#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6z h ALA 532 N 0.00 1.00 -0.01 4.61 0.00 -2.04 -3.27 119.26 119.55 3h6z h ALA 532 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h6z h ALA 532 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3h6z h ALA 532 CO 0.00 0.00 -0.08 -1.33 0.00 0.00 0.00 179.25 177.84 3h6z n MET 533 N -3.06 1.21 0.00 0.00 2.00 -1.26 -5.11 117.12 110.89 3h6z n MET 533 Ca 0.01 -0.75 0.00 0.00 0.00 0.00 0.00 57.70 56.95 3h6z n MET 533 Cb 0.31 -1.08 0.00 0.00 0.00 0.00 0.00 33.22 32.45 3h6z n MET 533 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3h6z n GLY 534 N 0.63 -2.74 3.66 3.03 0.00 -1.24 -5.09 105.19 103.44 3h6z n GLY 534 Ca 0.04 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.21 3h6z n GLY 534 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h6z s SER 535 N -2.15 -0.36 0.27 1.61 0.15 -1.26 -4.06 113.70 107.89 3h6z s SER 535 Ca 0.00 -0.40 -0.24 0.00 0.70 0.00 0.00 55.95 56.01 3h6z s SER 535 Cb 0.00 0.66 -0.09 0.00 -1.71 0.00 0.00 66.02 64.88 3h6z s SER 535 CO 0.00 -1.18 0.85 -0.47 1.20 0.00 0.00 173.24 173.65 3h6z s TYR 536 N -3.86 3.72 -0.12 3.44 6.14 -0.06 -4.92 117.35 121.69 3h6z s TYR 536 Ca 0.08 1.65 0.00 0.00 0.64 0.00 0.00 57.07 59.44 3h6z s TYR 536 Cb -0.03 -2.81 -0.02 0.00 0.42 0.00 0.00 41.96 39.52 3h6z s TYR 536 CO -0.01 0.30 -0.13 0.34 0.64 0.00 0.00 175.55 176.70 3h6z s ASP 537 N -1.55 4.06 0.44 4.32 -1.08 -1.26 -4.74 116.67 116.86 3h6z s ASP 537 Ca 0.46 -0.29 0.23 0.00 -0.52 0.00 0.00 52.55 52.43 3h6z s ASP 537 Cb -0.19 -1.49 0.92 0.00 -1.46 0.00 0.00 42.92 40.70 3h6z s ASP 537 CO 0.24 0.20 1.83 -0.50 0.52 0.00 0.00 175.17 177.45 3h6z h TRP 538 N 6.46 0.00 -0.85 -5.34 4.06 -2.01 -3.38 115.95 114.89 3h6z h TRP 538 Ca -0.29 0.00 0.16 0.00 2.06 0.00 0.00 58.89 60.82 3h6z h TRP 538 Cb 1.20 0.00 -0.16 0.00 -1.00 0.00 0.00 29.16 29.21 3h6z h TRP 538 CO 0.50 0.24 -0.24 -0.11 -3.56 0.00 0.00 178.44 175.27 3h6z n LEU 539 N -3.43 -0.37 0.03 -4.49 7.94 -1.26 0.38 117.00 115.80 3h6z n LEU 539 Ca -0.00 1.47 0.14 0.00 -1.11 0.00 0.00 56.01 56.51 3h6z n LEU 539 Cb 0.43 -0.42 0.60 0.00 0.53 0.00 0.00 43.42 44.56 3h6z n LEU 539 CO 0.34 -1.39 1.16 1.55 -1.11 0.00 0.00 177.39 177.94 3h6z h PRO 540 N 0.00 0.16 0.12 1.96 0.13 -2.01 -2.40 132.00 129.96 3h6z h PRO 540 Ca 0.38 -0.01 -0.30 0.00 -0.87 0.00 0.00 66.00 65.20 3h6z h PRO 540 Cb 0.59 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 3h6z h PRO 540 CO -0.87 0.10 -1.48 -0.09 -0.23 0.00 0.00 178.00 175.43 3h6z h ARG 541 N 0.16 0.25 -1.03 0.86 2.43 -0.38 -3.35 114.38 113.32 3h6z h ARG 541 Ca 0.20 -0.43 0.26 0.00 -0.81 0.00 0.00 59.98 59.20 3h6z h ARG 541 Cb 0.57 0.16 -0.11 0.00 -0.42 0.00 0.00 29.97 30.17 3h6z h ARG 541 CO -0.03 1.13 0.64 -0.07 -1.51 0.00 0.00 179.97 180.13 3h6z h LEU 542 N 0.07 0.54 -3.81 3.80 3.38 -0.82 -3.04 115.31 115.43 3h6z h LEU 542 Ca -0.22 0.11 -0.55 0.00 0.09 0.00 0.00 57.88 57.30 3h6z h LEU 542 Cb 2.01 0.02 -0.24 0.00 0.09 0.00 0.00 40.66 42.54 3h6z h LEU 542 CO 0.17 0.09 0.71 -1.54 0.09 0.00 0.00 178.44 177.96 3h6z n SER 543 N -4.74 7.11 -3.96 -0.43 3.41 -1.22 -4.86 113.62 108.94 3h6z n SER 543 Ca 0.26 -3.53 -0.18 0.00 -0.26 0.00 0.00 58.87 55.16 3h6z n SER 543 Cb 0.83 -1.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.64 3h6z n SER 543 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3h6z s LYS 544 N -3.13 0.63 -1.46 4.33 -2.85 -1.15 -5.06 119.74 111.04 3h6z s LYS 544 Ca 0.53 -0.20 -0.11 0.00 -1.00 0.00 0.00 55.97 55.18 3h6z s LYS 544 Cb 0.42 -0.62 0.03 0.00 -2.06 0.00 0.00 37.83 35.60 3h6z s LYS 544 CO -0.00 0.08 2.38 0.39 0.10 0.00 0.00 175.35 178.30 3h6z n GLU 545 N 3.24 3.35 0.00 1.78 -0.58 -1.26 -1.81 120.64 125.36 3h6z n GLU 545 Ca -0.17 -2.72 0.00 0.00 -0.42 0.00 0.00 57.16 53.85 3h6z n GLU 545 Cb 0.56 -3.04 0.00 0.00 -0.57 0.00 0.00 31.44 28.38 3h6z n GLU 545 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 3h6z n ASN 546 N 4.69 0.00 -4.58 1.62 5.15 -1.26 -5.07 115.26 115.81 3h6z n ASN 546 Ca 0.58 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 54.13 3h6z n ASN 546 Cb 0.33 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.55 3h6z n ASN 546 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 3h6z s PHE 547 N 0.00 2.70 -0.18 1.20 5.36 -0.75 -5.01 117.98 121.31 3h6z s PHE 547 Ca 0.00 0.42 -0.04 0.00 -0.96 0.00 0.00 56.93 56.35 3h6z s PHE 547 Cb 0.00 -4.40 -0.02 0.00 -0.34 0.00 0.00 43.02 38.26 3h6z s PHE 547 CO 0.00 -1.45 -0.03 1.21 -1.46 0.00 0.00 175.22 173.50 3h6z s ASN 548 N 2.77 4.73 0.01 6.13 2.47 -1.26 -4.98 114.94 124.81 3h6z s ASN 548 Ca 0.42 -0.19 0.05 0.00 0.42 0.00 0.00 52.86 53.56 3h6z s ASN 548 Cb -0.08 -1.79 -0.03 0.00 -1.45 0.00 0.00 41.25 37.90 3h6z s ASN 548 CO 0.26 0.11 -0.11 0.00 -3.72 0.00 0.00 177.10 173.64 3h6z s ALA 549 N 0.71 2.83 0.12 1.71 0.00 -1.26 0.10 121.76 125.97 3h6z s ALA 549 Ca -0.01 -1.07 -0.31 0.00 0.00 0.00 0.00 51.96 50.56 3h6z s ALA 549 Cb -0.14 -0.98 -0.09 0.00 0.00 0.00 0.00 23.12 21.91 3h6z s ALA 549 CO 0.02 0.59 1.51 0.00 0.00 0.00 0.00 175.76 177.88 3h6z s ALA 550 N -0.94 3.69 0.63 0.00 0.00 -0.44 -4.66 121.76 120.04 3h6z s ALA 550 Ca 0.16 1.23 -0.18 0.00 0.00 0.00 0.00 51.96 53.17 3h6z s ALA 550 Cb -0.11 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 3h6z s ALA 550 CO 0.06 -0.78 1.24 -2.14 0.00 0.00 0.00 175.76 174.14 3h6z s PRO 551 N 1.42 2.72 0.40 0.00 0.02 -1.26 -4.02 135.00 134.28 3h6z s PRO 551 Ca 0.68 1.90 0.17 0.00 0.02 0.00 0.00 61.00 63.78 3h6z s PRO 551 Cb -0.40 -1.89 1.07 0.00 0.02 0.00 0.00 34.50 33.30 3h6z s PRO 551 CO 0.31 -1.42 1.79 0.28 -0.33 0.00 0.00 177.00 177.63 3h6z h VAL 552 N 0.62 0.58 -0.34 3.83 2.07 -1.94 -0.65 116.25 120.42 3h6z h VAL 552 Ca -0.50 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 66.97 3h6z h VAL 552 Cb 1.31 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3h6z h VAL 552 CO 0.54 0.08 0.65 0.74 0.02 0.00 0.00 177.57 179.59 3h6z h THR 553 N 0.42 0.13 0.00 2.57 2.02 -1.90 -1.77 112.91 114.37 3h6z h THR 553 Ca 0.56 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.74 3h6z h THR 553 Cb 1.38 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 3h6z h THR 