO 0.27 0.46 -0.11 -1.14 -1.11 0.00 0.00 175.55 173.92 1d2p s GLN 655 N -2.40 2.05 -1.07 -0.62 0.74 -0.27 -2.12 119.66 115.98 1d2p s GLN 655 Ca 0.24 -0.60 0.00 0.00 0.05 0.00 0.00 55.36 55.05 1d2p s GLN 655 Cb -0.11 -2.12 0.00 0.00 1.10 0.00 0.00 33.01 31.88 1d2p s GLN 655 CO 0.16 -0.31 0.00 -0.25 -0.55 0.00 0.00 175.29 174.34 1d2p n ASP 656 N 4.78 -2.76 0.00 6.67 8.00 -0.02 -0.91 116.55 132.31 1d2p n ASP 656 Ca -0.15 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.60 1d2p n ASP 656 Cb 0.49 -2.66 0.00 0.00 -0.02 0.00 0.00 41.12 38.93 1d2p n ASP 656 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d2p n GLY 657 N -0.24 2.14 3.76 0.44 0.00 -1.26 -5.05 105.19 104.97 1d2p n GLY 657 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1d2p n GLY 657 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1d2p s LYS 658 N -0.62 3.45 0.35 1.61 2.20 -0.09 -5.06 119.74 121.59 1d2p s LYS 658 Ca 0.00 -0.26 -0.27 0.00 -0.36 0.00 0.00 55.97 55.08 1d2p s LYS 658 Cb 0.00 -3.08 -0.12 0.00 -1.51 0.00 0.00 37.83 33.12 1d2p s LYS 658 CO 0.00 0.63 1.18 0.00 -0.36 0.00 0.00 175.35 176.80 1d2p n ALA 659 N 2.43 0.78 0.02 3.13 0.00 -1.26 -1.11 120.51 124.49 1d2p n ALA 659 Ca -0.19 0.33 0.03 0.00 0.00 0.00 0.00 53.44 53.62 1d2p n ALA 659 Cb 0.54 -2.18 -0.10 0.00 0.00 0.00 0.00 19.45 17.71 1d2p n ALA 659 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1d2p n THR 660 N 0.10 0.85 -0.03 0.00 -2.24 -0.76 -4.80 114.28 107.40 1d2p n THR 660 Ca 0.07 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 1d2p n THR 660 Cb 0.36 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 1d2p n THR 660 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d2p n GLY 661 N 1.38 0.50 3.63 3.38 0.00 -1.26 -5.03 105.19 107.78 1d2p n GLY 661 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1d2p n GLY 661 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2p s LYS 662 N -0.84 4.12 0.47 1.61 1.02 -1.26 -5.03 119.74 119.83 1d2p s LYS 662 Ca 0.00 0.50 0.04 0.00 0.02 0.00 0.00 55.97 56.53 1d2p s LYS 662 Cb 0.00 -3.63 -0.04 0.00 -0.52 0.00 0.00 37.83 33.63 1d2p s LYS 662 CO 0.00 -0.36 0.01 0.99 -0.92 0.00 0.00 175.35 175.07 1d2p s THR 663 N 2.32 1.53 -0.27 2.17 2.01 -1.26 -0.90 115.64 121.25 1d2p s THR 663 Ca 0.25 -2.00 -0.25 0.00 0.31 0.00 0.00 61.69 60.01 1d2p s THR 663 Cb -0.16 -2.53 0.07 0.00 0.01 0.00 0.00 72.50 69.89 1d2p s THR 663 CO 0.09 0.00 0.72 0.00 -0.69 0.00 0.00 174.62 174.74 1d2p s ALA 664 N -2.80 -1.78 -0.29 7.40 0.00 -0.67 -4.95 121.76 118.66 1d2p s ALA 664 Ca 0.19 2.04 -0.07 0.00 0.00 0.00 0.00 51.96 54.12 1d2p s ALA 664 Cb 0.05 -1.19 0.01 0.00 0.00 0.00 0.00 23.12 21.99 1d2p s ALA 664 CO 0.10 -0.34 0.07 0.42 0.00 0.00 0.00 175.76 176.01 1d2p s ILE 665 N 0.41 3.94 -0.16 0.00 1.09 -1.26 -1.39 121.20 123.84 1d2p s ILE 665 Ca -0.00 -0.64 -0.07 0.00 -1.10 0.00 0.00 60.65 58.83 1d2p s ILE 665 Cb -0.05 -3.01 -0.04 0.00 -1.06 0.00 0.00 42.46 38.30 1d2p s ILE 665 CO 0.00 0.12 0.08 -0.76 -0.10 0.00 0.00 174.94 174.28 1d2p s LEU 666 N 1.50 3.96 0.00 2.97 1.43 -0.01 -4.97 118.68 123.57 1d2p s LEU 666 Ca 0.03 0.19 -0.13 0.00 -1.03 0.00 0.00 54.13 53.19 1d2p s LEU 666 Cb -0.17 -1.98 0.05 0.00 0.03 0.00 0.00 46.19 44.12 1d2p s LEU 666 CO 0.02 0.25 0.69 -0.46 0.23 0.00 0.00 176.35 177.09 1d2p n ASN 667 N 3.00 -2.02 -0.31 2.29 0.23 -1.26 -1.67 115.26 115.52 1d2p n ASN 667 Ca -0.17 -2.41 0.09 0.00 -0.53 0.00 0.00 54.58 51.56 1d2p n ASN 667 Cb 0.53 3.36 0.31 0.00 -2.08 0.00 0.00 39.78 41.90 1d2p n ASN 667 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1d2p h GLU 668 N 0.00 0.81 -0.74 -3.83 4.39 -1.96 -1.99 114.58 111.26 1d2p h GLU 668 Ca -0.30 -0.05 0.10 0.00 0.34 0.00 0.00 59.36 59.45 1d2p h GLU 668 Cb 1.09 -0.18 -0.07 0.00 -0.10 0.00 0.00 28.75 29.48 1d2p h GLU 668 CO 0.37 0.54 0.38 0.77 -1.16 0.00 0.00 179.01 179.91 1d2p h SER 669 N 0.84 0.49 -0.53 1.42 0.02 -1.96 -2.25 113.55 111.57 1d2p h SER 669 Ca 0.47 0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.48 1d2p h SER 669 Cb 0.59 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 1d2p h SER 669 CO -0.23 0.27 0.00 -0.46 -1.14 0.00 0.00 176.83 175.28 1d2p n ASN 670 N -4.85 5.47 -2.61 3.07 0.23 -0.98 -4.92 115.26 110.66 1d2p n ASN 670 Ca 0.12 -2.96 -0.19 0.00 -0.53 0.00 0.00 54.58 51.03 1d2p n ASN 670 Cb 0.29 -0.67 0.00 0.00 -2.08 0.00 0.00 39.78 37.32 1d2p n ASN 670 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1d2p n ASN 671 N 0.43 -5.17 -2.55 0.53 3.02 -0.85 -2.15 115.26 108.52 1d2p n ASN 671 Ca 0.27 -0.04 -0.18 0.00 -0.03 0.00 0.00 54.58 54.61 1d2p n ASN 671 Cb 1.16 -4.30 -0.00 0.00 -0.61 0.00 0.00 39.78 36.03 1d2p n ASN 671 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1d2p n TRP 672 N -3.91 -1.34 -4.35 3.10 7.02 -0.79 -4.82 117.44 112.35 1d2p n TRP 672 Ca -0.17 0.09 -0.21 0.00 -1.02 0.00 0.00 57.50 56.19 1d2p n TRP 672 Cb 0.64 -3.45 -0.11 0.00 -2.42 0.00 0.00 31.31 25.98 1d2p n TRP 672 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1d2p s THR 673 N -2.87 1.88 -0.28 -0.99 2.01 -0.92 -1.63 115.64 112.85 1d2p s THR 673 Ca 0.06 -2.07 -0.25 0.00 0.31 0.00 0.00 61.69 59.74 1d2p s THR 673 Cb -0.03 -1.97 0.09 0.00 0.01 0.00 0.00 72.50 70.61 1d2p s THR 673 CO 0.07 -0.41 0.86 -2.28 -0.69 0.00 0.00 174.62 172.17 1d2p s HIS 674 N -2.40 -0.65 -0.16 4.92 2.46 -0.85 -4.90 115.29 113.70 1d2p s HIS 674 Ca 0.20 1.58 0.01 0.00 0.47 0.00 0.00 55.06 57.32 1d2p s HIS 674 Cb -0.04 0.32 0.02 0.00 -0.13 0.00 0.00 32.58 32.75 1d2p s HIS 674 CO 0.08 -0.31 -0.18 0.99 -2.47 0.00 0.00 174.74 172.84 1d2p s THR 675 N 0.34 1.85 0.14 0.89 2.01 -1.26 -1.44 115.64 118.18 1d2p s THR 675 Ca 0.01 -0.82 -0.18 0.00 0.31 0.00 0.00 61.69 61.01 1d2p s THR 675 Cb -0.05 -1.69 -0.07 0.00 0.01 0.00 0.00 72.50 70.70 1d2p s THR 675 CO -0.03 0.51 0.61 0.26 -0.69 0.00 0.00 174.62 175.28 1d2p s TRP 676 N 1.30 3.71 0.33 4.92 0.51 -0.10 -4.91 118.94 124.70 1d2p s TRP 676 Ca 0.03 1.26 0.09 0.00 -2.12 0.00 0.00 56.10 55.36 1d2p s TRP 676 Cb -0.13 -2.50 -0.05 0.00 -0.81 0.00 0.00 33.47 29.97 1d2p s TRP 676 CO -0.11 0.47 -0.00 0.99 -0.51 0.00 0.00 176.95 177.79 1d2p s THR 677 N -1.33 2.64 -1.13 2.01 2.01 -1.26 -1.89 115.64 116.68 1d2p s THR 677 Ca 0.36 -2.00 -0.05 0.00 0.31 0.00 0.00 61.69 60.31 1d2p s THR 677 Cb -0.18 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 1d2p s THR 677 CO 0.20 -0.22 0.92 0.61 -0.69 0.00 0.00 174.62 175.44 1d2p n GLY 678 N -0.93 -0.81 3.68 4.40 0.00 -0.98 -4.96 105.19 105.60 1d2p n GLY 678 Ca -0.04 0.37 -0.33 0.00 0.00 0.00 0.00 46.02 46.02 1d2p n GLY 678 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d2p s LEU 679 N -5.91 3.51 0.02 0.99 1.43 -0.55 -4.91 118.68 113.26 1d2p s LEU 679 Ca 0.27 0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.07 1d2p s LEU 679 Cb -0.04 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1d2p s LEU 679 CO 0.75 0.29 1.06 -1.81 0.23 0.00 0.00 176.35 176.88 1d2p s ASP 680 N -1.46 7.26 0.03 2.29 1.11 -1.26 -1.57 116.67 123.06 1d2p s ASP 680 Ca 0.19 1.78 -0.15 0.00 0.18 0.00 0.00 52.55 54.55 1d2p s ASP 680 Cb -0.11 -2.57 -0.35 0.00 1.07 0.00 0.00 42.92 40.95 1d2p s ASP 680 CO 0.09 -0.35 0.99 -0.33 1.18 0.00 0.00 175.17 176.75 1d2p h GLU 681 N 6.82 0.53 -5.60 8.23 5.08 -1.83 -3.44 114.58 124.37 1d2p h GLU 681 Ca -0.41 -0.91 -0.68 0.00 -1.00 0.00 0.00 59.36 56.36 1d2p h GLU 681 Cb 1.21 0.34 -0.31 0.00 0.50 0.00 0.00 28.75 30.50 1d2p h GLU 681 CO 0.78 1.44 -0.85 0.15 -1.00 0.00 0.00 179.01 179.52 1d2p s LYS 682 N -2.60 2.93 -0.86 2.33 1.02 -1.26 -1.44 119.74 119.87 1d2p s LYS 682 Ca -0.09 -0.84 0.01 0.00 0.02 0.00 0.00 55.97 55.07 1d2p s LYS 682 Cb 0.04 -2.33 0.32 0.00 -0.52 0.00 0.00 37.83 35.34 1d2p s LYS 682 CO 0.94 0.27 1.38 0.00 -0.92 0.00 0.00 175.35 177.03 1d2p n ALA 683 N 3.28 5.27 -1.88 5.17 0.00 -0.75 -4.86 120.51 126.73 1d2p n ALA 683 Ca -0.18 -4.69 -0.02 0.00 0.00 0.00 0.00 53.44 48.55 1d2p n ALA 683 Cb 0.53 -1.62 -0.02 0.00 0.00 0.00 0.00 19.45 18.34 1d2p n ALA 683 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1d2p n LYS 684 N 0.22 -1.57 -4.14 0.00 2.85 -1.26 -4.62 118.16 109.64 1d2p n LYS 684 Ca 0.37 1.51 -0.33 0.00 -1.05 0.00 0.00 58.31 58.81 1d2p n LYS 684 Cb 0.33 -2.42 -0.05 0.00 -0.65 0.00 0.00 35.03 32.24 1d2p n LYS 684 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1d2p n GLY 685 N 0.56 -0.35 0.00 2.58 0.00 -1.26 -4.92 105.19 101.80 1d2p n GLY 685 Ca -0.14 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1d2p n GLY 685 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d2p n GLN 686 N -4.62 0.00 -1.90 1.61 0.00 -1.26 -5.15 117.38 106.07 1d2p n GLN 686 Ca -0.27 0.00 -0.41 0.00 0.00 0.00 0.00 57.00 56.33 1d2p n GLN 686 Cb 0.66 0.00 -0.01 0.00 0.00 0.00 0.00 30.24 30.89 1d2p n GLN 686 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.06 