553 CO -0.27 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.62 3h6z s PHE 555 N -3.14 3.40 0.66 0.00 0.40 -0.67 -4.90 117.98 113.74 3h6z s PHE 555 Ca 0.09 -2.76 0.44 0.00 -0.60 0.00 0.00 56.93 54.10 3h6z s PHE 555 Cb 0.10 -3.14 2.40 0.00 0.51 0.00 0.00 43.02 42.89 3h6z s PHE 555 CO 0.61 -0.84 2.37 -1.00 0.70 0.00 0.00 175.22 177.06 3h6z h PRO 556 N 7.07 0.00 0.00 0.24 0.13 -1.84 0.01 132.00 137.61 3h6z h PRO 556 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 3h6z h PRO 556 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 3h6z h PRO 556 CO 0.70 0.00 -1.07 -2.39 -0.23 0.00 0.00 178.00 175.01 3h6z n HIS 557 N -3.14 0.44 -1.79 1.56 1.44 -1.26 -4.90 115.22 107.57 3h6z n HIS 557 Ca -0.03 0.13 -0.40 0.00 -2.01 0.00 0.00 57.72 55.41 3h6z n HIS 557 Cb 0.07 -0.59 0.02 0.00 0.12 0.00 0.00 29.99 29.61 3h6z n HIS 557 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3h6z s ALA 558 N -3.26 3.25 0.30 1.59 0.00 -0.01 -4.94 121.76 118.69 3h6z s ALA 558 Ca 0.02 1.48 -0.29 0.00 0.00 0.00 0.00 51.96 53.17 3h6z s ALA 558 Cb 0.13 -3.59 -0.10 0.00 0.00 0.00 0.00 23.12 19.56 3h6z s ALA 558 CO 0.80 -1.21 1.27 -2.14 0.00 0.00 0.00 175.76 174.49 3h6z s PRO 559 N -2.45 4.41 -0.10 0.00 0.02 -1.26 -2.45 135.00 133.16 3h6z s PRO 559 Ca 0.61 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.75 3h6z s PRO 559 Cb -0.44 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 30.97 3h6z s PRO 559 CO 0.57 -0.13 0.00 0.41 -0.33 0.00 0.00 177.00 177.52 3h6z n GLY 560 N 1.10 0.47 0.13 0.52 0.00 -1.26 -4.94 105.19 101.21 3h6z n GLY 560 Ca 0.01 -0.19 -0.07 0.00 0.00 0.00 0.00 46.02 45.77 3h6z n GLY 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6z h GLU 562 N 0.03 -0.47 0.00 0.00 5.08 -1.92 -3.16 114.58 114.14 3h6z h GLU 562 Ca 0.14 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 3h6z h GLU 562 Cb 0.20 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 3h6z h GLU 562 CO -0.27 -0.18 -0.04 -0.24 -1.00 0.00 0.00 179.01 177.28 3h6z h VAL 563 N -0.75 0.31 -0.73 3.13 3.04 -1.96 -3.20 116.25 116.09 3h6z h VAL 563 Ca -0.05 -0.23 -0.05 0.00 -1.01 0.00 0.00 66.70 65.36 3h6z h VAL 563 Cb 0.51 1.17 -0.03 0.00 -2.01 0.00 0.00 31.29 30.93 3h6z h VAL 563 CO 0.08 0.04 0.26 -0.25 -1.01 0.00 0.00 177.57 176.69 3h6z h TRP 564 N 0.00 1.14 0.00 3.17 2.91 -1.15 -2.39 115.95 119.63 3h6z h TRP 564 Ca -0.00 -0.10 0.00 0.00 1.13 0.00 0.00 58.89 59.92 3h6z h TRP 564 Cb 0.17 -0.34 0.00 0.00 -0.51 0.00 0.00 29.16 28.48 3h6z h TRP 564 CO 0.00 0.88 0.00 -0.40 -1.03 0.00 0.00 178.44 177.89 3h6z n ASP 565 N -4.27 0.00 0.08 2.65 5.75 -1.21 -1.00 116.55 118.55 3h6z n ASP 565 Ca 0.06 -0.22 0.13 0.00 -0.01 0.00 0.00 54.79 54.76 3h6z n ASP 565 Cb 0.20 -0.20 0.45 0.00 -1.03 0.00 0.00 41.12 40.55 3h6z n ASP 565 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3h6z n ASN 566 N -1.20 0.62 -4.80 -1.12 4.13 -0.90 -4.86 115.26 107.14 3h6z n ASN 566 Ca 0.12 0.55 -0.34 0.00 1.68 0.00 0.00 54.58 56.59 3h6z n ASN 566 Cb 0.14 -0.71 -0.05 0.00 -1.54 0.00 0.00 39.78 37.62 3h6z n ASN 566 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3h6z s LEU 567 N -4.17 3.97 0.02 3.41 1.43 -0.17 -4.75 118.68 118.43 3h6z s LEU 567 Ca 0.11 1.85 0.02 0.00 -1.03 0.00 0.00 54.13 55.08 3h6z s LEU 567 Cb 0.14 -4.44 -0.02 0.00 0.03 0.00 0.00 46.19 41.90 3h6z s LEU 567 CO 0.58 -0.52 -0.06 -0.83 0.23 0.00 0.00 176.35 175.76 3h6z s GLY 568 N -1.95 0.37 0.00 -3.19 0.00 -1.26 -5.05 107.32 96.24 3h6z s GLY 568 Ca 0.62 -0.56 -0.05 0.00 0.00 0.00 0.00 44.72 44.73 3h6z s GLY 568 CO 0.19 -0.59 3.14 1.55 0.00 0.00 0.00 173.10 177.39 3h6z n VAL 569 N 1.93 2.58 -1.64 1.40 3.14 -1.26 -2.84 118.33 121.64 3h6z n VAL 569 Ca -0.20 -1.25 0.00 0.00 -2.96 0.00 0.00 64.34 59.93 3h6z n VAL 569 Cb 0.56 -1.90 0.00 0.00 -1.06 0.00 0.00 33.84 31.44 3h6z n VAL 569 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3h6z n GLY 570 N 2.47 0.86 3.77 7.55 0.00 -1.11 -4.73 105.19 114.01 3h6z n GLY 570 Ca 0.35 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.99 3h6z n GLY 570 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h6z s MET 571 N 0.00 3.84 0.20 1.61 1.00 -1.13 -4.65 119.30 120.17 3h6z s MET 571 Ca 0.00 1.96 0.01 0.00 0.00 0.00 0.00 55.69 57.66 3h6z s MET 571 Cb 0.00 -2.57 -0.04 0.00 0.00 0.00 0.00 34.83 32.22 3h6z s MET 571 CO 0.00 -0.54 0.37 0.15 0.00 0.00 0.00 175.02 175.00 3h6z s LYS 572 N -2.47 3.48 -0.12 2.03 1.02 0.28 -0.80 119.74 123.17 3h6z s LYS 572 Ca 0.61 -0.46 -0.29 0.00 0.02 0.00 0.00 55.97 55.84 3h6z s LYS 572 Cb -0.33 -2.87 0.08 0.00 -0.52 0.00 0.00 37.83 34.18 3h6z s LYS 572 CO 0.41 0.42 0.72 0.08 -0.92 0.00 0.00 175.35 176.07 3h6z s VAL 573 N -1.87 0.00 -0.22 3.17 1.01 0.93 -4.25 120.40 119.16 3h6z s VAL 573 Ca 0.37 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 62.21 3h6z s VAL 573 Cb -0.11 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 3h6z s VAL 573 CO 0.29 0.00 0.32 -1.61 0.00 0.00 0.00 175.10 174.10 3h6z s GLU 574 N -0.76 4.12 0.31 2.72 2.02 -0.17 0.93 118.70 127.88 3h6z s GLU 574 Ca -0.07 0.03 0.02 0.00 0.02 0.00 0.00 54.97 54.97 3h6z s GLU 574 Cb -0.01 -3.56 -0.01 0.00 0.10 0.00 0.00 34.13 30.65 3h6z s GLU 574 CO 0.07 -0.05 0.08 0.28 0.02 0.00 0.00 175.26 175.66 3h6z n VAL 575 N 4.45 0.00 -0.19 2.63 0.31 0.78 -0.89 118.33 125.43 3h6z n VAL 575 Ca -0.10 -1.72 0.00 0.00 -0.01 0.00 0.00 64.34 62.50 3h6z n VAL 575 Cb 0.51 0.55 0.00 0.00 -0.91 0.00 0.00 33.84 33.99 3h6z n VAL 575 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3h6z n GLU 576 N -0.73 0.00 0.00 5.55 1.02 -1.24 -1.97 120.64 123.27 3h6z n GLU 576 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 3h6z n GLU 576 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.87 3h6z n GLU 576 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3h6z n THR 593 N 0.00 0.00 -4.06 2.62 -2.24 -1.26 -4.73 114.28 104.61 3h6z n THR 593 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3h6z n THR 593 Cb 0.00 -0.53 -0.11 0.00 -2.10 0.00 0.00 70.33 67.59 3h6z n THR 593 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3h6z s SER 594 N -1.95 0.61 0.32 3.42 1.04 -1.26 -4.53 113.70 111.35 3h6z s SER 594 Ca 0.00 -0.74 0.05 0.00 0.48 0.00 0.00 55.95 55.74 3h6z s SER 594 Cb 0.00 0.11 -0.06 0.00 0.10 0.00 0.00 66.02 66.17 3h6z s SER 594 CO 0.00 -0.39 0.02 -0.36 0.98 0.00 0.00 173.24 173.49 3h6z s PHE 595 N -2.51 2.01 0.14 5.02 0.40 0.32 -4.92 117.98 118.44 3h6z s PHE 595 Ca -0.03 -0.85 -0.13 0.00 -0.60 0.00 0.00 56.93 55.31 3h6z s PHE 595 Cb -0.02 -1.29 0.02 0.00 0.51 0.00 0.00 43.02 42.24 3h6z s PHE 595 CO -0.04 0.13 0.35 -0.46 0.70 0.00 0.00 175.22 175.91 3h6z s TRP 596 N -3.16 0.03 0.13 0.36 -0.11 -0.83 -1.13 118.94 114.23 3h6z s TRP 596 Ca 0.34 -0.38 -0.15 0.00 1.22 0.00 0.00 56.10 57.13 3h6z s TRP 596 Cb 0.08 0.15 -0.07 0.00 -1.50 0.00 0.00 33.47 32.12 3h6z s TRP 596 CO 0.15 -0.72 0.53 0.14 -4.62 0.00 0.00 176.95 172.43 3h6z s VAL 597 N -3.87 4.87 0.07 5.86 -7.23 -1.26 -0.16 120.40 118.68 3h6z s VAL 597 Ca 0.08 0.85 -0.00 0.00 -1.81 0.00 0.00 61.98 61.10 3h6z s VAL 597 Cb 0.02 -3.75 -0.04 0.00 0.56 0.00 0.00 36.38 33.17 3h6z s VAL 597 CO -0.07 0.30 -0.04 0.00 -0.31 0.00 0.00 175.10 174.98 3h6z s ALA 598 N -1.40 0.68 -0.10 1.32 0.00 0.27 -1.99 121.76 120.53 3h6z s ALA 598 Ca 0.36 -1.26 -0.02 0.00 0.00 0.00 0.00 51.96 51.03 3h6z s ALA 598 Cb -0.16 0.24 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 3h6z s ALA 598 CO 0.19 -0.32 -0.01 0.99 0.00 0.00 0.00 175.76 176.61 3h6z s THR 599 N -3.82 4.22 -0.54 0.00 2.01 0.10 -0.05 115.64 117.57 3h6z s THR 599 Ca 0.09 -0.27 -0.28 0.00 0.31 0.00 0.00 61.69 61.53 3h6z s THR 599 Cb 0.07 -2.79 0.03 0.00 0.01 0.00 0.00 72.50 69.81 3h6z s THR 599 CO -0.08 0.58 1.22 -0.63 -0.69 0.00 0.00 174.62 175.01 3h6z s ILE 600 N -0.57 4.03 -0.33 1.82 1.01 0.02 -1.10 121.20 126.07 3h6z s ILE 600 Ca 0.09 0.97 0.22 0.00 0.00 0.00 0.00 60.65 61.93 3h6z s ILE 600 Cb -0.12 -4.63 0.16 0.00 0.01 0.00 0.00 42.46 37.89 3h6z s ILE 600 CO 0.02 -1.20 1.32 -0.07 0.00 0.00 0.00 174.94 175.02 3h6z h LEU 601 N 11.89 0.00 -7.00 2.97 3.38 -0.94 -2.93 115.31 122.68 3h6z h LEU 601 Ca -0.25 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.78 3h6z h LEU 601 Cb 1.06 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.57 3h6z h LEU 601 CO 1.16 0.03 0.27 -0.70 0.09 0.00 0.00 178.44 179.30 3h6z s GLU 602 N -3.26 0.56 -0.22 1.13 2.12 -1.25 -4.90 118.70 112.88 3h6z s GLU 602 Ca 0.03 0.84 0.02 0.00 0.36 0.00 0.00 54.97 56.22 3h6z s GLU 602 Cb 0.07 0.18 0.04 0.00 0.26 0.00 0.00 34.13 34.68 3h6z s GLU 602 CO 0.73 -0.10 -0.16 0.42 -0.54 0.00 0.00 175.26 175.62 3h6z s ILE 603 N 1.02 2.11 -0.25 -3.70 1.01 -1.26 -0.24 121.20 119.88 3h6z s ILE 603 Ca -0.05 -1.26 0.02 0.00 0.00 0.00 0.00 60.65 59.36 3h6z s ILE 603 Cb -0.05 -2.05 0.06 0.00 0.01 0.00 0.00 42.46 40.44 3h6z s ILE 603 CO -0.12 0.28 -0.08 -0.54 0.00 0.00 0.00 174.94 174.48 3h6z s LYS 604 N 1.20 1.90 7.99 2.79 1.02 -0.20 -5.00 119.74 129.44 3h6z s LYS 604 Ca -0.01 -1.18 0.00 0.00 0.02 0.00 0.00 55.97 54.80 3h6z s LYS 604 Cb -0.16 -2.74 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 3h6z s LYS 604 CO -0.09 -0.60 0.00 0.41 -0.92 0.00 0.00 175.35 174.15 3h6z n GLY 605 N 4.55 4.10 0.21 -3.33 0.00 -1.26 -0.66 105.19 108.81 3h6z n GLY 605 Ca -0.12 0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.08 3h6z n GLY 605 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3h6z n TYR 606 N 13.99 0.00 -3.16 1.61 0.53 0.06 -4.45 117.16 125.74 3h6z n TYR 606 Ca 0.00 0.00 -0.38 0.00 -1.02 0.00 0.00 57.90 56.50 3h6z n TYR 606 Cb 0.00 -0.13 -0.06 0.00 -1.03 0.00 0.00 39.34 38.12 3h6z n TYR 606 CO 0.00 0.00 0.00 0.15 -1.02 0.00 0.00 176.86 175.99 3h6z s LYS 607 N -2.61 4.31 -0.04 -0.72 -0.14 0.17 -1.56 119.74 119.15 3h6z s LYS 607 Ca 0.21 0.87 0.03 0.00 -1.36 0.00 0.00 55.97 55.73 3h6z s LYS 607 Cb 0.19 -3.19 0.00 0.00 -1.68 0.00 0.00 37.83 33.15 3h6z s LYS 607 CO 0.57 0.58 -0.13 0.00 -0.76 0.00 0.00 175.35 175.61 3h6z s ALA 608 N -1.19 1.24 -0.42 5.17 0.00 0.12 -1.04 121.76 125.63 3h6z s ALA 608 Ca 0.33 -0.51 -0.24 0.00 0.00 0.00 0.00 51.96 51.54 3h6z s ALA 608 Cb -0.20 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.49 3h6z s ALA 608 CO 0.22 0.20 0.82 -1.17 0.00 0.00 0.00 175.76 175.83 3h6z s LEU 609 N 0.19 4.15 0.06 0.00 2.96 0.66 -0.84 118.68 125.86 3h6z s LEU 609 Ca -0.05 0.11 -0.11 0.00 -0.22 0.00 0.00 54.13 53.86 3h6z s LEU 609 Cb -0.11 -3.05 -0.06 0.00 0.50 0.00 0.00 46.19 43.47 3h6z s LEU 609 CO 0.02 -0.89 0.40 -0.04 -1.32 0.00 0.00 176.35 174.52 3h6z s MET 610 N 3.35 3.80 -0.07 1.98 -1.94 0.15 -0.30 119.30 126.27 3h6z s MET 610 Ca 0.32 0.24 -0.01 0.00 -1.71 0.00 0.00 55.69 54.53 3h6z s MET 610 Cb -0.12 -3.05 0.03 0.00 2.01 0.00 0.00 34.83 33.70 3h6z s MET 610 CO 0.22 0.59 0.00 0.45 -0.01 0.00 0.00 175.02 176.27 3h6z s SER 611 N -1.58 1.54 0.55 3.03 0.15 -0.26 -1.56 113.70 115.57 3h6z s SER 611 Ca 0.31 -0.07 -0.19 0.00 0.70 0.00 0.00 55.95 56.69 3h6z s SER 611 Cb -0.15 -0.42 -0.05 0.00 -1.71 0.00 0.00 66.02 63.69 3h6z s SER 611 CO 0.17 -0.19 1.15 -0.31 1.20 0.00 0.00 173.24 175.25 3h6z s TYR 612 N 1.96 2.60 0.27 3.44 4.12 -1.26 0.01 117.35 128.49 3h6z s TYR 612 Ca 0.05 1.54 -0.29 0.00 0.02 0.00 0.00 57.07 58.38 3h6z s TYR 612 Cb -0.12 -3.34 -0.10 0.00 -1.52 0.00 0.00 41.96 36.88 3h6z s TYR 612 CO -0.05 -1.74 1.29 -1.21 0.02 0.00 0.00 175.55 173.86 3h6z s GLU 613 N -3.29 4.40 0.00 -0.62 0.41 -0.84 -3.58 118.70 115.18 3h6z s GLU 613 Ca 0.74 2.11 0.00 0.00 -0.41 0.00 0.00 54.97 57.41 3h6z s GLU 613 Cb -0.26 -3.13 0.00 0.00 -1.78 0.00 0.00 34.13 28.96 3h6z s GLU 613 CO 0.28 -0.18 0.00 0.41 -0.49 0.00 0.00 175.26 175.29 3h6z n GLY 614 N 1.54 0.57 3.48 -1.39 0.00 -1.26 -5.00 105.19 103.13 3h6z n GLY 614 Ca 0.03 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 3h6z n GLY 614 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h6z s PHE 615 N -2.00 3.11 0.35 1.61 0.40 -1.23 -4.94 117.98 115.28 3h6z s PHE 615 Ca 0.00 -0.30 0.04 0.00 -0.60 0.00 0.00 56.93 56.07 3h6z s PHE 615 Cb 0.00 -2.23 0.65 0.00 0.51 0.00 0.00 43.02 41.95 3h6z s PHE 615 CO 0.00 -0.27 1.93 -0.44 0.70 0.00 0.00 175.22 177.13 3h6z h ASP 616 N 8.05 0.52 -2.55 1.36 5.19 -1.96 -3.46 116.42 123.58 3h6z h ASP 616 Ca -0.38 -0.07 -0.54 0.00 -0.62 0.00 0.00 57.03 55.42 3h6z h ASP 616 Cb 1.18 -0.14 -0.13 0.00 0.18 0.00 0.00 