175.92 1d2p s GLN 687 N 0.00 4.18 -0.10 2.61 -0.44 -1.26 -1.82 119.66 122.84 1d2p s GLN 687 Ca 0.00 2.46 -0.04 0.00 -2.50 0.00 0.00 55.36 55.29 1d2p s GLN 687 Cb 0.00 -3.00 -0.04 0.00 -1.64 0.00 0.00 33.01 28.33 1d2p s GLN 687 CO 0.00 -0.44 0.05 0.54 0.50 0.00 0.00 175.29 175.95 1d2p s VAL 688 N -1.04 4.77 -0.22 1.34 0.11 -0.52 -4.84 120.40 119.99 1d2p s VAL 688 Ca 0.52 -0.08 -0.10 0.00 -2.93 0.00 0.00 61.98 59.39 1d2p s VAL 688 Cb -0.45 -3.04 -0.05 0.00 -1.53 0.00 0.00 36.38 31.32 1d2p s VAL 688 CO 0.59 0.61 0.14 -0.75 -3.33 0.00 0.00 175.10 172.36 1d2p s LYS 689 N -0.96 4.10 -0.04 1.54 2.20 -1.26 -4.96 119.74 120.36 1d2p s LYS 689 Ca 0.14 -0.26 -0.03 0.00 -0.36 0.00 0.00 55.97 55.47 1d2p s LYS 689 Cb -0.12 -3.48 -0.04 0.00 -1.51 0.00 0.00 37.83 32.68 1d2p s LYS 689 CO 0.03 0.15 0.12 0.71 -0.36 0.00 0.00 175.35 175.99 1d2p s TYR 690 N 0.80 3.42 0.18 4.03 2.02 -1.26 -0.84 117.35 125.70 1d2p s TYR 690 Ca 0.07 0.32 -0.02 0.00 -0.37 0.00 0.00 57.07 57.08 1d2p s TYR 690 Cb -0.13 -1.81 -0.04 0.00 -0.40 0.00 0.00 41.96 39.58 1d2p s TYR 690 CO 0.02 0.61 0.13 0.95 -1.57 0.00 0.00 175.55 175.70 1d2p s THR 691 N -1.17 0.03 0.24 -0.71 -4.23 -0.90 -4.82 115.64 104.09 1d2p s THR 691 Ca 0.21 -1.92 0.11 0.00 -1.18 0.00 0.00 61.69 58.92 1d2p s THR 691 Cb -0.12 -2.32 -0.05 0.00 1.34 0.00 0.00 72.50 71.36 1d2p s THR 691 CO 0.12 -0.16 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.22 1d2p s VAL 692 N -4.11 2.84 -0.15 2.29 1.01 -1.26 -0.30 120.40 120.72 1d2p s VAL 692 Ca 0.33 -2.08 -0.09 0.00 0.00 0.00 0.00 61.98 60.14 1d2p s VAL 692 Cb 0.07 -2.46 0.05 0.00 0.00 0.00 0.00 36.38 34.03 1d2p s VAL 692 CO 0.08 -0.29 0.36 -0.70 0.00 0.00 0.00 175.10 174.55 1d2p s GLU 693 N -3.28 0.35 -0.25 2.72 2.12 -0.84 -4.92 118.70 114.59 1d2p s GLU 693 Ca 0.28 0.67 -0.26 0.00 0.36 0.00 0.00 54.97 56.02 1d2p s GLU 693 Cb -0.07 -0.01 -0.00 0.00 0.26 0.00 0.00 34.13 34.32 1d2p s GLU 693 CO 0.15 -0.14 0.88 -2.00 -0.54 0.00 0.00 175.26 173.62 1d2p s GLU 694 N 1.14 4.17 0.03 4.30 2.12 -1.26 -0.55 118.70 128.64 1d2p s GLU 694 Ca -0.08 1.00 -0.16 0.00 0.36 0.00 0.00 54.97 56.09 1d2p s GLU 694 Cb -0.08 -3.66 -0.32 0.00 0.26 0.00 0.00 34.13 30.33 1d2p s GLU 694 CO -0.09 -0.58 1.03 -0.07 -0.54 0.00 0.00 175.26 175.01 1d2p h LEU 695 N 9.31 0.82 -9.95 2.70 3.38 -1.55 -3.46 115.31 116.57 1d2p h LEU 695 Ca -0.22 -0.88 -0.52 0.00 0.09 0.00 0.00 57.88 56.34 1d2p h LEU 695 Cb 1.08 -0.26 0.08 0.00 0.09 0.00 0.00 40.66 41.65 1d2p h LEU 695 CO 0.90 1.63 0.59 -0.89 0.09 0.00 0.00 178.44 180.77 1d2p s THR 696 N -2.75 2.70 -0.69 0.22 2.01 -1.17 -4.99 115.64 110.98 1d2p s THR 696 Ca -0.10 0.62 -0.09 0.00 0.31 0.00 0.00 61.69 62.43 1d2p s THR 696 Cb 0.04 -3.36 0.18 0.00 0.01 0.00 0.00 72.50 69.37 1d2p s THR 696 CO 0.93 0.09 0.57 -0.75 -0.69 0.00 0.00 174.62 174.76 1d2p s LYS 697 N -2.25 3.02 -0.25 4.92 2.47 -1.26 -4.96 119.74 121.43 1d2p s LYS 697 Ca 0.57 -2.35 -0.29 0.00 -1.56 0.00 0.00 55.97 52.34 1d2p s LYS 697 Cb -0.37 -4.09 -0.01 0.00 -1.46 0.00 0.00 37.83 31.91 1d2p s LYS 697 CO 0.47 -1.23 1.32 0.08 0.16 0.00 0.00 175.35 176.15 1d2p s VAL 698 N 0.32 4.14 0.24 4.02 1.01 -1.26 -4.98 120.40 123.89 1d2p s VAL 698 Ca 0.15 1.31 -0.30 0.00 0.00 0.00 0.00 61.98 63.15 1d2p s VAL 698 Cb -0.17 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.05 1d2p s VAL 698 CO -0.05 -0.36 1.28 -0.75 0.00 0.00 0.00 175.10 175.22 1d2p s LYS 699 N 4.02 4.42 0.00 2.72 2.47 -1.26 -2.72 119.74 129.39 1d2p s LYS 699 Ca 0.57 2.06 0.00 0.00 -1.56 0.00 0.00 55.97 57.04 1d2p s LYS 699 Cb -0.19 -3.16 0.00 0.00 -1.46 0.00 0.00 37.83 33.02 1d2p s LYS 699 CO 0.21 -0.17 0.00 0.41 0.16 0.00 0.00 175.35 175.97 1d2p n GLY 700 N 1.79 2.62 3.98 5.54 0.00 -1.26 -5.01 105.19 112.85 1d2p n GLY 700 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1d2p n GLY 700 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d2p s TYR 701 N -2.52 3.36 0.12 1.61 1.51 -1.10 -4.68 117.35 115.66 1d2p s TYR 701 Ca 0.00 -0.07 0.11 0.00 -1.01 0.00 0.00 57.07 56.10 1d2p s TYR 701 Cb 0.00 -1.69 -0.04 0.00 -0.11 0.00 0.00 41.96 40.12 1d2p s TYR 701 CO 0.00 0.31 -0.27 0.99 -1.11 0.00 0.00 175.55 175.47 1d2p s THR 702 N -2.04 2.23 -0.06 -0.71 2.01 0.47 -4.91 115.64 112.63 1d2p s THR 702 Ca 0.37 -1.73 0.04 0.00 0.31 0.00 0.00 61.69 60.68 1d2p s THR 702 Cb -0.09 -1.97 -0.00 0.00 0.01 0.00 0.00 72.50 70.45 1d2p s THR 702 CO 0.30 0.10 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.26 1d2p s THR 703 N -1.05 1.51 -0.03 -0.82 2.01 -1.26 -0.53 115.64 115.47 1d2p s THR 703 Ca 0.14 -0.74 0.01 0.00 0.31 0.00 0.00 61.69 61.41 1d2p s THR 703 Cb -0.10 -1.31 0.01 0.00 0.01 0.00 0.00 72.50 71.11 1d2p s THR 703 CO 0.06 0.44 -0.05 -2.28 -0.69 0.00 0.00 174.62 172.09 1d2p s HIS 704 N 0.18 0.68 -0.08 4.92 5.65 -0.04 -4.99 115.29 121.61 1d2p s HIS 704 Ca -0.08 -0.17 0.02 0.00 0.25 0.00 0.00 55.06 55.08 1d2p s HIS 704 Cb -0.13 -0.57 -0.02 0.00 -1.18 0.00 0.00 32.58 30.68 1d2p s HIS 704 CO 0.04 -0.13 -0.13 0.08 -0.65 0.00 0.00 174.74 173.94 1d2p s VAL 705 N 0.58 3.11 -0.42 0.89 1.01 -1.26 0.25 120.40 124.55 1d2p s VAL 705 Ca -0.07 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.11 1d2p s VAL 705 Cb -0.11 -2.26 0.06 0.00 0.00 0.00 0.00 36.38 34.07 1d2p s VAL 705 CO 0.00 0.56 0.28 -0.62 0.00 0.00 0.00 175.10 175.32 1d2p s ASP 706 N -0.29 5.80 -0.14 3.32 2.15 1.00 -4.94 116.67 123.56 1d2p s ASP 706 Ca 0.02 -1.31 0.16 0.00 0.43 0.00 0.00 52.55 51.85 1d2p s ASP 706 Cb -0.13 -2.05 0.60 0.00 -0.30 0.00 0.00 42.92 41.05 1d2p s ASP 706 CO 0.03 -0.52 1.52 0.59 -0.17 0.00 0.00 175.17 176.61 1d2p n ASN 707 N 5.01 4.33 -0.08 -0.34 3.02 -1.26 -2.12 115.26 123.82 1d2p n ASN 707 Ca -0.11 -2.65 0.01 0.00 -0.03 0.00 0.00 54.58 51.80 1d2p n ASN 707 Cb 0.44 -0.53 0.32 0.00 -0.61 0.00 0.00 39.78 39.40 1d2p n ASN 707 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1d2p h ASN 708 N 2.94 0.63 -3.23 6.41 2.35 -1.92 -3.41 115.58 119.35 1d2p h ASN 708 Ca 0.00 -0.05 -0.45 0.00 -0.55 0.00 0.00 56.30 55.25 1d2p h ASN 708 Cb 1.42 -0.16 -0.39 0.00 0.05 0.00 0.00 38.32 39.24 1d2p h ASN 708 CO 0.24 0.52 -0.76 -0.62 -1.65 0.00 0.00 177.43 175.16 1d2p s ASP 709 N -6.58 2.00 0.64 5.81 -1.08 -1.26 -5.01 116.67 111.19 1d2p s ASP 709 Ca -0.09 -0.35 0.33 0.00 -0.52 0.00 0.00 52.55 51.92 1d2p s ASP 709 Cb 0.17 -0.41 1.79 0.00 -1.46 0.00 0.00 42.92 43.01 1d2p s ASP 709 CO 0.76 -0.26 2.00 0.00 0.52 0.00 0.00 175.17 178.20 1d2p h MET 710 N 8.34 0.00 0.00 4.34 -0.00 -1.88 0.50 114.93 126.23 1d2p h MET 710 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.53 1d2p h MET 710 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.73 1d2p h MET 710 CO 0.27 0.00 0.00 0.41 -0.00 0.00 0.00 176.91 177.59 1d2p n GLY 711 N -1.19 -1.66 2.45 -3.00 0.00 -1.26 -0.94 105.19 99.59 1d2p n GLY 711 Ca -0.02 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 1d2p n GLY 711 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d2p n ASN 712 N -2.22 -0.91 -4.77 1.61 5.15 0.17 -4.01 115.26 110.29 1d2p n ASN 712 Ca 0.05 -3.20 -0.38 0.00 -0.60 0.00 0.00 54.58 50.44 1d2p n ASN 712 Cb 0.41 0.57 -0.05 0.00 -0.53 0.00 0.00 39.78 40.17 1d2p n ASN 712 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1d2p s LEU 713 N -1.82 4.43 -0.04 1.20 1.43 0.37 -4.61 118.68 119.65 1d2p s LEU 713 Ca 0.32 2.01 0.00 0.00 -1.03 0.00 0.00 54.13 55.44 1d2p s LEU 713 Cb 0.27 -3.85 0.03 0.00 0.03 0.00 0.00 46.19 42.67 1d2p s LEU 713 CO -0.11 -0.11 -0.00 -0.63 0.23 0.00 0.00 176.35 175.73 1d2p s ILE 714 N -1.40 0.25 -0.23 -0.59 1.01 -0.90 -1.58 121.20 117.77 1d2p s ILE 714 Ca 0.48 0.07 -0.07 0.00 0.00 0.00 0.00 60.65 61.13 1d2p s ILE 714 Cb -0.25 -0.35 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 1d2p s ILE 714 CO 0.31 0.18 0.06 -0.89 0.00 0.00 0.00 174.94 174.60 1d2p s THR 715 N 1.18 4.39 -0.15 2.92 2.01 -0.39 -0.00 115.64 125.58 1d2p s THR 715 Ca -0.07 -0.15 -0.02 0.00 0.31 0.00 0.00 61.69 61.75 1d2p s THR 715 Cb -0.13 -3.03 -0.02 0.00 0.01 0.00 0.00 72.50 69.32 1d2p s THR 715 CO -0.02 0.37 -0.07 -0.89 -0.69 0.00 0.00 174.62 173.32 1d2p s THR 716 N 1.31 3.52 -0.25 -0.82 2.01 0.14 0.88 115.64 122.42 1d2p s THR 716 Ca 0.05 -0.49 -0.00 0.00 0.31 0.00 0.00 61.69 61.56 1d2p s THR 716 Cb -0.15 -2.53 0.04 0.00 0.01 0.00 0.00 72.50 69.87 1d2p s THR 716 CO 0.03 0.50 -0.08 0.20 -0.69 0.00 0.00 174.62 174.59 1d2p s ASN 717 N 0.47 4.33 0.01 3.53 -0.87 -0.08 -0.86 114.94 121.47 1d2p s ASN 717 Ca -0.06 -1.05 -0.01 0.00 -1.57 0.00 0.00 52.86 50.18 1d2p s ASN 717 Cb -0.15 -1.63 -0.04 0.00 -0.02 0.00 0.00 41.25 39.42 1d2p s ASN 717 CO 0.03 -0.15 0.14 -0.75 -2.57 0.00 0.00 177.10 173.80 1d2p s LYS 718 N 1.26 3.24 -0.16 -0.60 2.20 0.31 -1.27 119.74 124.70 1d2p s LYS 718 Ca -0.02 -0.44 -0.11 0.00 -0.36 0.00 0.00 55.97 55.04 1d2p