39.33 40.42 3h6z h ASP 616 CO 0.59 0.52 -0.61 0.42 -3.12 0.00 0.00 179.24 177.03 3h6z s THR 617 N -5.17 1.59 -2.00 0.35 -4.23 -1.26 -5.02 115.64 99.90 3h6z s THR 617 Ca -0.08 -2.02 0.27 0.00 -1.18 0.00 0.00 61.69 58.68 3h6z s THR 617 Cb 0.16 -2.84 0.77 0.00 1.34 0.00 0.00 72.50 71.93 3h6z s THR 617 CO 0.76 -0.04 1.99 -0.90 -0.54 0.00 0.00 174.62 175.89 3h6z n ASP 618 N -0.79 0.00 -0.32 3.99 5.75 -1.26 -4.27 116.55 119.65 3h6z n ASP 618 Ca -0.04 -0.97 0.20 0.00 -0.01 0.00 0.00 54.79 53.98 3h6z n ASP 618 Cb 0.66 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 41.15 3h6z n ASP 618 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 3h6z h SER 619 N 0.00 0.00 -0.42 -1.12 0.87 -1.97 -1.58 113.55 109.34 3h6z h SER 619 Ca 0.00 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 3h6z h SER 619 Cb 0.00 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 3h6z h SER 619 CO 0.00 -0.30 0.00 1.41 -0.53 0.00 0.00 176.83 177.41 3h6z n HIS 620 N -5.30 0.87 -1.84 2.24 8.25 -1.26 -4.99 115.22 113.19 3h6z n HIS 620 Ca 0.28 -0.63 -0.40 0.00 -0.26 0.00 0.00 57.72 56.71 3h6z n HIS 620 Cb 0.92 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.87 3h6z n HIS 620 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3h6z s ASP 621 N -1.23 6.21 0.00 0.41 1.01 -0.60 -4.78 116.67 117.69 3h6z s ASP 621 Ca 0.36 2.95 -0.02 0.00 0.71 0.00 0.00 52.55 56.55 3h6z s ASP 621 Cb 0.24 -2.66 -0.01 0.00 1.01 0.00 0.00 42.92 41.50 3h6z s ASP 621 CO 0.17 -0.95 0.04 0.72 0.21 0.00 0.00 175.17 175.36 3h6z s PHE 622 N -1.16 0.09 0.08 4.23 -0.12 -0.60 -4.96 117.98 115.54 3h6z s PHE 622 Ca 0.56 -0.19 -0.16 0.00 -0.05 0.00 0.00 56.93 57.08 3h6z s PHE 622 Cb -0.44 -0.08 -0.06 0.00 -0.63 0.00 0.00 43.02 41.80 3h6z s PHE 622 CO 0.59 -0.16 0.52 -1.58 -0.05 0.00 0.00 175.22 174.54 3h6z s TRP 623 N -0.92 3.72 0.13 3.49 0.52 -1.26 0.32 118.94 124.94 3h6z s TRP 623 Ca -0.10 1.12 0.06 0.00 0.02 0.00 0.00 56.10 57.20 3h6z s TRP 623 Cb -0.06 -2.40 -0.04 0.00 -1.15 0.00 0.00 33.47 29.83 3h6z s TRP 623 CO -0.00 0.55 -0.13 0.14 0.02 0.00 0.00 176.95 177.53 3h6z s VAL 624 N -1.23 1.28 -1.08 4.03 -7.23 -0.02 -4.94 120.40 111.21 3h6z s VAL 624 Ca 0.31 -1.78 -0.21 0.00 -1.81 0.00 0.00 61.98 58.49 3h6z s VAL 624 Cb -0.17 -1.58 0.07 0.00 0.56 0.00 0.00 36.38 35.26 3h6z s VAL 624 CO 0.18 -0.48 1.48 0.20 -0.31 0.00 0.00 175.10 176.16 3h6z s ASN 625 N -2.59 6.62 0.39 4.85 -0.87 -1.26 -0.70 114.94 121.38 3h6z s ASN 625 Ca 0.10 -1.83 0.24 0.00 -1.57 0.00 0.00 52.86 49.81 3h6z s ASN 625 Cb -0.03 -2.54 1.37 0.00 -0.02 0.00 0.00 41.25 40.02 3h6z s ASN 625 CO 0.03 -1.34 1.59 0.25 -2.57 0.00 0.00 177.10 175.06 3h6z h LEU 626 N 12.31 0.30 -1.25 0.60 6.46 -1.62 0.24 115.31 132.35 3h6z h LEU 626 Ca 0.26 0.21 0.00 0.00 -0.12 0.00 0.00 57.88 58.23 3h6z h LEU 626 Cb 0.97 0.21 0.00 0.00 -0.73 0.00 0.00 40.66 41.11 3h6z h LEU 626 CO 1.39 -0.33 0.00 0.00 -0.62 0.00 0.00 178.44 178.88 3h6z n ASN 628 N 0.47 0.00 -4.41 0.00 2.04 0.52 -5.02 115.26 108.85 3h6z n ASN 628 Ca 0.15 -1.01 -0.29 0.00 -0.44 0.00 0.00 54.58 52.98 3h6z n ASN 628 Cb 0.33 -0.00 0.15 0.00 -2.53 0.00 0.00 39.78 37.73 3h6z n ASN 628 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3h6z s ALA 629 N 0.00 2.46 -1.54 -2.53 0.00 0.51 -4.92 121.76 115.74 3h6z s ALA 629 Ca 0.00 -1.05 -0.10 0.00 0.00 0.00 0.00 51.96 50.81 3h6z s ALA 629 Cb 0.00 -2.79 -0.02 0.00 0.00 0.00 0.00 23.12 20.31 3h6z s ALA 629 CO 0.00 -2.13 2.69 0.39 0.00 0.00 0.00 175.76 176.71 3h6z n GLU 630 N -3.56 3.69 -4.98 0.00 -0.58 -1.26 -4.89 120.64 109.06 3h6z n GLU 630 Ca 0.13 -2.53 -0.32 0.00 -0.42 0.00 0.00 57.16 54.01 3h6z n GLU 630 Cb 0.60 -2.87 -0.14 0.00 -0.57 0.00 0.00 31.44 28.46 3h6z n GLU 630 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3h6z s VAL 631 N 1.75 2.79 0.11 2.62 1.01 -1.26 -3.72 120.40 123.70 3h6z s VAL 631 Ca 0.62 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.80 3h6z s VAL 631 Cb 0.17 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 3h6z s VAL 631 CO -0.07 0.57 -0.04 -1.00 0.00 0.00 0.00 175.10 174.57 3h6z s HIS 632 N -0.43 0.89 0.32 5.22 3.76 -0.07 -5.00 115.29 119.98 3h6z s HIS 632 Ca 0.05 -0.98 -0.27 0.00 -0.15 0.00 0.00 55.06 53.70 3h6z s HIS 632 Cb -0.12 -0.52 -0.09 0.00 1.11 0.00 0.00 32.58 32.95 3h6z s HIS 632 CO 0.02 -0.23 1.04 -1.54 -0.85 0.00 0.00 174.74 173.18 3h6z s SER 633 N -3.05 7.17 -0.19 1.40 1.04 -1.26 -0.99 113.70 117.82 3h6z s SER 633 Ca 0.14 2.09 -0.41 0.00 0.48 0.00 0.00 55.95 58.26 3h6z s SER 633 Cb 0.06 -2.61 -0.17 0.00 0.10 0.00 0.00 66.02 63.40 3h6z s SER 633 CO -0.04 -0.20 1.53 0.52 0.98 0.00 0.00 173.24 176.04 3h6z n VAL 634 N 0.76 0.13 0.00 5.02 0.31 -1.26 -1.35 118.33 121.94 3h6z n VAL 634 Ca 0.01 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 3h6z n VAL 634 Cb 0.47 -0.83 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 3h6z n VAL 634 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h6z n GLY 635 N 3.40 1.31 0.12 2.92 0.00 -1.26 -4.99 105.19 106.68 3h6z n GLY 635 Ca 0.24 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 3h6z n GLY 635 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3h6z h TRP 636 N 0.00 0.29 -0.23 1.61 7.01 -1.58 -2.62 115.95 120.44 3h6z h TRP 636 Ca 0.00 -0.02 0.01 0.00 2.11 0.00 0.00 58.89 60.99 3h6z h TRP 636 Cb 0.00 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 3h6z h TRP 636 CO 0.00 0.34 0.14 0.00 -2.79 0.00 0.00 178.44 176.13 3h6z h ALA 638 N 1.10 1.46 0.00 0.00 0.00 -1.80 0.38 119.26 120.39 3h6z h ALA 638 Ca 0.09 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3h6z h ALA 638 Cb -0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3h6z h ALA 638 CO -0.03 0.48 -0.35 0.00 0.00 0.00 0.00 179.25 179.35 3h6z h THR 639 N 1.05 0.76 0.00 0.00 1.03 -1.22 -3.27 112.91 111.26 3h6z h THR 639 Ca 0.31 -1.54 0.00 0.00 -0.01 0.00 0.00 66.41 65.17 3h6z h THR 639 Cb -0.05 1.98 0.00 0.00 -1.07 0.00 0.00 68.15 69.01 3h6z h THR 639 CO -0.08 0.34 -0.85 0.54 -0.01 0.00 0.00 175.52 175.46 3h6z n ARG 640 N -3.42 1.95 -1.75 0.00 1.74 -0.83 -5.00 116.66 109.35 3h6z n ARG 640 Ca 0.00 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 3h6z n ARG 640 Cb 0.53 -1.21 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 3h6z n ARG 640 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h6z n GLY 641 N 1.40 0.45 3.84 -0.13 0.00 0.12 -5.06 105.19 105.81 3h6z n GLY 641 Ca 0.02 -0.88 -0.35 0.00 0.00 0.00 0.00 46.02 44.81 3h6z n GLY 641 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6z s LYS 642 N -3.53 3.97 0.11 1.61 -0.14 -0.58 -5.03 119.74 116.15 3h6z s LYS 642 Ca 0.00 0.48 -0.30 0.00 -1.36 0.00 0.00 55.97 54.79 3h6z s LYS 642 Cb 0.00 -2.95 -0.06 0.00 -1.68 0.00 0.00 37.83 33.14 3h6z s LYS 642 CO 0.00 0.49 1.03 -2.14 -0.76 0.00 0.00 175.35 173.97 3h6z s PRO 643 N -1.92 4.62 -0.51 -1.68 0.02 -1.26 -4.60 135.00 129.67 3h6z s PRO 643 Ca 0.37 1.55 -0.16 0.00 0.02 0.00 0.00 61.00 62.78 3h6z s PRO 643 Cb -0.15 -3.36 0.11 0.00 0.02 0.00 0.00 34.50 31.12 3h6z s PRO 643 CO 0.19 0.09 0.46 -0.51 -0.33 0.00 0.00 177.00 176.90 3h6z s LEU 644 N 0.16 5.98 -0.14 -5.54 1.43 -1.26 -0.52 118.68 118.79 3h6z s LEU 644 Ca 0.50 -1.64 0.01 0.00 -1.03 0.00 0.00 54.13 51.96 3h6z s LEU 644 Cb -0.25 -2.19 -0.00 0.00 0.03 0.00 0.00 46.19 43.77 3h6z s LEU 644 CO 0.31 -0.78 -0.16 -0.63 0.23 0.00 0.00 176.35 175.31 3h6z s ILE 645 N 1.60 2.63 0.30 -0.59 1.01 -0.28 -4.95 121.20 120.92 3h6z s ILE 645 Ca 0.03 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.59 3h6z s ILE 645 Cb -0.28 -2.10 -0.12 0.00 0.01 0.00 0.00 42.46 39.98 3h6z s ILE 645 CO 0.04 0.52 1.59 -0.81 0.00 0.00 0.00 174.94 176.28 3h6z n PRO 646 N 3.89 2.69 -1.67 2.79 -0.04 -1.26 -4.62 135.00 136.78 3h6z n PRO 646 Ca -0.19 0.96 -0.39 0.00 -0.04 0.00 0.00 63.50 63.84 3h6z n PRO 646 Cb 0.52 -2.74 0.04 0.00 -0.04 0.00 0.00 33.50 31.29 3h6z n PRO 646 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3h6z n PRO 647 N 2.10 1.31 -0.35 0.54 -0.02 -1.26 -4.68 135.00 132.63 3h6z n PRO 647 Ca 0.08 0.49 0.24 0.00 -2.02 0.00 0.00 63.50 62.29 3h6z n PRO 647 Cb 0.37 -2.32 0.49 0.00 -0.02 0.00 0.00 33.50 32.02 3h6z n PRO 647 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h6z h ARG 648 N 1.07 0.36 0.00 -0.52 3.08 -2.02 -1.52 114.38 114.83 3h6z h ARG 648 Ca -0.49 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.53 3h6z h ARG 648 Cb 1.33 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.30 3h6z h ARG 648 CO 0.54 0.24 -0.05 1.15 -1.07 0.00 0.00 179.97 180.79 3h6z h THR 649 N 0.38 0.42 0.00 2.04 2.02 -2.03 -3.11 112.91 112.63 3h6z h THR 649 Ca 0.68 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.61 3h6z h THR 649 Cb 1.64 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 3h6z h THR 649 CO -0.45 0.05 0.00 2.30 0.37 0.00 0.00 175.52 177.79 3h6z n ILE 650 N -3.59 0.41 -0.32 3.11 -5.35 -0.58 -4.77 119.36 108.27 3h6z n ILE 650 Ca -0.02 -0.70 0.05 0.00 -0.27 0.00 0.00 62.75 61.81 3h6z n ILE 650 Cb 0.16 0.80 0.13 0.00 -1.74 0.00 0.00 39.64 38.99 3h6z n ILE 650 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 3h6z h GLU 651 N 0.00 0.00 -0.34 6.28 5.08 -1.47 -2.01 114.58 122.12 3h6z h GLU 651 Ca 0.00 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.46 3h6z h GLU 651 Cb 0.21 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3h6z h GLU 651 CO 0.00 0.00 0.33 1.12 -1.00 0.00 0.00 179.01 179.46 3h6z h HIS 652 N 0.00 0.00 -0.87 4.33 2.07 -1.86 -3.09 115.15 115.73 3h6z h HIS 652 Ca 0.44 0.00 0.16 0.00 -2.85 0.00 0.00 60.37 58.12 3h6z h HIS 652 Cb 0.68 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 30.56 3h6z h HIS 652 CO -0.69 0.00 0.45 0.87 -3.07 0.00 0.00 177.93 175.49 3h6z h LYS 653 N 0.00 0.60 -3.54 5.12 1.79 -1.74 -3.43 116.57 115.37 3h6z h LYS 653 Ca 0.16 -0.04 -0.13 0.00 -2.18 0.00 0.00 60.65 58.46 3h6z h LYS 653 Cb 0.81 -0.14 -0.19 0.00 -1.58 0.00 0.00 32.23 31.13 3h6z h LYS 653 CO -0.00 0.40 -0.46 0.71 -1.08 0.00 0.00 179.45 179.02 3h6z s TYR 654 N -5.95 0.06 0.04 -1.35 1.51 -1.17 -5.03 117.35 105.45 3h6z s TYR 654 Ca -0.12 -0.20 -0.17 0.00 -1.01 0.00 0.00 57.07 55.56 3h6z s TYR 654 Cb 0.22 -0.05 -0.22 0.00 -0.11 0.00 0.00 41.96 41.80 3h6z s TYR 654 CO 0.78 -0.34 1.16 0.87 -1.11 0.00 0.00 175.55 176.91 3h6z h LYS 655 N 3.96 0.53 -5.89 -0.62 1.79 -1.85 -3.46 116.57 111.03 3h6z h LYS 655 Ca -0.31 -0.54 -0.60 0.00 -2.18 0.00 0.00 60.65 57.02 3h6z h LYS 655 Cb 1.19 0.14 -0.30 0.00 -1.58 0.00 0.00 32.23 31.68 3h6z h LYS 655 CO 0.44 1.17 -0.85 0.34 -1.08 0.00 0.00 179.45 179.46 3h6z s ASP 656 N -6.91 2.40 0.00 0.86 2.15 -1.26 -5.06 116.67 108.85 3h6z s ASP 656 Ca -0.12 -0.37 0.12 0.00 0.43 0.00 0.00 52.55 52.60 3h6z s ASP 656 Cb 0.05 -0.35 0.03 0.00 -0.30 0.00 0.00 42.92 42.36 3h6z s ASP 656 CO 0.86 0.24 0.76 0.79 -0.17 0.00 0.00 175.17 177.64 3h6z n TRP 657 N 2.68 0.00 -0.21 -5.34 7.02 -1.26 -4.62 117.44 115.71 3h6z n TRP 657 Ca -0.16 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.27 3h6z n TRP 657 Cb 0.53 0.00 0.04 0.00 -2.42 0.00 0.00 31.31 29.46 3h6z n TRP 657 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 3h6z h LYS 658 N 1.68 0.77 0.08 -0.99 3.64 -1.98 -2.51 116.57 117.26 3h6z h LYS 658 Ca 0.00 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3h6z h LYS 658 Cb 0.43 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 3h6z h LYS 658 CO 0.00 0.51 -0.04 -0.44 -2.27 0.00 0.00 179.45 177.21 3h6z h ASP 659 N 0.79 -0.09 -0.30 4.20 5.19 -1.99 0.78 116.42 125.00 3h6z h ASP 659 Ca 0.23 -0.11 0.07 0.00 -0.62 0.00 0.00 57.03 56.59 3h6z h ASP 659 Cb -0.07 0.02 -0.07 0.00 0.18 0.00 0.00 39.33 39.40 3h6z h ASP 659 CO -0.06 0.06 -0.16 0.15 -3.12 0.00 0.00 179.24 176.11 3h6z h PHE 660 N -0.24 -0.39 -0.04 4.55 3.57 -1.84 -0.18 116.94 122.38 3h6z h PHE 660 Ca -0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 3h6z h PHE 660 Cb 0.20 0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.16 3h6z h PHE 660 CO -0.03 -0.23 -0.00 -0.07 -2.23 0.00 0.00 178.31 175.75 3h6z h LEU 661 N -0.12 0.06 -0.93 0.59 3.38 -1.26 -1.40 115.31 115.63 3h6z h LEU 661 Ca 0.16 -0.32 0.16 0.00 0.09 0.00 0.00 57.88 57.96 3h6z h LEU 661 Cb 0.36 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.99 3h6z h LEU 661 CO -0.37 0.37 0.54 0.58 0.09 0.00 0.00 178.44 179.65 3h6z h VAL 662 N -0.25 0.76 -0.52 1.22 2.07 -0.71 0.40 116.25 119.22 3h6z h VAL 662 Ca 