s LYS 718 Cb -0.18 -2.96 0.05 0.00 -1.51 0.00 0.00 37.83 33.23 1d2p s LYS 718 CO -0.05 0.65 0.41 -0.47 -0.36 0.00 0.00 175.35 175.53 1d2p s TYR 719 N -1.30 -0.54 -0.37 4.03 5.04 -0.69 -0.39 117.35 123.12 1d2p s TYR 719 Ca 0.27 1.21 -0.13 0.00 -2.44 0.00 0.00 57.07 55.98 1d2p s TYR 719 Cb -0.12 0.22 0.01 0.00 0.35 0.00 0.00 41.96 42.41 1d2p s TYR 719 CO 0.18 -0.29 0.25 0.95 -1.34 0.00 0.00 175.55 175.30 1d2p s THR 720 N 0.91 5.10 0.30 4.34 -4.23 -1.26 -4.45 115.64 116.35 1d2p s THR 720 Ca -0.06 -0.51 -0.29 0.00 -1.18 0.00 0.00 61.69 59.65 1d2p s THR 720 Cb -0.06 -3.74 -0.13 0.00 1.34 0.00 0.00 72.50 69.91 1d2p s THR 720 CO -0.07 -0.16 1.27 -2.65 -0.54 0.00 0.00 174.62 172.47 1d2p n PRO 721 N 5.10 1.95 -1.15 3.99 -0.02 -1.26 -4.97 135.00 138.63 1d2p n PRO 721 Ca -0.12 0.69 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 1d2p n PRO 721 Cb 0.48 -2.25 0.12 0.00 -0.02 0.00 0.00 33.50 31.83 1d2p n PRO 721 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1d2p s GLU 722 N -1.41 1.75 0.05 -0.52 2.02 -1.26 -4.96 118.70 114.37 1d2p s GLU 722 Ca 0.60 1.63 0.00 0.00 0.02 0.00 0.00 54.97 57.22 1d2p s GLU 722 Cb -0.62 -1.80 -0.03 0.00 0.10 0.00 0.00 34.13 31.78 1d2p s GLU 722 CO 0.58 -2.10 -0.04 0.95 0.02 0.00 0.00 175.26 174.67 1d2p s THR 723 N -2.30 0.30 0.12 3.63 -4.23 -1.26 -2.41 115.64 109.48 1d2p s THR 723 Ca 0.70 -1.43 0.02 0.00 -1.18 0.00 0.00 61.69 59.81 1d2p s THR 723 Cb -0.26 -1.00 -0.01 0.00 1.34 0.00 0.00 72.50 72.58 1d2p s THR 723 CO 0.51 -0.73 0.07 0.41 -0.54 0.00 0.00 174.62 174.33 1d2p n THR 724 N 0.77 0.00 -3.66 3.99 -1.04 0.13 -4.78 114.28 109.70 1d2p n THR 724 Ca -0.18 -0.75 -0.15 0.00 -2.04 0.00 0.00 64.05 60.93 1d2p n THR 724 Cb 0.58 0.32 -0.08 0.00 -1.82 0.00 0.00 70.33 69.33 1d2p n THR 724 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1d2p s SER 725 N -1.75 -0.40 -0.08 8.00 1.04 -1.26 -0.60 113.70 118.65 1d2p s SER 725 Ca 0.09 0.38 0.05 0.00 0.48 0.00 0.00 55.95 56.95 1d2p s SER 725 Cb 0.00 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.54 1d2p s SER 725 CO 0.07 -0.51 -0.24 -0.44 0.98 0.00 0.00 173.24 173.09 1d2p s SER 726 N -1.23 3.06 0.02 7.02 0.01 -0.74 -4.98 113.70 116.87 1d2p s SER 726 Ca -0.12 -0.53 0.02 0.00 1.31 0.00 0.00 55.95 56.63 1d2p s SER 726 Cb -0.03 -1.08 -0.01 0.00 0.21 0.00 0.00 66.02 65.10 1d2p s SER 726 CO 0.07 0.21 -0.06 0.27 0.41 0.00 0.00 173.24 174.13 1d2p s ILE 727 N 0.06 0.45 0.00 1.44 -4.36 -1.26 -0.60 121.20 116.92 1d2p s ILE 727 Ca -0.10 -0.66 0.00 0.00 -0.26 0.00 0.00 60.65 59.63 1d2p s ILE 727 Cb -0.16 -0.46 0.00 0.00 1.25 0.00 0.00 42.46 43.10 1d2p s ILE 727 CO 0.06 -0.15 0.00 0.61 0.24 0.00 0.00 174.94 175.70 1d2p n GLY 728 N 2.18 2.42 3.27 6.27 0.00 -0.58 -4.80 105.19 113.94 1d2p n GLY 728 Ca -0.18 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.87 1d2p n GLY 728 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1d2p s GLU 729 N -0.53 0.97 -0.14 1.61 -1.05 -1.21 -1.32 118.70 117.03 1d2p s GLU 729 Ca 0.00 -0.91 -0.01 0.00 -0.15 0.00 0.00 54.97 53.90 1d2p s GLU 729 Cb 0.00 0.39 -0.02 0.00 -0.44 0.00 0.00 34.13 34.06 1d2p s GLU 729 CO 0.00 -0.34 -0.11 -1.59 0.95 0.00 0.00 175.26 174.17 1d2p s LYS 730 N -3.86 3.44 -0.11 -4.83 -2.85 -0.39 -1.92 119.74 109.21 1d2p s LYS 730 Ca 0.06 -0.65 0.00 0.00 -1.00 0.00 0.00 55.97 54.39 1d2p s LYS 730 Cb 0.04 -2.71 -0.02 0.00 -2.06 0.00 0.00 37.83 33.07 1d2p s LYS 730 CO -0.10 0.19 -0.13 0.14 0.10 0.00 0.00 175.35 175.56 1d2p s VAL 731 N 0.44 3.12 -0.10 1.79 -7.23 0.57 -4.87 120.40 114.12 1d2p s VAL 731 Ca -0.08 -0.65 -0.14 0.00 -1.81 0.00 0.00 61.98 59.30 1d2p s VAL 731 Cb -0.15 -2.30 -0.05 0.00 0.56 0.00 0.00 36.38 34.44 1d2p s VAL 731 CO 0.04 0.54 0.33 0.26 -0.31 0.00 0.00 175.10 175.96 1d2p s TRP 732 N 0.12 3.57 -0.70 2.82 0.52 -1.26 -1.19 118.94 122.81 1d2p s TRP 732 Ca -0.06 0.74 0.05 0.00 0.02 0.00 0.00 56.10 56.85 1d2p s TRP 732 Cb -0.15 -2.30 0.17 0.00 -1.15 0.00 0.00 33.47 30.05 1d2p s TRP 732 CO 0.04 0.42 0.51 -3.47 0.02 0.00 0.00 176.95 174.47 1d2p n ASP 733 N 2.85 3.01 -2.80 2.95 2.03 0.84 -4.84 116.55 120.60 1d2p n ASP 733 Ca -0.13 -3.21 -0.01 0.00 0.52 0.00 0.00 54.79 51.96 1d2p n ASP 733 Cb 0.52 -0.75 0.07 0.00 -0.72 0.00 0.00 41.12 40.24 1d2p n ASP 733 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1d2p n ASP 734 N 1.90 0.89 -3.82 1.67 5.75 -1.26 -1.57 116.55 120.11 1d2p n ASP 734 Ca 0.21 -2.09 -0.30 0.00 -0.01 0.00 0.00 54.79 52.59 1d2p n ASP 734 Cb 0.36 -0.22 0.02 0.00 -1.03 0.00 0.00 41.12 40.24 1d2p n ASP 734 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1d2p n LYS 735 N -0.78 -2.02 -4.23 0.11 4.76 -1.26 -1.04 118.16 113.70 1d2p n LYS 735 Ca 0.02 0.41 -0.33 0.00 -2.87 0.00 0.00 58.31 55.54 1d2p n LYS 735 Cb 0.82 -4.17 -0.06 0.00 -1.84 0.00 0.00 35.03 29.78 1d2p n LYS 735 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1d2p n ASP 736 N -2.76 -0.84 -3.34 4.39 2.03 -1.26 -0.88 116.55 113.88 1d2p n ASP 736 Ca -0.18 -1.14 -0.21 0.00 0.52 0.00 0.00 54.79 53.79 1d2p n ASP 736 Cb 0.63 -2.28 0.08 0.00 -0.72 0.00 0.00 41.12 38.83 1d2p n ASP 736 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1d2p n ASN 737 N -2.79 -5.07 -0.19 1.67 5.15 -0.20 -4.91 115.26 108.92 1d2p n ASN 737 Ca -0.16 -0.52 -0.02 0.00 -0.60 0.00 0.00 54.58 53.28 1d2p n ASN 737 Cb 0.61 -4.73 0.04 0.00 -0.53 0.00 0.00 39.78 35.17 1d2p n ASN 737 CO 0.00 0.00 0.00 -0.61 1.40 0.00 0.00 177.26 178.05 1d2p h GLN 738 N -2.33 -0.05 -0.75 1.20 4.15 -0.48 -0.70 115.11 116.14 1d2p h GLN 738 Ca -0.53 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.89 1d2p h GLN 738 Cb 1.34 0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.04 1d2p h GLN 738 CO 0.51 -0.03 0.00 -0.25 -1.93 0.00 0.00 178.83 177.12 1d2p n ASP 739 N -5.42 3.73 -2.80 -0.69 9.92 -1.26 -4.93 116.55 115.10 1d2p n ASP 739 Ca 0.06 -2.53 -0.07 0.00 -0.53 0.00 0.00 54.79 51.72 1d2p n ASP 739 Cb 0.32 -0.60 -0.01 0.00 -0.64 0.00 0.00 41.12 40.19 1d2p n ASP 739 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1d2p n GLY 740 N 0.38 -0.48 0.28 0.44 0.00 -0.27 -4.76 105.19 100.78 1d2p n GLY 740 Ca 0.16 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1d2p n GLY 740 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d2p n LYS 741 N -2.72 0.80 -2.01 1.61 4.01 -1.26 -4.94 118.16 113.66 1d2p n LYS 741 Ca 0.02 -0.56 -0.42 0.00 -0.51 0.00 0.00 58.31 56.84 1d2p n LYS 741 Cb 0.49 -1.49 -0.03 0.00 -0.51 0.00 0.00 35.03 33.49 1d2p n LYS 741 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 1d2p s ARG 742 N -2.58 4.25 0.85 1.97 3.52 -1.26 -5.00 118.95 120.69 1d2p s ARG 742 Ca 0.20 2.27 -0.12 0.00 -0.13 0.00 0.00 55.73 57.95 1d2p s ARG 742 Cb 0.18 -3.22 0.10 0.00 -1.56 0.00 0.00 34.95 30.46 1d2p s ARG 742 CO 0.58 -0.56 1.10 -1.25 -0.81 0.00 0.00 175.30 174.36 1d2p s PRO 743 N 1.25 1.64 0.38 5.12 0.04 -1.26 -4.96 135.00 137.20 1d2p s PRO 743 Ca 0.69 0.61 0.15 0.00 0.04 0.00 0.00 61.00 62.49 1d2p s PRO 743 Cb -0.41 -1.87 0.76 0.00 0.04 0.00 0.00 34.50 33.02 1d2p s PRO 743 CO 0.31 -1.93 1.82 1.49 0.04 0.00 0.00 177.00 178.73 1d2p h GLU 744 N -1.31 0.00 -2.81 4.56 4.57 -1.97 -3.47 114.58 114.16 1d2p h GLU 744 Ca -0.49 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 57.77 1d2p h GLU 744 Cb 1.29 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.80 1d2p h GLU 744 CO 0.59 0.37 0.30 -1.59 -1.18 0.00 0.00 179.01 177.49 1d2p s LYS 745 N -4.03 1.51 0.15 1.92 0.00 -1.26 -4.44 119.74 113.58 1d2p s LYS 745 Ca -0.02 -0.78 0.07 0.00 0.00 0.00 0.00 55.97 55.24 1d2p s LYS 745 Cb 0.13 0.55 -0.04 0.00 0.00 0.00 0.00 37.83 38.47 1d2p s LYS 745 CO 0.71 -0.68 -0.15 0.14 0.00 0.00 0.00 175.35 175.36 1d2p s VAL 746 N -3.70 1.52 -0.33 1.79 -7.23 -0.75 -4.95 120.40 106.75 1d2p s VAL 746 Ca 0.09 -1.91 -0.04 0.00 -1.81 0.00 0.00 61.98 58.31 1d2p s VAL 746 Cb -0.04 -1.75 0.05 0.00 0.56 0.00 0.00 36.38 35.21 1d2p s VAL 746 CO 0.01 -0.46 0.07 -0.44 -0.31 0.00 0.00 175.10 173.97 1d2p s SER 747 N -2.76 5.14 -0.11 4.85 0.01 -1.26 -0.25 113.70 119.32 1d2p s SER 747 Ca 0.14 -1.29 -0.11 0.00 1.31 0.00 0.00 55.95 56.00 1d2p s SER 747 Cb -0.03 -1.80 -0.05 0.00 0.21 0.00 0.00 66.02 64.35 1d2p s SER 747 CO 0.04 -0.33 0.24 0.68 0.41 0.00 0.00 173.24 174.28 1d2p s VAL 748 N 1.31 5.34 -0.04 3.43 -7.23 -0.07 -1.90 120.40 121.25 1d2p s VAL 748 Ca -0.02 0.43 -0.02 0.00 -1.81 0.00 0.00 61.98 60.56 1d2p s VAL 748 Cb -0.20 -3.53 -0.04 0.00 0.56 0.00 0.00 36.38 33.17 1d2p s VAL 748 CO 0.00 0.54 0.10 0.20 -0.31 0.00 0.00 175.10 175.63 1d2p s ASN 749 N -0.57 5.86 -0.19 4.85 0.01 0.98 -1.20 114.94 124.69 1d2p s ASN 749 Ca 0.17 0.24 -0.05 0.00 -0.71 0.00 0.00 52.86 52.50 1d2p s ASN 749 Cb -0.13 -1.75 -0.03 0.00 0.41 0.00 0.00 41.25 39.75 1d2p s ASN 749 CO 0.06 0.31 0.01 -0.22 -1.51 0.00 0.00 177.10 175.74 1d2p s LEU 