0.01 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 3h6z h VAL 662 Cb 0.34 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.03 3h6z h VAL 662 CO 0.00 0.14 0.20 1.23 0.02 0.00 0.00 177.57 179.15 3h6z h GLY 663 N 0.75 0.81 1.70 2.17 0.00 -0.62 -2.09 103.07 105.79 3h6z h GLY 663 Ca 0.51 -0.41 -0.21 0.00 0.00 0.00 0.00 47.33 47.22 3h6z h GLY 663 CO -0.35 0.39 -1.13 3.21 0.00 0.00 0.00 176.54 178.66 3h6z h ARG 664 N 0.75 0.00 0.00 4.80 2.47 0.33 -3.35 114.38 119.37 3h6z h ARG 664 Ca 0.18 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.90 3h6z h ARG 664 Cb 0.17 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.49 3h6z h ARG 664 CO -0.01 0.77 -0.83 -0.07 0.56 0.00 0.00 179.97 180.39 3h6z h LEU 665 N 0.00 0.00 -9.65 3.04 3.38 -0.20 -3.45 115.31 108.43 3h6z h LEU 665 Ca -0.08 -0.14 -0.52 0.00 0.09 0.00 0.00 57.88 57.22 3h6z h LEU 665 Cb 1.77 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.58 3h6z h LEU 665 CO 0.10 0.07 1.00 -0.94 0.09 0.00 0.00 178.44 178.76 3h6z s SER 666 N -4.69 6.41 -1.29 -0.43 1.04 -0.80 -2.48 113.70 111.46 3h6z s SER 666 Ca 0.03 2.83 -0.01 0.00 0.48 0.00 0.00 55.95 59.28 3h6z s SER 666 Cb 0.12 -2.60 0.01 0.00 0.10 0.00 0.00 66.02 63.65 3h6z s SER 666 CO 0.76 -0.95 0.09 0.61 0.98 0.00 0.00 173.24 174.73 3h6z n GLY 667 N 3.95 -0.50 3.74 7.32 0.00 -1.26 -4.97 105.19 113.47 3h6z n GLY 667 Ca 0.16 0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3h6z n GLY 667 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6z s ALA 668 N -2.79 3.46 0.42 4.61 0.00 -1.04 -5.11 121.76 121.32 3h6z s ALA 668 Ca 0.06 -0.99 -0.18 0.00 0.00 0.00 0.00 51.96 50.85 3h6z s ALA 668 Cb -0.03 -1.40 -0.10 0.00 0.00 0.00 0.00 23.12 21.59 3h6z s ALA 668 CO 0.07 0.71 0.90 1.03 0.00 0.00 0.00 175.76 178.47 3h6z s ARG 669 N -2.06 4.10 0.00 0.00 0.52 -1.26 -4.93 118.95 115.31 3h6z s ARG 669 Ca 0.25 0.95 0.00 0.00 -0.52 0.00 0.00 55.73 56.41 3h6z s ARG 669 Cb -0.12 -2.24 0.00 0.00 0.52 0.00 0.00 34.95 33.11 3h6z s ARG 669 CO 0.17 -0.04 0.00 2.41 0.02 0.00 0.00 175.30 177.86 3h6z n THR 670 N -0.82 0.00 -1.74 0.02 -1.04 -1.26 -0.56 114.28 108.88 3h6z n THR 670 Ca 0.06 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.65 3h6z n THR 670 Cb 0.54 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.03 3h6z n THR 670 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h6z n LEU 671 N 0.00 4.31 -2.83 -4.42 4.77 -1.26 -4.92 117.00 112.65 3h6z n LEU 671 Ca 0.00 1.16 -0.26 0.00 -0.03 0.00 0.00 56.01 56.88 3h6z n LEU 671 Cb 0.00 -1.58 0.01 0.00 -2.33 0.00 0.00 43.42 39.51 3h6z n LEU 671 CO 0.00 0.10 -0.42 -2.65 -1.33 0.00 0.00 177.39 173.09 3h6z n PRO 672 N 1.95 0.00 -0.01 3.23 -0.02 -1.26 -4.83 135.00 134.06 3h6z n PRO 672 Ca 0.08 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.56 3h6z n PRO 672 Cb 0.37 -0.67 -0.00 0.00 -0.02 0.00 0.00 33.50 33.18 3h6z n PRO 672 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h6z n SER 673 N 1.66 -0.03 -2.31 2.55 2.88 -1.26 -1.98 113.62 115.14 3h6z n SER 673 Ca 0.05 0.42 -0.27 0.00 -1.33 0.00 0.00 58.87 57.75 3h6z n SER 673 Cb 0.31 -0.19 0.01 0.00 -0.75 0.00 0.00 64.21 63.59 3h6z n SER 673 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3h6z n ASN 674 N -2.55 5.06 -0.31 -3.46 3.02 -1.26 -4.95 115.26 110.81 3h6z n ASN 674 Ca 0.00 -3.74 0.00 0.00 -0.03 0.00 0.00 54.58 50.81 3h6z n ASN 674 Cb 0.01 -0.46 0.07 0.00 -0.61 0.00 0.00 39.78 38.79 3h6z n ASN 674 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 3h6z h PHE 675 N 2.41 -0.74 0.00 3.10 3.57 -1.72 -1.79 116.94 121.78 3h6z h PHE 675 Ca 0.35 0.08 -0.13 0.00 3.53 0.00 0.00 57.97 61.81 3h6z h PHE 675 Cb 1.13 0.45 -0.02 0.00 2.79 0.00 0.00 35.95 40.30 3h6z h PHE 675 CO 0.88 -0.38 -0.62 1.88 -2.23 0.00 0.00 178.31 177.83 3h6z h TYR 676 N -0.04 0.00 -0.38 0.41 -1.99 -1.92 -2.84 116.97 110.22 3h6z h TYR 676 Ca 0.36 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 61.04 3h6z h TYR 676 Cb 0.61 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.32 3h6z h TYR 676 CO -0.73 0.59 0.07 -0.91 -0.00 0.00 0.00 178.16 177.18 3h6z h ASN 677 N 0.00 0.59 -0.74 3.88 2.35 -1.76 -1.50 115.58 118.40 3h6z h ASN 677 Ca -0.01 -0.25 0.01 0.00 -0.55 0.00 0.00 56.30 55.49 3h6z h ASN 677 Cb 1.46 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 39.63 3h6z h ASN 677 CO 0.07 0.70 0.49 0.11 -1.65 0.00 0.00 177.43 177.15 3h6z h LYS 678 N 0.46 0.97 -0.28 0.81 1.79 -1.45 -1.02 116.57 117.86 3h6z h LYS 678 Ca 0.11 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.53 3h6z h LYS 678 Cb 0.35 -0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 3h6z h LYS 678 CO 0.01 0.64 0.17 0.82 -1.08 0.00 0.00 179.45 180.00 3h6z h ILE 679 N 1.00 1.10 -0.16 1.86 1.08 -1.34 -2.78 117.51 118.26 3h6z h ILE 679 Ca 0.27 -0.23 -0.10 0.00 -0.39 0.00 0.00 64.86 64.41 3h6z h ILE 679 Cb -0.11 0.76 -0.01 0.00 -3.07 0.00 0.00 36.82 34.38 3h6z h ILE 679 CO -0.06 0.10 -0.33 0.78 -0.69 0.00 0.00 178.15 177.94 3h6z h ASN 680 N 0.35 0.34 0.38 1.72 2.35 -0.94 -2.54 115.58 117.24 3h6z h ASN 680 Ca 0.10 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 3h6z h ASN 680 Cb 0.01 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.29 3h6z h ASN 680 CO -0.02 0.66 -0.18 0.44 -1.65 0.00 0.00 177.43 176.68 3h6z h ASP 681 N 0.29 -0.43 0.45 5.81 3.32 -1.05 -2.71 116.42 122.09 3h6z h ASP 681 Ca 0.04 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3h6z h ASP 681 Cb 0.73 0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.39 3h6z h ASP 681 CO 0.06 -0.25 0.00 0.77 -1.72 0.00 0.00 179.24 178.09 3h6z h SER 682 N -0.57 0.00 0.37 6.45 4.64 -1.42 -2.50 113.55 120.52 3h6z h SER 682 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 3h6z h SER 682 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3h6z h SER 682 CO 0.08 0.00 0.00 -0.11 -0.87 0.00 0.00 176.83 175.93 3h6z n LEU 683 N -2.58 0.00 -4.91 5.97 7.94 -0.96 -4.76 117.00 117.70 3h6z n LEU 683 Ca -0.00 0.26 -0.33 0.00 -1.11 0.00 0.00 56.01 54.83 3h6z n LEU 683 Cb 0.16 -0.26 -0.05 0.00 0.53 0.00 0.00 43.42 43.81 3h6z n LEU 683 CO 0.18 -0.07 -0.15 -1.58 -1.11 0.00 0.00 177.39 174.67 3h6z s GLN 684 N -2.51 3.45 0.11 1.96 0.74 -0.94 -4.67 119.66 117.80 3h6z s GLN 684 Ca 0.22 -0.33 -0.21 0.00 0.05 0.00 0.00 55.36 55.10 3h6z s GLN 684 Cb 0.15 -3.08 -0.07 0.00 1.10 0.00 0.00 33.01 31.11 3h6z s GLN 684 CO 0.33 0.66 0.64 0.45 -0.55 0.00 0.00 175.29 176.81 3h6z s SER 685 N -2.06 7.14 0.49 6.67 0.15 -1.26 -4.89 113.70 119.94 3h6z s SER 685 Ca 0.29 1.37 0.21 0.00 0.70 0.00 0.00 55.95 58.53 3h6z s SER 685 Cb -0.13 -2.40 1.28 0.00 -1.71 0.00 0.00 66.02 63.06 3h6z s SER 685 CO 0.21 0.23 2.06 0.03 1.20 0.00 0.00 173.24 176.96 3h6z h ARG 686 N 4.34 0.00 -6.73 5.44 3.08 -1.97 -3.43 114.38 115.11 3h6z h ARG 686 Ca -0.49 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.09 3h6z h ARG 686 Cb 1.21 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.29 3h6z h ARG 686 CO 0.64 0.13 -0.06 -0.06 -1.07 0.00 0.00 179.97 179.56 3h6z s PHE 687 N -4.47 3.35 0.13 3.04 0.40 -1.26 -4.98 117.98 114.19 3h6z s PHE 687 Ca -0.04 0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.70 3h6z s PHE 687 Cb 0.15 -2.24 -0.04 0.00 0.51 0.00 0.00 43.02 41.39 3h6z s PHE 687 CO 0.64 -0.27 -0.02 -0.98 0.70 0.00 0.00 175.22 175.29 3h6z s ARG 688 N -4.57 0.94 0.30 0.44 3.03 -1.26 -5.12 118.95 112.71 3h6z s ARG 688 Ca 0.46 -1.42 -0.30 0.00 2.03 0.00 0.00 55.73 56.51 3h6z s ARG 688 Cb -0.10 -0.16 -0.11 0.00 -1.03 0.00 0.00 34.95 33.55 3h6z s ARG 688 CO 0.39 -0.09 1.59 -0.51 -1.13 0.00 0.00 175.30 175.55 3h6z s LEU 689 N -3.09 4.34 0.00 -1.89 1.43 -1.26 -3.38 118.68 114.83 3h6z s LEU 689 Ca 0.18 2.97 0.00 0.00 -1.03 0.00 0.00 54.13 56.25 3h6z s LEU 689 Cb 0.06 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.64 3h6z s LEU 689 CO -0.01 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 176.26 3h6z n GLY 690 N 2.04 0.46 3.75 -3.19 0.00 -0.13 -5.03 105.19 103.10 3h6z n GLY 690 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3h6z n GLY 690 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h6z s LEU 691 N 0.00 4.58 -0.05 0.99 1.43 -1.22 -4.81 118.68 119.61 3h6z s LEU 691 Ca 0.00 2.12 -0.15 0.00 -1.03 0.00 0.00 54.13 55.07 3h6z s LEU 691 Cb 0.00 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.55 3h6z s LEU 691 CO 0.00 -0.04 0.40 0.20 0.23 0.00 0.00 176.35 177.14 3h6z s ASN 692 N -0.87 6.73 0.30 2.29 -0.87 0.95 -0.84 114.94 122.63 3h6z s ASN 692 Ca 0.44 0.86 0.05 0.00 -1.57 0.00 0.00 52.86 52.64 3h6z s ASN 692 Cb -0.29 -2.24 -0.03 0.00 -0.02 0.00 0.00 41.25 38.66 3h6z s ASN 692 CO 0.37 0.24 0.25 -1.48 -2.57 0.00 0.00 177.10 173.90 3h6z s LEU 693 N -0.54 1.60 -0.23 0.60 0.05 -0.76 -1.08 118.68 118.32 3h6z s LEU 693 Ca 0.23 -1.67 -0.08 0.00 0.05 0.00 0.00 54.13 52.66 3h6z s LEU 693 Cb -0.16 0.54 -0.04 0.00 -2.05 0.00 0.00 46.19 44.49 3h6z s LEU 693 CO 0.11 -1.02 0.08 -1.61 -0.55 0.00 0.00 176.35 173.37 3h6z s GLU 694 N -3.60 3.82 -0.02 1.48 2.02 0.65 -0.58 118.70 122.48 3h6z s GLU 694 Ca 0.40 -0.40 0.03 0.00 0.02 0.00 0.00 54.97 55.02 3h6z s GLU 694 Cb 0.03 -3.32 -0.00 0.00 0.10 0.00 0.00 34.13 30.94 3h6z s GLU 694 CO 0.24 0.00 -0.11 0.00 0.02 0.00 0.00 175.26 175.42 3h6z n VAL 696 N 3.01 0.60 -1.94 0.00 0.31 -0.91 0.07 118.33 119.47 3h6z n VAL 696 Ca -0.16 -0.11 -0.43 0.00 -0.01 0.00 0.00 64.34 63.64 3h6z n VAL 696 Cb 0.55 -2.01 -0.03 0.00 -0.91 0.00 0.00 33.84 31.45 3h6z n VAL 696 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3h6z s ASP 697 N 3.96 6.05 0.40 4.52 3.68 -0.40 -4.84 116.67 130.05 3h6z s ASP 697 Ca 0.90 1.66 0.28 0.00 2.13 0.00 0.00 52.55 57.52 3h6z s ASP 697 Cb -0.60 -2.53 1.42 0.00 -1.45 0.00 0.00 42.92 39.76 3h6z s ASP 697 CO 0.47 -1.52 1.84 0.07 0.13 0.00 0.00 175.17 176.17 3h6z h LYS 698 N 12.23 0.00 0.00 4.34 2.10 -1.89 -1.31 116.57 132.04 3h6z h LYS 698 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 3h6z h LYS 698 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 3h6z h LYS 698 CO 1.00 0.00 -1.28 -0.25 -2.00 0.00 0.00 179.45 176.92 3h6z n ASP 699 N -2.48 0.55 -3.02 7.07 10.43 -1.26 -4.69 116.55 123.14 3h6z n ASP 699 Ca -0.01 -0.33 -0.11 0.00 2.57 0.00 0.00 54.79 56.90 3h6z n ASP 699 Cb 0.09 1.15 -0.03 0.00 1.84 0.00 0.00 41.12 44.18 3h6z n ASP 699 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 3h6z s ARG 700 N -3.24 0.97 0.08 -1.24 3.52 -0.54 -5.02 118.95 113.50 3h6z s ARG 700 Ca 0.02 -1.30 0.09 0.00 -0.13 0.00 0.00 55.73 54.40 3h6z s ARG 700 Cb 0.15 -0.49 0.42 0.00 -1.56 0.00 0.00 34.95 33.47 3h6z s ARG 700 CO 0.85 -1.33 1.27 0.44 -0.81 0.00 0.00 175.30 175.72 3h6z n ILE 701 N 3.11 1.53 1.84 4.11 -5.35 -0.95 -1.63 119.36 122.02 3h6z n ILE 701 Ca 0.20 0.48 0.05 0.00 -0.27 0.00 0.00 62.75 63.21 3h6z n ILE 701 Cb 0.53 -1.43 0.23 0.00 -1.74 0.00 0.00 39.64 37.24 3h6z n ILE 701 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3h6z n SER 702 N -1.70 0.29 -3.79 7.28 3.41 -1.01 -4.54 113.62 113.55 3h6z n SER 702 Ca 0.01 -1.78 -0.13 0.00 -0.26 0.00 0.00 58.87 56.71 3h6z n SER 702 Cb 0.06 -0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 63.88 3h6z n SER 702 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3h6z s GLN 703 N -1.94 0.56 0.19 4.33 0.74 -0.65 -4.25 119.66 118.63 3h6z s GLN 703 Ca 0.14 -0.13 0.04 0.00 0.05 0.00 0.00 55.36 55.46 3h6z s GLN 703 Cb 0.07 0.25 -0.03 0.00 1.10 0.00 0.00 33.01 34.39 3h6z s GLN 703 CO 0.11 -0.14 0.30 0.14 -0.55 0.00 0.00 175.29 175.15 3h6z s VAL 704 N -1.06 5.20 -0.03 1.34 -7.23 0.01 -1.27 120.40 117.36 3h6z s VAL 704 Ca -0.11 -0.86 0.02 0.00 -1.81 0.00 0.00 61.98 59.21 3h6z s VAL 704 Cb -0.05 -3.74 0.01 0.00 0.56 0.00 0.00 36.38 33.16 3h6z s VAL 704 CO 0.03 -0.19 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.95 3h6z s ARG 705 N -3.53 0.84 0.20 4.82 3.52 0.11 -0.43 118.95 124.48 3h6z s ARG 705 Ca 0.34 -0.23 -0.32 0.00 -0.13 0.00 0.00 55.73 55.39 3h6z s ARG 705 Cb -0.10 -0.80 -0.13 0.00 -1.56 0.00 0.00 34.95 32.36 3h6z s ARG 705 CO 0.28 0.06 1.62 -0.11 -0.81 0.00 0.00 175.30 176.34 3h6z n LEU 706 N 3.45 3.58 -4.34 -0.88 0.00 -0.78 -1.91 117.00 116.12 3h6z n LEU 706 Ca -0.19 1.09 -0.20 0.00 0.00 0.00 0.00 56.01 56.70 3h6z n LEU 706 Cb 0.54 -1.50 -0.08 0.00 0.00 0.00 0.00 43.42 42.37 3h6z n LEU 706 CO 0.24 -0.08 -0.16 0.00 0.00 0.00 0.00 177.39 177.40 3h6z s ALA 707 N 0.81 2.09 -0.02 1.96 