750 N -1.53 3.35 -0.10 0.60 2.96 -0.10 -2.00 118.68 121.87 1d2p s LEU 750 Ca 0.21 -0.14 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 1d2p s LEU 750 Cb -0.12 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1d2p s LEU 750 CO 0.11 0.10 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.37 1d2p s LEU 751 N 0.78 2.87 -0.36 -0.68 1.02 0.20 -1.49 118.68 121.02 1d2p s LEU 751 Ca 0.01 -0.21 -0.06 0.00 0.02 0.00 0.00 54.13 53.88 1d2p s LEU 751 Cb -0.14 -1.63 0.06 0.00 0.02 0.00 0.00 46.19 44.49 1d2p s LEU 751 CO 0.02 0.24 0.14 0.00 0.02 0.00 0.00 176.35 176.78 1d2p s ALA 752 N -0.11 3.09 -1.50 4.21 0.00 0.25 -1.47 121.76 126.23 1d2p s ALA 752 Ca -0.00 -1.96 -0.13 0.00 0.00 0.00 0.00 51.96 49.87 1d2p s ALA 752 Cb -0.13 -2.34 0.07 0.00 0.00 0.00 0.00 23.12 20.71 1d2p s ALA 752 CO 0.03 -1.47 1.02 0.09 0.00 0.00 0.00 175.76 175.43 1d2p n ASN 753 N 4.78 -5.04 0.00 0.00 5.03 -0.04 -1.19 115.26 118.80 1d2p n ASN 753 Ca -0.10 -0.74 0.00 0.00 0.87 0.00 0.00 54.58 54.61 1d2p n ASN 753 Cb 0.44 -4.11 0.00 0.00 -1.02 0.00 0.00 39.78 35.09 1d2p n ASN 753 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1d2p n GLY 754 N -1.75 0.99 3.58 7.41 0.00 -1.26 -4.24 105.19 109.93 1d2p n GLY 754 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1d2p n GLY 754 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1d2p s GLU 755 N -0.36 3.82 -0.15 1.61 2.12 -0.33 -4.42 118.70 120.99 1d2p s GLU 755 Ca 0.00 -0.42 -0.29 0.00 0.36 0.00 0.00 54.97 54.62 1d2p s GLU 755 Cb 0.00 -3.08 -0.02 0.00 0.26 0.00 0.00 34.13 31.29 1d2p s GLU 755 CO 0.00 0.28 1.32 0.21 -0.54 0.00 0.00 175.26 176.53 1d2p s LYS 756 N 0.31 4.23 -0.00 4.30 2.20 -1.26 0.88 119.74 130.39 1d2p s LYS 756 Ca 0.00 1.74 0.03 0.00 -0.36 0.00 0.00 55.97 57.39 1d2p s LYS 756 Cb -0.13 -3.79 -0.05 0.00 -1.51 0.00 0.00 37.83 32.35 1d2p s LYS 756 CO 0.01 -0.72 0.09 1.33 -0.36 0.00 0.00 175.35 175.70 1d2p n VAL 757 N 5.37 0.00 -3.48 4.02 0.24 -0.56 -4.94 118.33 118.99 1d2p n VAL 757 Ca 0.14 -0.18 -0.15 0.00 -2.04 0.00 0.00 64.34 62.11 1d2p n VAL 757 Cb 0.45 0.59 -0.04 0.00 -1.47 0.00 0.00 33.84 33.36 1d2p n VAL 757 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1d2p s LYS 758 N -1.96 1.15 0.04 7.34 1.02 -1.23 -5.03 119.74 121.07 1d2p s LYS 758 Ca -0.01 -0.05 0.03 0.00 0.02 0.00 0.00 55.97 55.96 1d2p s LYS 758 Cb 0.02 0.54 -0.02 0.00 -0.52 0.00 0.00 37.83 37.85 1d2p s LYS 758 CO 0.13 -0.43 -0.09 0.99 -0.92 0.00 0.00 175.35 175.04 1d2p s THR 759 N -2.29 0.66 -0.02 2.17 2.01 -1.26 -0.92 115.64 115.99 1d2p s THR 759 Ca -0.06 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.05 1d2p s THR 759 Cb -0.00 -0.67 -0.00 0.00 0.01 0.00 0.00 72.50 71.84 1d2p s THR 759 CO 0.00 -0.20 -0.10 -0.76 -0.69 0.00 0.00 174.62 172.87 1d2p s LEU 760 N -1.23 1.87 -0.31 4.42 1.43 -0.34 -4.98 118.68 119.54 1d2p s LEU 760 Ca -0.05 -0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 52.70 1d2p s LEU 760 Cb -0.08 -0.56 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 1d2p s LEU 760 CO 0.01 0.09 0.42 -1.81 0.23 0.00 0.00 176.35 175.29 1d2p s ASP 761 N 0.03 6.27 -0.18 2.29 1.11 -1.26 -0.89 116.67 124.04 1d2p s ASP 761 Ca -0.01 0.07 -0.08 0.00 0.18 0.00 0.00 52.55 52.71 1d2p s ASP 761 Cb -0.07 -2.23 -0.04 0.00 1.07 0.00 0.00 42.92 41.65 1d2p s ASP 761 CO 0.00 -0.33 0.08 -0.69 1.18 0.00 0.00 175.17 175.42 1d2p s VAL 762 N 2.17 4.99 0.15 -1.27 1.01 0.65 -4.94 120.40 123.16 1d2p s VAL 762 Ca 0.16 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.18 1d2p s VAL 762 Cb -0.16 -3.25 -0.00 0.00 0.00 0.00 0.00 36.38 32.97 1d2p s VAL 762 CO 0.11 0.46 0.04 0.35 0.00 0.00 0.00 175.10 176.07 1d2p n THR 763 N 3.44 0.00 0.64 3.92 -2.24 -1.26 -1.81 114.28 116.97 1d2p n THR 763 Ca -0.17 -0.80 0.13 0.00 -2.27 0.00 0.00 64.05 60.94 1d2p n THR 763 Cb 0.52 0.26 0.44 0.00 -2.10 0.00 0.00 70.33 69.45 1d2p n THR 763 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1d2p n SER 764 N -1.71 0.70 0.10 3.42 3.41 -1.26 -1.38 113.62 116.90 1d2p n SER 764 Ca -0.03 0.58 0.18 0.00 -0.26 0.00 0.00 58.87 59.33 1d2p n SER 764 Cb 0.21 -0.76 0.73 0.00 -0.26 0.00 0.00 64.21 64.13 1d2p n SER 764 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1d2p h GLU 765 N 0.00 0.00 -0.19 4.33 4.39 -1.95 0.38 114.58 121.53 1d2p h GLU 765 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1d2p h GLU 765 Cb 0.67 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.32 1d2p h GLU 765 CO 0.00 0.00 0.00 0.25 -1.16 0.00 0.00 179.01 178.10 1d2p n THR 766 N -4.17 1.55 -2.70 1.13 -2.24 -1.23 -4.95 114.28 101.67 1d2p n THR 766 Ca 0.06 -1.49 -0.15 0.00 -2.27 0.00 0.00 64.05 60.19 1d2p n THR 766 Cb 0.46 0.14 0.02 0.00 -2.10 0.00 0.00 70.33 68.85 1d2p n THR 766 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1d2p n ASN 767 N -0.34 -4.61 -2.67 3.42 3.02 0.13 -2.69 115.26 111.52 1d2p n ASN 767 Ca 0.13 -0.17 -0.20 0.00 -0.03 0.00 0.00 54.58 54.31 1d2p n ASN 767 Cb 0.57 -3.52 0.03 0.00 -0.61 0.00 0.00 39.78 36.26 1d2p n ASN 767 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1d2p n TRP 768 N -4.09 -1.72 -5.07 3.10 7.02 -0.48 -4.88 117.44 111.31 1d2p n TRP 768 Ca -0.09 0.45 -0.32 0.00 -1.02 0.00 0.00 57.50 56.52 1d2p n TRP 768 Cb 0.59 -4.10 -0.15 0.00 -2.42 0.00 0.00 31.31 25.23 1d2p n TRP 768 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1d2p s LYS 769 N -5.54 2.55 0.20 -0.99 1.02 -1.10 -1.26 119.74 114.62 1d2p s LYS 769 Ca 0.26 -0.80 0.06 0.00 0.02 0.00 0.00 55.97 55.51 1d2p s LYS 769 Cb -0.11 -2.28 -0.05 0.00 -0.52 0.00 0.00 37.83 34.87 1d2p s LYS 769 CO 0.32 0.49 -0.10 1.52 -0.92 0.00 0.00 175.35 176.65 1d2p s TYR 770 N -0.40 1.61 -0.26 3.18 1.13 -0.43 -4.81 117.35 117.37 1d2p s TYR 770 Ca 0.04 -0.68 -0.13 0.00 -1.41 0.00 0.00 57.07 54.89 1d2p s TYR 770 Cb -0.12 -0.81 0.09 0.00 -1.10 0.00 0.00 41.96 40.01 1d2p s TYR 770 CO 0.02 0.23 0.61 -2.00 -2.51 0.00 0.00 175.55 171.89 1d2p s GLU 771 N -3.71 0.59 -0.25 -3.49 2.12 -1.26 -1.53 118.70 111.17 1d2p s GLU 771 Ca 0.23 1.18 -0.08 0.00 0.36 0.00 0.00 54.97 56.66 1d2p s GLU 771 Cb 0.02 0.29 -0.04 0.00 0.26 0.00 0.00 34.13 34.66 1d2p s GLU 771 CO 0.06 -0.17 0.10 -0.06 -0.54 0.00 0.00 175.26 174.65 1d2p s PHE 772 N 1.96 3.15 0.25 5.30 0.08 0.23 -4.99 117.98 123.97 1d2p s PHE 772 Ca -0.08 -0.18 0.09 0.00 0.12 0.00 0.00 56.93 56.88 1d2p s PHE 772 Cb -0.08 -2.25 -0.04 0.00 -0.57 0.00 0.00 43.02 40.08 1d2p s PHE 772 CO -0.18 -0.21 0.01 0.21 -0.10 0.00 0.00 175.22 174.95 1d2p s LYS 773 N 1.43 2.35 -1.20 0.44 2.20 -1.26 -1.78 119.74 121.91 1d2p s LYS 773 Ca 0.06 -1.35 -0.13 0.00 -0.36 0.00 0.00 55.97 54.18 1d2p s LYS 773 Cb -0.15 -2.21 -0.01 0.00 -1.51 0.00 0.00 37.83 33.95 1d2p s LYS 773 CO 0.05 0.38 0.72 -0.25 -0.36 0.00 0.00 175.35 175.89 1d2p n ASP 774 N -0.81 -3.89 -4.87 1.43 8.00 -1.19 -4.98 116.55 110.23 1d2p n ASP 774 Ca -0.07 -0.97 -0.36 0.00 0.71 0.00 0.00 54.79 54.10 1d2p n ASP 774 Cb 0.58 -3.54 -0.06 0.00 -0.02 0.00 0.00 41.12 38.08 1d2p n ASP 774 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1d2p s LEU 775 N -6.52 4.40 0.25 0.64 1.02 0.23 -4.89 118.68 113.82 1d2p s LEU 775 Ca 0.32 0.64 -0.30 0.00 0.02 0.00 0.00 54.13 54.81 1d2p s LEU 775 Cb -0.11 -2.44 -0.10 0.00 0.02 0.00 0.00 46.19 43.56 1d2p s LEU 775 CO 0.85 0.33 1.46 -2.16 0.02 0.00 0.00 176.35 176.85 1d2p s PRO 776 N -1.32 4.25 0.15 1.29 0.04 -1.26 0.17 135.00 138.32 1d2p s PRO 776 Ca 0.22 2.33 0.09 0.00 0.04 0.00 0.00 61.00 63.68 1d2p s PRO 776 Cb -0.14 -3.10 -0.14 0.00 0.04 0.00 0.00 34.50 31.16 1d2p s PRO 776 CO 0.11 -0.44 1.27 -0.22 0.04 0.00 0.00 177.00 177.76 1d2p h LYS 777 N 5.07 0.00 -5.23 4.56 3.64 -1.78 -3.43 116.57 119.40 1d2p h LYS 777 Ca -0.46 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 58.55 1d2p h LYS 777 Cb 1.22 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.89 1d2p h LYS 777 CO 0.78 0.83 -0.72 0.71 -2.27 0.00 0.00 179.45 178.79 1d2p s TYR 778 N -2.77 1.43 -0.13 1.91 1.51 -1.26 -2.50 117.35 115.54 1d2p s TYR 778 Ca 0.01 -0.71 -0.03 0.00 -1.01 0.00 0.00 57.07 55.33 1d2p s TYR 778 Cb 0.09 -0.71 0.05 0.00 -0.11 0.00 0.00 41.96 41.28 1d2p s TYR 778 CO 0.80 0.17 0.06 0.34 -1.11 0.00 0.00 175.55 175.81 1d2p s ASP 779 N -3.22 2.01 -1.39 2.29 2.15 0.16 -4.84 116.67 113.82 1d2p s ASP 779 Ca 0.19 -0.39 -0.08 0.00 0.43 0.00 0.00 52.55 52.70 1d2p s ASP 779 Cb 0.02 -0.30 0.03 0.00 -0.30 0.00 0.00 42.92 42.37 1d2p s ASP 779 CO 0.03 -0.30 1.01 -0.62 -0.17 0.00 0.00 175.17 175.12 1d2p n GLU 780 N 5.23 -6.41 0.00 4.34 1.02 -1.18 -1.38 120.64 122.27 1d2p n GLU 780 Ca -0.06 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 57.79 1d2p n GLU 780 Cb 0.49 -5.62 0.00 0.00 -0.02 0.00 0.00 31.44 26.29 1d2p n GLU 780 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1d2p n GLY 781 N -1.71 2.63 3.79 0.62 0.00 -0.04 -4.86 105.19 105.62 1d2p n GLY 781 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1d2p n GLY 781 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2p s LYS 782 N -0.16 3.12 0.06 1.61 1.02 -0.48 -4.77 119.74 120.16 1d2p s LYS 782 Ca 0.00 -0.42 -0.31 0.00 0.02 0.00 0.00 55.97 55.26 1d2p s LYS 782 Cb 0.00 -2.90 -0.06 0.00 -0.52 0.00 0.00 37.83 34.34 1d2p s LYS 782 CO 0.00 0.67 1.33 0.21 -0.92 0.00 0.00 175.35 176.64 1d2p s LYS 783 N -1.53 4.35 0.04 1.68 2.20 -1.26 0.36 119.74 125.57 1d2p s LYS 783 Ca 0.21 1.94 -0.30 0.00 -0.36 0.00 0.00 55.97 57.45 1d2p s LYS 783 Cb -0.12 -3.37 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 1d2p s LYS 783 CO 0.11 -0.42 1.18 0.42 -0.36 0.00 0.00 175.35 176.29 1d2p s ILE 784 N 1.44 4.13 -0.52 5.43 1.01 -1.04 -4.88 121.20 126.77 1d2p s ILE 784 Ca 0.62 1.52 -0.21 0.00 0.00 0.00 0.00 60.65 62.59 1d2p s ILE 784 Cb -0.33 -3.98 0.05 0.00 0.01 0.00 0.00 42.46 38.22 1d2p s ILE 784 CO 0.29 0.10 0.73 -1.61 0.00 0.00 0.00 174.94 174.45 1d2p s GLU 785 N 1.22 3.19 -0.06 2.79 0.41 -1.26 -4.93 118.70 120.05 1d2p s GLU 785 Ca 0.58 -0.69 -0.15 0.00 -0.41 0.00 0.00 54.97 54.29 1d2p s GLU 785 Cb -0.28 -4.09 -0.05 0.00 -1.78 0.00 0.00 34.13 27.93 1d2p s GLU 785 CO 0.28 -1.31 0.39 0.71 -0.49 0.00 0.00 175.26 174.84 1d2p s TYR 786 N 3.06 3.62 0.25 1.61 2.02 -1.26 -0.86 117.35 125.80 1d2p s TYR 786 Ca 0.20 0.87 0.01 0.00 -0.37 0.00 0.00 57.07 57.79 1d2p s TYR 786 Cb -0.17 -2.34 -0.04 0.00 -0.40 0.00 0.00 41.96 39.01 1d2p s TYR 786 CO 0.14 0.47 0.13 0.95 -1.57 0.00 0.00 175.55 175.67 1d2p s THR 787 N -0.41 0.26 0.05 -0.71 -4.23 -0.54 -4.97 115.64 105.09 1d2p s THR 787 Ca 0.22 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.78 1d2p s THR 787 Cb -0.15 -2.55 -0.02 0.00 1.34 0.00 0.00 72.50 71.11 1d2p s THR 787 CO 0.10 0.00 -0.12 0.68 -0.54 0.00 0.00 174.62 174.74 1d2p s VAL 788 N -3.86 0.97 0.24 2.29 -7.23 -1.26 -0.63 120.40 110.92 1d2p s VAL 788 Ca 0.38 -1.04 0.02 0.00 -1.81 0.00 0.00 61.98 59.52 1d2p s VAL 788 Cb 0.07 -0.91 -0.05 0.00 0.56 0.00 0.00 36.38 36.04 1d2p s VAL 788 CO 0.15 -0.12 0.06 0.42 -0.31 0.00 0.00 175.10 175.31 1d2p s THR 789 N -1.00 0.64 -0.06 5.32 -4.23 -0.84 -4.96 115.64 110.51 1d2p s THR 789 Ca -0.01 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.52 1d2p s THR 789 Cb -0.08 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 71.28 1d2p s THR 789 CO 0.01 -0.14 -0.09 -0.70 -0.54 0.00 0.00 174.62 173.16 1d2p s GLU 790 N -3.99 1.35 0.46 3.99 2.12 -1.25 -0.01 118.70 121.36 1d2p s GLU 790 Ca 0.34 -0.29 -0.25 0.00 0.36 0.00 0.00 54.97 55.13 1d2p s GLU 790 Cb 0.07 -1.17 -0.08 0.00 0.26 0.00 0.00 34.13 33.21 1d2p s GLU 790 CO 0.11 -0.02 1.41 -0.51 -0.54 0.00 0.00 175.26 175.71 1d2p s ASP 791 N 0.77 5.85 0.15 -1.70 1.01 -0.80 -4.32 116.67 117.63 1d2p s ASP 791 Ca -0.13 2.87 -0.34 0.00 0.71 0.00 0.00 52.55 55.66 1d2p s ASP 791 Cb -0.15 -2.65 -0.16 0.00 1.01 0.00 0.00 42.92 40.97 1d2p s ASP 791 CO 0.02 -1.19 1.21 1.57 0.21 0.00 0.00 175.17 176.99 1d2p n HIS 792 N -0.27 1.34 -4.39 4.23 -0.00 -1.26 -4.73 115.22 110.14 1d2p n HIS 792 Ca 0.06 0.67 -0.34 0.00 -0.00 0.00 0.00 57.72 58.11 1d2p n HIS 792 Cb 0.42 -2.29 -0.13 0.00 -0.00 0.00 0.00 29.99 27.99 1d2p n HIS 792 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1d2p s VAL 793 N -0.02 3.55 0.07 3.57 1.01 -1.26 -5.00 120.40 122.31 1d2p s VAL 793 Ca 0.76 -0.47 -0.32 0.00 0.00 0.00 0.00 61.98 61.95 1d2p s VAL 793 Cb -0.88 -2.55 -0.11 0.00 0.00 0.00 0.00 36.38 32.84 1d2p s VAL 793 CO 0.51 0.48 1.85 1.17 0.00 0.00 0.00 175.10 179.11 1d2p n LYS 794 N 3.83 2.63 -1.25 2.72 0.00 -1.26 -2.63 118.16 122.20 1d2p n LYS 794 Ca -0.18 0.96 -0.09 0.00 0.00 0.00 0.00 58.31 59.01 1d2p n LYS 794 Cb 0.52 -2.85 -0.04 0.00 0.00 0.00 0.00 35.03 32.67 1d2p n LYS 794 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1d2p n ASP 795 N 6.03 -4.24 -4.23 3.14 8.00 -1.26 -5.03 116.55 118.96 1d2p n ASP 795 Ca 0.19 0.21 -0.24 0.00 0.71 0.00 0.00 54.79 55.66 1d2p n ASP 795 Cb 0.36 -2.50 -0.14 0.00 -0.02 0.00 0.00 41.12 38.82 1d2p n ASP 795 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1d2p s TYR 796 N -2.25 1.67 -0.31 1.24 1.51 -1.08 -0.98 117.35 117.16 1d2p s TYR 796 Ca 0.00 -0.37 -0.08 0.00 -1.01 0.00 0.00 57.07 55.61 1d2p s TYR 796 Cb 0.00 -0.99 0.00 0.00 -0.11 0.00 0.00 41.96 40.86 1d2p s TYR 796 CO 0.00 0.09 0.12 0.99 -1.11 0.00 0.00 175.55 175.63 1d2p s THR 797 N -0.83 4.27 0.16 -0.71 2.01 -0.05 -4.21 115.64 116.26 1d2p s THR 797 Ca 0.06 -0.59 -0.24 0.00 0.31 0.00 0.00 61.69 61.23 1d2p s THR 797 Cb -0.09 -3.20 -0.08 0.00 0.01 0.00 0.00 72.50 69.15 1d2p s THR 797 CO 0.02 0.06 0.74 -0.89 -0.69 0.00 0.00 174.62 173.86 1d2p s THR 798 N 1.55 4.43 -0.04 -0.82 2.01 -1.26 -2.42 115.64 119.08 1d2p s THR 798 Ca 0.03 1.62 0.02 0.00 0.31 0.00 0.00 61.69 63.67 1d2p s THR 798 Cb -0.17 -4.09 0.01 0.00 0.01 0.00 0.00 72.50 68.26 1d2p s THR 798 CO 0.04 0.52 -0.08 -0.62 -0.69 0.00 0.00 174.62 173.79 1d2p s ASP 799 N -1.16 1.26 -0.17 3.53 -1.08 -0.36 -4.87 116.67 113.81 1d2p s ASP 799 Ca 0.35 -0.20 0.01 0.00 -0.52 0.00 0.00 52.55 52.19 1d2p s ASP 799 Cb -0.22 -0.52 0.01 0.00 -1.46 0.00 0.00 42.92 40.73 1d2p s ASP 799 CO 0.25 0.01 -0.18 -0.63 0.52 0.00 0.00 175.17 175.14 1d2p s ILE 800 N 0.61 2.28 -0.30 4.11 1.01 -1.26 -0.90 121.20 126.75 1d2p s ILE 800 Ca -0.10 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 59.69 1d2p s ILE 800 Cb -0.13 -1.96 0.09 0.00 0.01 0.00 0.00 42.46 40.47 1d2p s ILE 800 CO 0.01 0.53 0.04 0.21 0.00 0.00 0.00 174.94 175.73 1d2p s ASN 801 N 1.14 4.27 1.56 3.58 2.47 -0.43 -5.01 114.94 122.52 1d2p s ASN 801 Ca 0.01 -1.73 0.00 0.00 0.42 0.00 0.00 52.86 51.56 1d2p s ASN 801 Cb -0.14 -1.23 0.00 0.00 -1.45 0.00 0.00 41.25 38.43 1d2p s ASN 801 CO -0.08 -0.36 0.00 0.61 -3.72 0.00 0.00 177.10 173.55 1d2p n GLY 802 N 4.58 3.08 1.00 1.21 0.00 -1.26 -1.47 105.19 112.32 1d2p n GLY 802 Ca -0.02 -0.19 0.10 0.00 0.00 0.00 0.00 46.02 45.91 1d2p n GLY 802 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1d2p n THR 803 N 0.00 0.63 -3.31 2.61 -2.24 -1.26 -4.67 114.28 106.04 1d2p n THR 803 Ca 0.00 -0.81 -0.41 0.00 -2.27 0.00 0.00 64.05 60.56 1d2p n THR 803 Cb 0.00 0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 68.98 1d2p n THR 803 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1d2p s THR 804 N -1.24 5.08 -0.27 4.28 2.01 -0.54 -3.29 115.64 121.68 1d2p s THR 804 Ca 0.34 0.30 -0.09 0.00 0.31 0.00 0.00 61.69 62.55 1d2p s THR 804 Cb 0.19 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 1d2p s THR 804 CO 0.27 -0.12 0.13 -0.63 -0.69 0.00 0.00 174.62 173.57 1d2p s ILE 805 N 2.23 4.74 -0.15 1.82 1.01 -0.81 -1.32 121.20 128.72 1d2p s ILE 805 Ca 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 60.65 60.73 1d2p s ILE 805 Cb -0.16 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.04 1d2p s ILE 805 CO 0.12 0.28 -0.06 -0.89 0.00 0.00 0.00 174.94 174.40 1d2p s THR 806 N 1.67 3.66 -0.18 2.92 2.01 -0.08 -0.31 115.64 125.34 1d2p s THR 806 Ca 0.07 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.63 1d2p s THR 806 Cb -0.16 -2.60 0.01 0.00 0.01 0.00 0.00 72.50 69.77 1d2p s THR 806 CO 0.07 0.49 -0.17 0.20 -0.69 0.00 0.00 174.62 174.52 1d2p s ASN 807 N 0.44 3.40 -0.12 3.53 0.01 -0.33 -1.22 114.94 120.64 1d2p s ASN 807 Ca -0.05 -0.57 -0.04 0.00 -0.71 0.00 0.00 52.86 51.49 1d2p s ASN 807 Cb -0.15 -1.53 -0.03 0.00 0.41 0.00 0.00 41.25 39.95 1d2p s ASN 807 CO 0.03 0.02 0.01 -0.75 -1.51 0.00 0.00 177.10 174.90 1d2p s LYS 808 N 1.19 3.38 -0.11 -0.60 2.47 -1.01 -0.11 119.74 124.95 1d2p s LYS 808 Ca 0.02 -0.41 -0.30 0.00 -1.56 0.00 0.00 55.97 53.73 1d2p s LYS 808 Cb -0.14 -2.93 -0.03 0.00 -1.46 0.00 0.00 37.83 33.27 1d2p s LYS 808 CO -0.08 0.51 1.32 -0.47 0.16 0.00 0.00 175.35 176.79 1d2p s TYR 809 N -0.33 2.80 -0.39 4.03 5.04 -0.61 -0.87 117.35 127.01 1d2p s TYR 809 Ca 0.07 0.91 0.03 0.00 -2.44 0.00 0.00 57.07 55.64 1d2p s TYR 809 Cb -0.12 -3.57 0.16 0.00 0.35 0.00 0.00 41.96 38.78 1d2p s TYR 809 CO 0.02 -2.03 0.35 0.95 -1.34 0.00 0.00 175.55 173.50 1d2p s THR 810 N 3.16 -0.08 -0.30 4.34 -4.23 -0.15 -4.94 115.64 113.44 1d2p s THR 810 Ca 0.59 -1.62 -0.42 0.00 -1.18 0.00 0.00 61.69 59.06 1d2p s THR 810 Cb -0.25 -0.89 -0.17 0.00 1.34 0.00 0.00 72.50 72.53 1d2p s THR 810 CO 0.20 -0.82 1.64 -2.65 -0.54 0.00 0.00 174.62 172.44 1d2p n PRO 811 N 3.72 0.76 -0.98 3.99 -0.02 -1.26 -1.21 135.00 140.00 1d2p n PRO 811 Ca 0.17 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1d2p n PRO 811 Cb 0.44 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1d2p n PRO 811 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d2p n GLY 812 N 3.88 0.41 2.96 -1.23 0.00 -1.26 -5.02 105.19 104.93 1d2p n GLY 812 Ca 0.27 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.14 1d2p n GLY 812 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d2p s GLU 813 N -0.51 0.38 0.00 1.61 0.41 -0.35 -1.85 118.70 118.39 1d2p s GLU 813 Ca 0.00 -0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.35 1d2p s GLU 813 Cb 0.00 -0.35 0.00 0.00 -1.78 0.00 0.00 34.13 32.00 1d2p s GLU 813 CO 0.00 0.09 0.00 0.25 -0.49 0.00 0.00 175.26 175.11 1d2p n THR 814 N 2.84 0.00 -4.54 3.63 -2.24 -0.41 -3.89 114.28 109.67 1d2p n THR 814 Ca -0.14 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.40 1d2p n THR 814 Cb 0.58 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.70 1d2p n THR 814 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1d2p s SER 815 N -0.23 3.09 -0.01 3.42 1.04 -1.26 -1.89 113.70 117.86 1d2p s SER 815 Ca 0.00 -1.39 0.02 0.00 0.48 0.00 0.00 55.95 55.06 1d2p s SER 815 Cb 0.00 -0.18 -0.00 0.00 0.10 0.00 0.00 66.02 65.93 1d2p s SER 815 CO 0.00 -0.56 -0.08 0.00 0.98 0.00 0.00 173.24 173.58 1d2p s ALA 816 N -3.03 0.73 -0.08 5.32 0.00 -0.90 -4.64 121.76 119.15 1d2p s ALA 816 Ca 0.35 -0.32 0.04 0.00 0.00 0.00 0.00 51.96 52.02 1d2p s ALA 816 Cb 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.98 1d2p s ALA 816 CO 0.16 0.14 -0.20 0.99 0.00 0.00 0.00 175.76 176.86 1d2p s THR 817 N 0.01 1.73 0.08 0.00 2.01 -0.37 -1.09 115.64 117.99 1d2p s THR 817 Ca 0.00 -0.83 0.09 0.00 0.31 0.00 0.00 61.69 61.26 1d2p s THR 817 Cb -0.06 -1.51 -0.03 0.00 0.01 0.00 0.00 72.50 70.91 1d2p s THR 817 CO -0.00 0.49 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.50 1d2p s VAL 818 N 0.42 2.46 -0.05 3.82 1.01 0.14 -0.92 120.40 127.28 1d2p s VAL 818 Ca -0.16 -1.45 -0.05 0.00 0.00 0.00 0.00 61.98 60.32 1d2p s VAL 818 Cb -0.17 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.18 1d2p s VAL 818 CO 0.07 0.24 0.14 -0.89 0.00 0.00 0.00 175.10 174.66 1d2p s THR 819 N -0.96 0.00 -0.18 3.92 2.01 -0.90 -0.83 115.64 118.71 1d2p s THR 819 Ca 0.14 -0.03 -0.10 0.00 0.31 0.00 0.00 61.69 62.02 1d2p s THR 819 Cb -0.10 -0.21 -0.05 0.00 0.01 0.00 0.00 72.50 72.15 1d2p s THR 819 CO 0.05 -0.01 0.15 -0.75 -0.69 0.00 0.00 174.62 173.37 1d2p s LYS 820 N 0.02 4.03 -0.29 4.92 2.47 -0.24 -1.39 119.74 129.27 1d2p s LYS 820 Ca -0.01 -0.16 -0.05 0.00 -1.56 0.00 0.00 55.97 54.19 1d2p s LYS 820 Cb -0.01 -3.37 0.02 0.00 -1.46 0.00 0.00 37.83 33.00 1d2p s LYS 820 CO 0.00 0.40 0.04 1.21 0.16 0.00 0.00 175.35 177.17 1d2p s ASN 821 N 0.06 4.93 -0.46 1.43 2.47 0.14 -4.48 114.94 119.02 1d2p s ASN 821 Ca 0.10 -0.79 -0.18 0.00 0.42 0.00 0.00 52.86 52.41 1d2p s ASN 821 Cb -0.11 -1.82 0.04 0.00 -1.45 0.00 0.00 41.25 37.91 1d2p s ASN 821 CO 0.00 -0.18 0.54 0.26 -3.72 0.00 0.00 177.10 174.00 1d2p s TRP 822 N 1.44 3.11 -0.83 0.43 0.52 -1.26 -0.55 118.94 121.81 1d2p s TRP 822 Ca 0.01 -0.44 -0.08 0.00 0.02 0.00 0.00 56.10 55.62 1d2p s TRP 822 Cb -0.17 -3.25 0.21 0.00 -1.15 0.00 0.00 33.47 29.11 1d2p s TRP 822 CO 0.01 -0.87 0.73 0.34 0.02 0.00 0.00 176.95 177.18 1d2p s ASP 823 N 2.26 6.31 -0.33 2.95 2.15 -0.55 -4.77 116.67 124.69 1d2p s ASP 823 Ca 0.14 -3.03 0.15 0.00 0.43 0.00 0.00 52.55 50.24 1d2p s ASP 823 Cb -0.18 -2.07 0.43 0.00 -0.30 0.00 0.00 42.92 40.80 1d2p s ASP 823 CO 0.13 -0.41 1.40 -0.90 -0.17 0.00 0.00 175.17 175.22 1d2p n ASP 824 N 3.40 -0.80 -4.07 -0.34 5.68 -1.26 -1.26 116.55 117.90 1d2p n ASP 824 Ca 0.15 -2.25 -0.28 0.00 -0.50 0.00 0.00 54.79 51.91 1d2p n ASP 824 Cb 0.42 0.45 -0.04 0.00 -1.14 0.00 0.00 41.12 40.81 1d2p n ASP 824 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1d2p n ASN 825 N -1.13 -0.23 -3.33 -1.12 4.13 -1.26 -1.04 115.26 111.28 1d2p n ASN 825 Ca -0.09 -1.11 -0.24 0.00 1.68 0.00 0.00 54.58 54.82 1d2p n ASN 825 Cb 0.86 -2.53 0.03 0.00 -1.54 0.00 0.00 39.78 36.60 1d2p n ASN 825 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1d2p n ASN 826 N -2.91 -5.51 -3.33 6.41 3.02 -1.26 -2.38 115.26 109.29 1d2p n ASN 826 Ca -0.30 -0.43 -0.24 0.00 -0.03 0.00 0.00 54.58 53.58 1d2p n ASN 826 Cb 0.68 -4.44 0.02 0.00 -0.61 0.00 0.00 39.78 35.44 1d2p n ASN 826 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1d2p n ASN 827 N -2.61 -5.11 -0.01 6.41 5.15 -0.21 -4.86 115.26 114.02 1d2p n ASN 827 Ca -0.05 -0.42 0.05 0.00 -0.60 0.00 0.00 54.58 53.56 1d2p n ASN 827 Cb 0.58 -4.13 0.44 0.00 -0.53 0.00 0.00 39.78 36.13 1d2p n ASN 827 CO 0.00 0.00 0.00 0.06 1.40 0.00 0.00 177.26 178.72 1d2p h GLN 828 N -1.47 0.52 -0.00 1.20 3.07 -1.54 -0.45 115.11 116.45 1d2p h GLN 828 Ca -0.51 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 58.20 1d2p h GLN 828 Cb 1.34 -0.12 0.00 0.00 0.08 0.00 0.00 27.48 28.78 1d2p h GLN 828 CO 0.57 0.34 -0.05 -3.47 0.09 0.00 0.00 178.83 176.32 1d2p n ASP 829 N -4.48 0.37 -3.79 0.06 2.03 -1.26 -4.95 116.55 104.53 1d2p n ASP 829 Ca 0.04 -0.73 -0.27 0.00 0.52 0.00 0.00 54.79 54.35 1d2p n ASP 829 Cb 0.10 -0.08 0.04 0.00 -0.72 0.00 0.00 41.12 40.46 1d2p n ASP 829 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1d2p n GLY 830 N 1.19 -0.46 0.39 0.27 0.00 -0.18 -4.89 105.19 101.50 1d2p n GLY 830 Ca 0.18 0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.44 1d2p n GLY 830 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d2p n LYS 831 N -4.66 0.62 -2.33 1.61 4.76 -1.26 -5.01 118.16 111.88 1d2p n LYS 831 Ca -0.04 -1.17 -0.42 0.00 -2.87 0.00 0.00 58.31 53.82 1d2p n LYS 831 Cb 0.57 -1.18 -0.03 0.00 -1.84 0.00 0.00 35.03 32.54 1d2p n LYS 831 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1d2p s ARG 832 N -0.80 4.42 0.79 1.97 3.52 -1.26 -4.99 118.95 122.61 1d2p s ARG 832 Ca 0.12 1.91 -0.11 0.00 -0.13 0.00 0.00 55.73 57.52 1d2p s ARG 832 Cb 0.08 -3.27 0.07 0.00 -1.56 0.00 0.00 34.95 30.27 1d2p s ARG 832 CO 0.12 -0.23 1.10 -1.25 -0.81 0.00 0.00 175.30 174.22 1d2p s PRO 833 N 0.46 2.07 0.04 5.12 0.04 -1.26 -4.94 135.00 136.53 1d2p s PRO 833 Ca 0.58 1.19 0.27 0.00 0.04 0.00 0.00 61.00 63.07 1d2p s PRO 833 Cb -0.33 -1.87 0.84 0.00 0.04 0.00 0.00 34.50 33.18 1d2p s PRO 833 CO 0.33 -1.78 1.67 0.25 0.04 0.00 0.00 177.00 177.51 1d2p n THR 834 N -3.62 0.11 -3.53 1.26 -2.24 -1.26 -4.92 114.28 100.08 1d2p n THR 834 Ca 0.09 -0.06 -0.10 0.00 -2.27 0.00 0.00 64.05 61.71 1d2p n THR 834 Cb 0.53 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.51 1d2p n THR 834 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1d2p s GLU 835 N -3.03 0.78 0.15 -0.78 -1.05 -1.26 -4.40 118.70 109.11 1d2p s GLU 835 Ca 0.12 -0.11 -0.03 0.00 -0.15 0.00 0.00 54.97 54.80 1d2p s GLU 835 Cb 0.17 0.36 -0.03 0.00 -0.44 0.00 0.00 34.13 34.19 1d2p s GLU 835 CO 0.62 -0.31 0.12 0.96 0.95 0.00 0.00 175.26 177.60 1d2p s ILE 836 N -2.33 0.08 -0.06 1.83 -4.36 -0.59 -4.99 121.20 110.78 1d2p s ILE 836 Ca 0.01 -1.82 0.04 0.00 -0.26 0.00 0.00 60.65 58.62 1d2p s ILE 836 Cb -0.01 -2.09 -0.00 0.00 1.25 0.00 0.00 42.46 41.61 1d2p s ILE 836 CO -0.04 -0.35 -0.19 -0.75 0.24 0.00 0.00 174.94 173.86 1d2p s LYS 837 N -4.05 2.12 0.16 0.37 2.20 -1.26 -0.51 119.74 118.77 1d2p s LYS 837 Ca 0.25 -0.67 0.09 0.00 -0.36 0.00 0.00 55.97 55.28 1d2p s LYS 837 Cb 0.06 -1.76 -0.04 0.00 -1.51 0.00 0.00 37.83 34.59 1d2p s LYS 837 CO 0.03 0.21 -0.19 0.14 -0.36 0.00 0.00 175.35 175.19 1d2p s VAL 838 N 0.19 1.84 0.04 4.02 -7.23 -0.79 0.39 120.40 118.86 1d2p s VAL 838 Ca -0.09 -1.90 0.03 0.00 -1.81 0.00 0.00 61.98 58.21 1d2p s VAL 838 Cb -0.14 -1.84 -0.02 0.00 0.56 0.00 0.00 36.38 34.94 1d2p s VAL 838 CO 0.04 -0.29 -0.10 -0.70 -0.31 0.00 0.00 175.10 173.74 1d2p s GLU 839 N -2.74 0.64 0.03 4.82 2.12 0.67 -1.18 118.70 123.06 1d2p s GLU 839 Ca 0.15 -0.74 -0.22 0.00 0.36 0.00 0.00 54.97 54.52 1d2p s GLU 839 Cb -0.06 -0.53 -0.06 0.00 0.26 0.00 0.00 34.13 33.75 1d2p s GLU 839 CO 0.07 0.11 0.64 -1.17 -0.54 0.00 0.00 175.26 174.37 1d2p s LEU 840 N -1.40 4.45 -0.07 2.70 2.96 0.32 -1.21 118.68 126.44 1d2p s LEU 840 Ca -0.05 1.27 0.03 0.00 -0.22 0.00 0.00 54.13 55.16 1d2p s LEU 840 Cb -0.09 -3.01 0.00 0.00 0.50 0.00 0.00 46.19 43.60 1d2p s LEU 840 CO 0.01 0.11 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.68 1d2p s TYR 841 N -0.35 1.78 -0.22 5.38 1.51 0.29 -1.18 117.35 124.56 1d2p s TYR 841 Ca 0.33 -0.64 -0.01 0.00 -1.01 0.00 0.00 57.07 55.74 1d2p s TYR 841 Cb -0.19 -1.24 0.02 0.00 -0.11 0.00 0.00 41.96 40.44 1d2p s TYR 841 CO 0.19 -0.27 -0.11 1.14 -1.11 0.00 0.00 175.55 175.39 1d2p s GLN 842 N 0.39 2.92 -1.47 -0.62 -2.07 -0.66 -0.90 119.66 117.26 1d2p s GLN 842 Ca -0.12 -0.90 0.00 0.00 -1.82 0.00 0.00 55.36 52.52 1d2p s GLN 842 Cb -0.15 -2.84 0.00 0.00 -1.09 0.00 0.00 33.01 28.93 1d2p s GLN 842 CO 0.04 -0.32 0.00 -0.25 -1.32 0.00 0.00 175.29 173.45 1d2p n ASP 843 N 4.65 -4.74 0.00 12.60 8.00 0.22 -2.70 116.55 134.59 1d2p n ASP 843 Ca -0.18 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.51 1d2p n ASP 843 Cb 0.48 -3.72 0.00 0.00 -0.02 0.00 0.00 41.12 37.86 1d2p n ASP 843 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d2p n GLY 844 N -1.06 0.63 3.62 0.44 0.00 -1.26 -5.02 105.19 102.54 1d2p n GLY 844 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 1d2p n GLY 844 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2p s LYS 845 N -0.78 2.63 -0.00 1.61 -0.14 -1.10 -5.06 119.74 116.90 1d2p s LYS 845 Ca 0.00 -0.68 -0.30 0.00 -1.36 0.00 0.00 55.97 53.63 1d2p s LYS 845 Cb 0.00 -2.56 -0.06 0.00 -1.68 0.00 0.00 37.83 33.53 1d2p s LYS 845 CO 0.00 0.61 1.58 0.00 -0.76 0.00 0.00 175.35 176.78 1d2p s ALA 846 N -1.02 3.63 -0.39 5.17 0.00 -1.26 -1.65 121.76 126.25 1d2p s ALA 846 Ca 0.18 1.00 0.23 0.00 0.00 0.00 0.00 51.96 53.36 1d2p s ALA 846 Cb -0.11 -3.69 0.26 0.00 0.00 0.00 0.00 23.12 19.58 1d2p s ALA 846 CO 0.08 -1.17 1.47 1.79 0.00 0.00 0.00 175.76 177.93 1d2p h THR 847 N 5.16 0.00 0.00 0.00 1.35 -1.52 -3.48 112.91 114.42 1d2p h THR 847 Ca -0.40 -1.00 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 1d2p h THR 847 Cb 1.18 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.48 1d2p h THR 847 CO 0.93 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.82 1d2p n GLY 848 N 1.12 0.97 3.61 5.82 0.00 -1.26 -5.02 105.19 110.43 1d2p n GLY 848 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1d2p n GLY 848 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d2p s LYS 849 N -0.63 3.93 0.38 1.61 1.02 -1.26 -4.98 119.74 119.81 1d2p s LYS 849 Ca 0.00 0.65 0.07 0.00 0.02 0.00 0.00 55.97 56.71 1d2p s LYS 849 Cb 0.00 -3.76 -0.07 0.00 -0.52 0.00 0.00 37.83 33.48 1d2p s LYS 849 CO 0.00 -0.80 -0.01 0.95 -0.92 0.00 0.00 175.35 174.57 1d2p s THR 850 N 3.23 1.92 -0.09 2.17 -4.23 -1.26 -0.52 115.64 116.86 1d2p s THR 850 Ca 0.36 -2.05 -0.16 0.00 -1.18 0.00 0.00 61.69 58.67 1d2p s THR 850 Cb -0.13 -2.87 0.04 0.00 1.34 0.00 0.00 72.50 70.88 1d2p s THR 850 CO 0.15 -0.06 0.39 0.00 -0.54 0.00 0.00 174.62 174.56 1d2p s ALA 851 N -2.79 -0.97 -0.30 3.99 0.00 -0.33 -4.99 121.76 116.37 1d2p s ALA 851 Ca 0.34 0.84 -0.09 0.00 0.00 0.00 0.00 51.96 53.05 1d2p s ALA 851 Cb 0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 1d2p s ALA 851 CO 0.17 -0.23 0.14 0.42 0.00 0.00 0.00 175.76 176.26 1d2p s ILE 852 N -0.47 4.62 -0.18 0.00 -1.09 -1.26 -1.88 121.20 120.94 1d2p s ILE 852 Ca -0.06 -0.34 -0.10 0.00 -2.23 0.00 0.00 60.65 57.93 1d2p s ILE 852 Cb -0.04 -3.32 -0.05 0.00 -1.58 0.00 0.00 42.46 37.48 1d2p s ILE 852 CO 0.03 0.12 0.14 -0.76 -1.23 0.00 0.00 174.94 173.23 1d2p s LEU 853 N 1.63 4.24 0.00 2.97 1.43 0.33 -4.95 118.68 124.33 1d2p s LEU 853 Ca 0.05 0.28 -0.08 0.00 -1.03 0.00 0.00 54.13 53.35 1d2p s LEU 853 Cb -0.17 -2.10 0.03 0.00 0.03 0.00 0.00 46.19 43.99 1d2p s LEU 853 CO 0.06 0.22 0.53 -0.46 0.23 0.00 0.00 176.35 176.93 1d2p n ASN 854 N 3.24 -1.52 0.25 2.29 0.23 -1.26 -1.54 115.26 116.95 1d2p n ASN 854 Ca -0.17 -2.28 0.09 0.00 -0.53 0.00 0.00 54.58 51.70 1d2p n ASN 854 Cb 0.53 2.59 0.64 0.00 -2.08 0.00 0.00 39.78 41.45 1d2p n ASN 854 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1d2p h GLU 855 N 0.00 0.00 -0.44 -3.83 4.57 -1.95 0.12 114.58 113.05 1d2p h GLU 855 Ca -0.24 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 57.85 1d2p h GLU 855 Cb 0.92 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.50 1d2p h GLU 855 CO 0.31 0.12 -0.06 0.66 -1.18 0.00 0.00 179.01 178.86 1d2p h SER 856 N 0.00 0.82 -0.64 1.04 4.64 -1.96 -2.99 113.55 114.47 1d2p h SER 856 Ca -0.00 -0.34 -0.08 0.00 -0.47 0.00 0.00 61.79 60.90 1d2p h SER 856 Cb 0.25 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 62.07 1d2p h SER 856 CO 0.02 0.97 0.10 -0.46 -0.87 0.00 0.00 176.83 176.59 1d2p n ASN 857 N -4.32 5.40 -2.49 4.97 0.23 -1.14 -4.92 115.26 112.98 1d2p n ASN 857 Ca -0.00 -3.03 -0.21 0.00 -0.53 0.00 0.00 54.58 50.81 1d2p n ASN 857 Cb 0.35 -0.71 -0.00 0.00 -2.08 0.00 0.00 39.78 37.33 1d2p n ASN 857 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1d2p n ASN 858 N 0.34 -5.84 -3.59 0.53 4.13 -1.08 -2.59 115.26 107.17 1d2p n ASN 858 Ca 0.33 -0.04 -0.27 0.00 1.68 0.00 0.00 54.58 56.28 1d2p n ASN 858 Cb 1.27 -4.85 0.02 0.00 -1.54 0.00 0.00 39.78 34.69 1d2p n ASN 858 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 1d2p n TRP 859 N -4.04 -2.13 -3.89 3.10 7.02 0.38 -4.83 117.44 113.05 1d2p n TRP 859 Ca -0.22 0.72 -0.11 0.00 -1.02 0.00 0.00 57.50 56.87 1d2p n TRP 859 Cb 0.68 -3.83 -0.10 0.00 -2.42 0.00 0.00 31.31 25.64 1d2p n TRP 859 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 1d2p s THR 860 N -3.17 0.08 -0.08 -0.99 -1.32 -1.07 -1.08 115.64 108.01 1d2p s THR 860 Ca 0.53 -0.66 -0.22 0.00 -1.21 0.00 0.00 61.69 60.13 1d2p s THR 860 Cb -0.26 -0.37 0.05 0.00 -1.51 0.00 0.00 72.50 70.41 1d2p s THR 860 CO 0.65 -0.36 0.51 -2.28 -2.21 0.00 0.00 174.62 170.93 1d2p s HIS 861 N -1.24 -0.47 -0.13 9.09 2.46 -0.01 -4.92 115.29 120.08 1d2p s HIS 861 Ca -0.13 0.91 -0.00 0.00 0.47 0.00 0.00 55.06 56.30 1d2p s HIS 861 Cb -0.07 0.24 0.03 0.00 -0.13 0.00 0.00 32.58 32.65 1d2p s HIS 861 CO 0.01 -0.44 -0.08 0.99 -2.47 0.00 0.00 174.74 172.75 1d2p s THR 862 N -0.84 1.10 0.23 0.89 2.01 -1.26 0.26 115.64 118.03 1d2p s THR 862 Ca -0.09 -0.40 -0.09 0.00 0.31 0.00 0.00 61.69 61.42 1d2p s THR 862 Cb -0.03 -1.14 -0.07 0.00 0.01 0.00 0.00 72.50 71.27 1d2p s THR 862 CO 0.05 0.32 0.55 0.26 -0.69 0.00 0.00 174.62 175.11 1d2p s TRP 863 N 1.67 3.43 0.42 4.92 0.51 -0.25 -4.92 118.94 124.72 1d2p s TRP 863 Ca 0.04 0.85 0.06 0.00 -2.12 0.00 0.00 56.10 54.93 1d2p s TRP 863 Cb -0.13 -2.24 -0.07 0.00 -0.81 0.00 0.00 33.47 30.22 1d2p s TRP 863 CO -0.08 0.26 0.01 0.95 -0.51 0.00 0.00 176.95 177.58 1d2p s THR 864 N -1.84 1.77 -0.54 2.01 -4.23 -1.26 -2.12 115.64 109.43 1d2p s THR 864 Ca 0.47 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.98 1d2p s THR 864 Cb -0.11 -2.82 0.00 0.00 1.34 0.00 0.00 72.50 70.91 1d2p s THR 864 CO 0.22 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.91 1d2p n GLY 865 N -1.01 0.15 3.68 3.99 0.00 -1.22 -4.99 105.19 105.79 1d2p n GLY 865 Ca -0.08 -0.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 1d2p n GLY 865 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d2p s LEU 866 N -1.77 4.18 0.27 0.99 1.43 -0.79 -4.91 118.68 118.07 1d2p s LEU 866 Ca 0.00 0.66 -0.30 0.00 -1.03 0.00 0.00 54.13 53.47 1d2p s LEU 866 Cb 0.00 -2.64 -0.10 0.00 0.03 0.00 0.00 46.19 43.48 1d2p s LEU 866 CO 0.00 -0.10 1.33 -1.81 0.23 0.00 0.00 176.35 176.00 1d2p s ASP 867 N 0.97 6.81 0.25 2.29 1.01 -1.26 -1.29 116.67 125.44 1d2p s ASP 867 Ca 0.23 2.57 0.21 0.00 0.71 0.00 0.00 52.55 56.27 1d2p s ASP 867 Cb -0.15 -2.63 0.07 0.00 1.01 0.00 0.00 42.92 41.22 1d2p s ASP 867 CO 0.09 -0.55 1.18 -0.33 0.21 0.00 0.00 175.17 175.77 1d2p h GLU 868 N 4.43 0.00 -4.84 8.23 5.08 -1.74 -3.44 114.58 122.31 1d2p h GLU 868 Ca -0.47 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.55 1d2p h GLU 868 Cb 1.22 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.24 1d2p h GLU 868 CO 0.72 0.07 -0.76 0.15 -1.00 0.00 0.00 179.01 178.20 1d2p s LYS 869 N -3.24 0.65 -0.04 2.33 1.02 -1.26 -1.74 119.74 117.46 1d2p s LYS 869 Ca 0.01 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.30 1d2p s LYS 869 Cb 0.08 -0.55 0.01 0.00 -0.52 0.00 0.00 37.83 36.86 1d2p s LYS 869 CO 0.76 0.12 -0.08 0.00 -0.92 0.00 0.00 175.35 175.24 1d2p s ALA 870 N -1.08 0.83 0.00 5.17 0.00 -0.07 -4.87 121.76 121.74 1d2p s ALA 870 Ca -0.04 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1d2p s ALA 870 Cb -0.08 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.65 1d2p s ALA 870 CO 0.01 0.08 0.00 1.63 0.00 0.00 0.00 175.76 177.48 1d2p n LYS 871 N 3.62 0.00 0.00 0.00 4.01 -1.26 -1.59 118.16 122.94 1d2p n LYS 871 Ca -0.21 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.59 1d2p n LYS 871 Cb 0.53 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.05 1d2p n LYS 871 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1d2p n GLY 872 N 0.00 -0.18 3.86 0.72 0.00 -1.26 -5.06 105.19 103.27 1d2p n GLY 872 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1d2p n GLY 872 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1d2p s GLN 873 N -0.41 3.03 -0.06 1.61 -2.07 -0.62 -5.09 119.66 116.05 1d2p s GLN 873 Ca 0.00 -1.00 -0.28 0.00 -1.82 0.00 0.00 55.36 52.27 1d2p s GLN 873 Cb 0.00 -2.63 -0.03 0.00 -1.09 0.00 0.00 33.01 29.26 1d2p s GLN 873 CO 0.00 0.40 0.89 1.14 -1.32 0.00 0.00 175.29 176.40 1d2p s GLN 874 N -3.88 4.46 0.67 9.60 -2.07 -1.26 -0.89 119.66 126.29 1d2p s GLN 874 Ca 0.33 1.22 -0.15 0.00 -1.82 0.00 0.00 55.36 54.94 1d2p s GLN 874 Cb -0.08 -3.49 0.01 0.00 -1.09 0.00 0.00 33.01 28.36 1d2p s GLN 874 CO 0.26 -0.12 1.14 0.08 -1.32 0.00 0.00 175.29 175.33 1d2p s VAL 875 N 1.33 2.99 -0.10 3.63 1.01 -0.71 -4.92 120.40 123.63 1d2p s VAL 875 Ca 0.45 0.47 0.01 0.00 0.00 0.00 0.00 61.98 62.92 1d2p s VAL 875 Cb -0.19 -3.01 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 1d2p s VAL 875 CO 0.21 -0.27 -0.12 -0.75 0.00 0.00 0.00 175.10 174.17 1d2p s LYS 876 N -4.00 3.05 -0.08 2.72 2.20 -1.26 -4.95 119.74 117.42 1d2p s LYS 876 Ca 0.69 -0.67 0.04 0.00 -0.36 0.00 0.00 55.97 55.67 1d2p s LYS 876 Cb -0.23 -2.56 -0.01 0.00 -1.51 0.00 0.00 37.83 33.52 1d2p s LYS 876 CO 0.42 0.39 -0.21 0.71 -0.36 0.00 0.00 175.35 176.30 1d2p s TYR 877 N -0.11 2.58 0.12 4.03 2.02 -1.26 0.72 117.35 125.44 1d2p s TYR 877 Ca -0.01 -0.69 -0.01 0.00 -0.37 0.00 0.00 57.07 55.99 1d2p s TYR 877 Cb -0.14 -1.68 -0.04 0.00 -0.40 0.00 0.00 41.96 39.71 1d2p s TYR 877 CO 0.03 -0.20 0.02 0.95 -1.57 0.00 0.00 175.55 174.79 1d2p s THR 878 N -0.04 0.22 0.16 -0.71 -4.23 -0.07 -4.83 115.64 106.14 1d2p s THR 878 Ca -0.06 -1.90 0.09 0.00 -1.18 0.00 0.00 61.69 58.64 1d2p s THR 878 Cb -0.15 -1.92 -0.04 0.00 1.34 0.00 0.00 72.50 71.74 1d2p s THR 878 CO 0.05 -0.61 -0.13 0.68 -0.54 0.00 0.00 174.62 174.07 1d2p s VAL 879 N -3.95 3.07 -0.04 2.29 -7.23 -1.26 -0.55 120.40 112.72 1d2p s VAL 879 Ca 0.20 -1.61 0.02 0.00 -1.81 0.00 0.00 61.98 58.78 1d2p s VAL 879 Cb 0.07 -2.48 0.01 0.00 0.56 0.00 0.00 36.38 34.54 1d2p s VAL 879 CO -0.01 -0.04 -0.10 -0.70 -0.31 0.00 0.00 175.10 173.94 1d2p s GLU 880 N -2.60 1.21 -0.17 4.82 2.56 -0.35 -4.96 118.70 119.22 1d2p s GLU 880 Ca 0.23 -0.34 -0.22 0.00 0.00 0.00 0.00 54.97 54.64 1d2p s GLU 880 Cb -0.09 -1.09 -0.03 0.00 2.00 0.00 0.00 34.13 34.92 1d2p s GLU 880 CO 0.13 0.09 0.66 -2.00 -0.56 0.00 0.00 175.26 173.58 1d2p s GLU 881 N 0.37 4.27 -0.07 4.30 2.12 -1.26 -0.24 118.70 128.19 1d2p s GLU 881 Ca -0.07 0.71 -0.01 0.00 0.36 0.00 0.00 54.97 55.96 1d2p s GLU 881 Cb -0.11 -3.55 -0.00 0.00 0.26 0.00 0.00 34.13 30.73 1d2p s GLU 881 CO 0.01 -0.18 -0.02 -0.07 -0.54 0.00 0.00 175.26 174.46 1d2p h LEU 882 N 7.88 0.00 -9.49 2.70 3.38 -0.42 -3.46 115.31 115.90 1d2p h LEU 882 Ca -0.33 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.06 1d2p h LEU 882 Cb 1.15 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.95 1d2p h LEU 882 CO 0.78 0.34 0.89 0.35 0.09 0.00 0.00 178.44 180.90 1d2p n THR 883 N -3.72 0.12 -3.49 0.22 -2.24 -1.22 -4.96 114.28 98.98 1d2p n THR 883 Ca -0.01 -0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.37 1d2p n THR 883 Cb 0.04 -1.68 -0.10 0.00 -2.10 0.00 0.00 70.33 66.49 1d2p n THR 883 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1d2p s LYS 884 N 1.57 4.01 -0.22 -0.78 2.20 -1.26 -4.85 119.74 120.41 1d2p s LYS 884 Ca 0.81 -0.11 -0.07 0.00 -0.36 0.00 0.00 55.97 56.24 1d2p s LYS 884 Cb -0.65 -3.64 -0.03 0.00 -1.51 0.00 0.00 37.83 32.00 1d2p s LYS 884 CO 0.39 -0.19 0.07 0.14 -0.36 0.00 0.00 175.35 175.40 1d2p s VAL 885 N 1.80 4.53 0.35 4.02 -7.23 -1.26 -5.07 120.40 117.54 1d2p s VAL 885 Ca 0.12 -0.11 -0.29 0.00 -1.81 0.00 0.00 61.98 59.89 1d2p s VAL 885 Cb -0.16 -3.09 -0.11 0.00 0.56 0.00 0.00 36.38 33.59 1d2p s VAL 885 CO 0.10 0.38 1.52 -0.54 -0.31 0.00 0.00 175.10 176.25 1d2p s LYS 886 N 1.13 4.11 0.00 4.82 3.01 -1.26 -2.83 119.74 128.73 1d2p s LYS 886 Ca 0.04 2.58 0.00 0.00 -1.01 0.00 0.00 55.97 57.58 1d2p s LYS 886 Cb -0.14 -2.98 0.00 0.00 -1.01 0.00 0.00 37.83 33.69 1d2p s LYS 886 CO 0.03 -0.57 0.00 0.41 0.51 0.00 0.00 175.35 175.74 1d2p n GLY 887 N 0.99 1.41 3.35 -3.33 0.00 -1.26 -5.03 105.19 101.32 1d2p n GLY 887 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1d2p n GLY 887 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d2p s TYR 888 N -3.14 2.25 -0.10 1.61 1.51 -1.13 -1.29 117.35 117.07 1d2p s TYR 888 Ca 0.00 -0.40 -0.00 0.00 -1.01 0.00 0.00 57.07 55.66 1d2p s TYR 888 Cb 0.00 -1.31 -0.03 0.00 -0.11 0.00 0.00 41.96 40.52 1d2p s TYR 888 CO 0.00 0.19 -0.07 0.95 -1.11 0.00 0.00 175.55 175.50 1d2p s THR 889 N -0.89 3.63 0.03 -0.71 -4.23 -0.05 -4.83 115.64 108.59 1d2p s THR 889 Ca 0.12 -0.49 0.01 0.00 -1.18 0.00 0.00 61.69 60.15 1d2p s THR 889 Cb -0.10 -2.51 -0.04 0.00 1.34 0.00 0.00 72.50 71.19 1d2p s THR 889 CO 0.03 0.56 0.07 -0.89 -0.54 0.00 0.00 174.62 173.85 1d2p s THR 890 N -0.38 4.57 -0.07 3.99 2.01 -1.26 -0.40 115.64 124.09 1d2p s THR 890 Ca 0.05 -0.58 -0.05 0.00 0.31 0.00 0.00 61.69 61.43 1d2p s THR 890 Cb -0.12 -3.13 0.03 0.00 0.01 0.00 0.00 72.50 69.29 1d2p s THR 890 CO 0.02 0.26 0.18 -2.28 -0.69 0.00 0.00 174.62 172.11 1d2p s HIS 891 N -1.26 -0.21 -0.09 4.92 5.65 -0.56 -5.02 115.29 118.73 1d2p s HIS 891 Ca 0.25 0.53 0.04 0.00 0.25 0.00 0.00 55.06 56.13 1d2p s HIS 891 Cb -0.12 0.00 -0.01 0.00 -1.18 0.00 0.00 32.58 31.28 1d2p s HIS 891 CO 0.17 -0.15 -0.23 0.08 -0.65 0.00 0.00 174.74 173.96 1d2p s VAL 892 N 0.74 2.21 -0.42 0.89 1.01 -1.26 -0.83 120.40 122.74 1d2p s VAL 892 Ca -0.05 -0.98 -0.14 0.00 0.00 0.00 0.00 61.98 60.81 1d2p s VAL 892 Cb -0.07 -1.84 0.04 0.00 0.00 0.00 0.00 36.38 34.50 1d2p s VAL 892 CO -0.04 0.56 0.31 -0.62 0.00 0.00 0.00 175.10 175.30 1d2p s ASP 893 N 0.19 6.04 -0.14 3.32 -1.08 0.16 -4.93 116.67 120.23 1d2p s ASP 893 Ca -0.14 -1.04 0.16 0.00 -0.52 0.00 0.00 52.55 51.01 1d2p s ASP 893 Cb -0.17 -2.14 0.58 0.00 -1.46 0.00 0.00 42.92 39.74 1d2p s ASP 893 CO 0.07 -0.49 1.49 0.59 0.52 0.00 0.00 175.17 177.35 1d2p n ASN 894 N 5.14 4.21 -0.31 -0.34 3.02 -1.26 -2.26 115.26 123.46 1d2p n ASN 894 Ca -0.11 -2.71 0.05 0.00 -0.03 0.00 0.00 54.58 51.78 1d2p n ASN 894 Cb 0.46 -0.52 0.20 0.00 -0.61 0.00 0.00 39.78 39.31 1d2p n ASN 894 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1d2p h ASN 895 N 2.68 0.68 -3.25 6.41 -0.26 -1.92 -3.40 115.58 116.53 1d2p h ASN 895 Ca 0.00 0.06 -0.45 0.00 -0.56 0.00 0.00 56.30 55.35 1d2p h ASN 895 Cb 1.41 -0.07 -0.38 0.00 -1.06 0.00 0.00 38.32 38.22 1d2p h ASN 895 CO 0.23 0.36 -0.77 -0.62 -1.06 0.00 0.00 177.43 175.57 1d2p s ASP 896 N -5.57 1.70 0.51 5.81 -1.08 -1.26 -5.02 116.67 111.76 1d2p s ASP 896 Ca -0.12 -0.13 0.34 0.00 -0.52 0.00 0.00 52.55 52.12 1d2p s ASP 896 Cb 0.21 -0.49 1.85 0.00 -1.46 0.00 0.00 42.92 43.02 1d2p s ASP 896 CO 0.79 -0.19 2.05 0.00 0.52 0.00 0.00 175.17 178.34 1d2p h MET 897 N 8.31 0.00 -0.00 4.34 -0.00 -1.88 0.19 114.93 125.89 1d2p h MET 897 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.49 1d2p h MET 897 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.73 1d2p h MET 897 CO 0.28 0.00 -0.09 0.41 -0.00 0.00 0.00 176.91 177.51 1d2p n GLY 898 N -1.11 -1.26 2.51 -3.00 0.00 -1.26 -1.24 105.19 99.82 1d2p n GLY 898 Ca -0.02 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 1d2p n GLY 898 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d2p n ASN 899 N -1.30 -0.73 -4.73 1.61 5.15 0.64 -3.89 115.26 112.01 1d2p n ASN 899 Ca 0.11 -3.22 -0.41 0.00 -0.60 0.00 0.00 54.58 50.45 1d2p n ASN 899 Cb 0.30 0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 40.14 1d2p n ASN 899 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1d2p s LEU 900 N -2.50 4.44 -0.12 1.20 1.43 -0.10 -4.65 118.68 118.38 1d2p s LEU 900 Ca 0.29 2.13 -0.00 0.00 -1.03 0.00 0.00 54.13 55.52 1d2p s LEU 900 Cb 0.34 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.99 1d2p s LEU 900 CO -0.06 -0.36 -0.08 -0.63 0.23 0.00 0.00 176.35 175.45 1d2p s ILE 901 N 0.21 1.11 -0.38 -0.59 1.01 -0.96 -2.12 121.20 119.48 1d2p s ILE 901 Ca 0.53 -0.36 -0.13 0.00 0.00 0.00 0.00 60.65 60.70 1d2p s ILE 901 Cb -0.31 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.06 1d2p s ILE 901 CO 0.34 0.37 0.24 -0.89 0.00 0.00 0.00 174.94 175.00 1d2p s THR 902 N 1.67 4.90 -0.06 2.92 2.01 -0.48 -0.67 115.64 125.94 1d2p s THR 902 Ca 0.05 -0.68 -0.01 0.00 0.31 0.00 0.00 61.69 61.36 1d2p s THR 902 Cb -0.13 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 1d2p s THR 902 CO -0.09 -0.21 -0.01 0.28 -0.69 0.00 0.00 174.62 173.90 1d2p s THR 903 N 1.62 4.20 -0.17 -0.82 -1.32 -0.01 0.25 115.64 119.38 1d2p s THR 903 Ca 0.04 -0.38 0.01 0.00 -1.21 0.00 0.00 61.69 60.15 1d2p s THR 903 Cb -0.19 -2.79 0.02 0.00 -1.51 0.00 0.00 72.50 68.03 1d2p s THR 903 CO 0.08 0.54 -0.18 0.20 -2.21 0.00 0.00 174.62 173.05 1d2p s ASN 904 N -1.08 3.05 -0.21 8.08 0.02 0.29 -1.49 114.94 123.60 1d2p s ASN 904 Ca 0.15 -0.63 -0.11 0.00 -1.02 0.00 0.00 52.86 51.24 1d2p s ASN 904 Cb -0.11 -1.39 -0.05 0.00 0.02 0.00 0.00 41.25 39.71 1d2p s ASN 904 CO 0.05 -0.02 0.19 -0.75 0.02 0.00 0.00 177.10 176.58 1d2p s LYS 905 N 1.34 4.16 -0.57 -0.60 2.20 0.47 -1.48 119.74 125.26 1d2p s LYS 905 Ca 0.04 -0.15 -0.28 0.00 -0.36 0.00 0.00 55.97 55.22 1d2p s LYS 905 Cb -0.13 -3.47 0.02 0.00 -1.51 0.00 0.00 37.83 32.74 1d2p s LYS 905 CO -0.12 0.18 1.34 -0.47 -0.36 0.00 0.00 175.35 175.92 1d2p s TYR 906 N 0.69 2.39 -2.79 4.03 5.04 -0.38 -0.87 117.35 125.45 1d2p s TYR 906 Ca 0.10 0.44 0.22 0.00 -2.44 0.00 0.00 57.07 55.40 1d2p s TYR 906 Cb -0.12 -4.44 0.18 0.00 0.35 0.00 0.00 41.96 37.92 1d2p s TYR 906 CO 0.02 -1.86 1.21 0.25 -1.34 0.00 0.00 175.55 173.83