0.00 0.25 -1.15 121.76 125.70 3h6z s ALA 707 Ca 0.75 -1.77 0.00 0.00 0.00 0.00 0.00 51.96 50.94 3h6z s ALA 707 Cb -0.59 1.23 0.02 0.00 0.00 0.00 0.00 23.12 23.78 3h6z s ALA 707 CO 0.38 -0.55 0.00 0.99 0.00 0.00 0.00 175.76 176.58 3h6z s THR 708 N -3.48 0.10 -0.18 0.00 2.01 0.18 -1.82 115.64 112.44 3h6z s THR 708 Ca 0.35 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 62.12 3h6z s THR 708 Cb 0.03 -0.16 -0.04 0.00 0.01 0.00 0.00 72.50 72.34 3h6z s THR 708 CO 0.21 0.09 1.68 -0.69 -0.69 0.00 0.00 174.62 175.22 3h6z s VAL 709 N 0.62 3.60 -0.09 3.82 1.01 -0.02 -1.04 120.40 128.29 3h6z s VAL 709 Ca -0.06 0.69 0.05 0.00 0.00 0.00 0.00 61.98 62.66 3h6z s VAL 709 Cb -0.08 -3.59 -0.09 0.00 0.00 0.00 0.00 36.38 32.61 3h6z s VAL 709 CO -0.01 -0.22 -0.02 0.41 0.00 0.00 0.00 175.10 175.25 3h6z n THR 710 N 6.31 0.61 -4.06 3.92 -1.04 -0.05 -0.95 114.28 119.01 3h6z n THR 710 Ca 0.19 -0.32 -0.13 0.00 -2.04 0.00 0.00 64.05 61.76 3h6z n THR 710 Cb 0.45 -0.82 -0.12 0.00 -1.82 0.00 0.00 70.33 68.02 3h6z n THR 710 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3h6z s LYS 711 N -2.21 0.50 -0.09 -2.82 1.02 -1.24 -4.91 119.74 109.99 3h6z s LYS 711 Ca -0.08 -0.68 -0.01 0.00 0.02 0.00 0.00 55.97 55.21 3h6z s LYS 711 Cb 0.03 -0.27 0.03 0.00 -0.52 0.00 0.00 37.83 37.10 3h6z s LYS 711 CO 0.31 0.05 -0.01 0.42 -0.92 0.00 0.00 175.35 175.21 3h6z s ILE 712 N -1.24 0.49 -0.12 2.17 1.01 -1.26 -0.60 121.20 121.65 3h6z s ILE 712 Ca -0.09 -0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.57 3h6z s ILE 712 Cb -0.09 -0.66 0.02 0.00 0.01 0.00 0.00 42.46 41.74 3h6z s ILE 712 CO 0.00 0.24 -0.13 0.68 0.00 0.00 0.00 174.94 175.72 3h6z s VAL 713 N 1.92 1.42 -0.60 2.92 -7.23 -0.63 -4.90 120.40 113.31 3h6z s VAL 713 Ca 0.04 -0.57 -0.03 0.00 -1.81 0.00 0.00 61.98 59.62 3h6z s VAL 713 Cb -0.13 -1.33 0.00 0.00 0.56 0.00 0.00 36.38 35.49 3h6z s VAL 713 CO -0.06 0.43 0.41 0.61 -0.31 0.00 0.00 175.10 176.18 3h6z n GLY 714 N 4.52 -0.85 3.92 2.32 0.00 -1.26 -1.20 105.19 112.64 3h6z n GLY 714 Ca -0.17 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3h6z n GLY 714 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h6z n ASP 715 N -1.57 0.00 -4.76 1.61 9.92 -1.26 -4.96 116.55 115.53 3h6z n ASP 715 Ca -0.20 0.00 -0.38 0.00 -0.53 0.00 0.00 54.79 53.67 3h6z n ASP 715 Cb 0.46 -1.88 -0.06 0.00 -0.64 0.00 0.00 41.12 39.00 3h6z n ASP 715 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 3h6z s ARG 716 N -0.68 4.24 -0.01 -1.24 0.52 -0.34 -1.23 118.95 120.21 3h6z s ARG 716 Ca 0.00 0.56 0.02 0.00 -0.52 0.00 0.00 55.73 55.78 3h6z s ARG 716 Cb 0.00 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 32.08 3h6z s ARG 716 CO 0.00 0.36 -0.02 -0.51 0.02 0.00 0.00 175.30 175.15 3h6z s LEU 717 N -0.09 3.43 -0.22 2.53 1.43 0.29 -1.60 118.68 124.45 3h6z s LEU 717 Ca 0.27 -0.03 -0.10 0.00 -1.03 0.00 0.00 54.13 53.25 3h6z s LEU 717 Cb -0.17 -1.94 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 3h6z s LEU 717 CO 0.14 0.29 0.14 0.12 0.23 0.00 0.00 176.35 177.27 3h6z s PHE 718 N -1.03 3.36 -0.28 0.29 5.36 0.23 -1.77 117.98 124.15 3h6z s PHE 718 Ca 0.18 0.28 -0.04 0.00 -0.96 0.00 0.00 56.93 56.38 3h6z s PHE 718 Cb -0.11 -2.21 0.02 0.00 -0.34 0.00 0.00 43.02 40.38 3h6z s PHE 718 CO 0.08 0.19 0.01 -0.51 -1.46 0.00 0.00 175.22 173.53 3h6z s LEU 719 N 0.67 3.57 -0.21 6.12 1.43 -0.41 -0.88 118.68 128.98 3h6z s LEU 719 Ca 0.08 -0.83 -0.09 0.00 -1.03 0.00 0.00 54.13 52.26 3h6z s LEU 719 Cb -0.12 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 3h6z s LEU 719 CO 0.01 -0.17 0.10 -0.60 0.23 0.00 0.00 176.35 175.92 3h6z s ARG 720 N 1.40 3.99 0.69 1.70 3.52 -0.21 -1.96 118.95 128.10 3h6z s ARG 720 Ca 0.01 -0.32 -0.14 0.00 -0.13 0.00 0.00 55.73 55.15 3h6z s ARG 720 Cb -0.17 -3.35 0.02 0.00 -1.56 0.00 0.00 34.95 29.88 3h6z s ARG 720 CO -0.01 0.15 1.10 0.71 -0.81 0.00 0.00 175.30 176.45 3h6z s TYR 721 N 0.73 2.61 0.32 5.12 4.12 -0.48 0.49 117.35 130.25 3h6z s TYR 721 Ca 0.05 1.55 0.08 0.00 0.02 0.00 0.00 57.07 58.77 3h6z s TYR 721 Cb -0.13 -3.13 0.53 0.00 -1.52 0.00 0.00 41.96 37.71 3h6z s TYR 721 CO 0.02 -1.72 1.75 0.27 0.02 0.00 0.00 175.55 175.88 3h6z h PHE 722 N -0.33 0.25 -0.53 2.71 -5.15 -1.48 -3.09 116.94 109.32 3h6z h PHE 722 Ca -0.46 -0.06 0.00 0.00 -0.20 0.00 0.00 57.97 57.25 3h6z h PHE 722 Cb 1.24 -0.06 0.00 0.00 0.22 0.00 0.00 35.95 37.35 3h6z h PHE 722 CO 0.56 0.55 0.00 -0.40 -2.00 0.00 0.00 178.31 177.02 3h6z n ASP 723 N -4.07 4.16 -3.69 -0.68 5.75 -1.26 -5.00 116.55 111.76 3h6z n ASP 723 Ca -0.01 -2.40 -0.11 0.00 -0.01 0.00 0.00 54.79 52.26 3h6z n ASP 723 Cb 0.44 -0.49 -0.06 0.00 -1.03 0.00 0.00 41.12 39.98 3h6z n ASP 723 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3h6z s SER 724 N -1.10 -0.17 -0.39 -1.12 0.15 -1.17 -5.03 113.70 104.87 3h6z s SER 724 Ca 0.43 -0.31 0.06 0.00 0.70 0.00 0.00 55.95 56.83 3h6z s SER 724 Cb 0.28 0.43 0.54 0.00 -1.71 0.00 0.00 66.02 65.56 3h6z s SER 724 CO 0.21 -0.78 1.65 -0.90 1.20 0.00 0.00 173.24 174.62 3h6z n ASP 725 N 0.01 3.81 -4.62 5.45 3.85 -1.26 -4.46 116.55 119.32 3h6z n ASP 725 Ca -0.17 -3.74 -0.24 0.00 -0.71 0.00 0.00 54.79 49.94 3h6z n ASP 725 Cb 0.62 -0.71 -0.08 0.00 -1.35 0.00 0.00 41.12 39.60 3h6z n ASP 725 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3h6z s ASP 726 N -2.21 4.31 0.00 -1.12 2.15 -1.26 -5.00 116.67 113.54 3h6z s ASP 726 Ca 0.52 -0.82 0.00 0.00 0.43 0.00 0.00 52.55 52.68 3h6z s ASP 726 Cb 0.44 -0.66 0.00 0.00 -0.30 0.00 0.00 42.92 42.40 3h6z s ASP 726 CO 0.03 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.54 3h6z n GLY 727 N -0.90 -0.52 3.33 2.66 0.00 -1.26 -1.38 105.19 107.12 3h6z n GLY 727 Ca -0.05 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 3h6z n GLY 727 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h6z s PHE 728 N -3.06 -0.16 0.24 1.61 -0.12 -0.83 -4.96 117.98 110.70 3h6z s PHE 728 Ca 0.00 -0.17 -0.28 0.00 -0.05 0.00 0.00 56.93 56.43 3h6z s PHE 728 Cb 0.00 0.24 -0.09 0.00 -0.63 0.00 0.00 43.02 42.54 3h6z s PHE 728 CO 0.00 -0.71 0.91 -1.58 -0.05 0.00 0.00 175.22 173.79 3h6z s TRP 729 N -3.82 3.91 0.16 3.49 0.52 -1.26 -1.29 118.94 120.65 3h6z s TRP 729 Ca 0.04 1.83 -0.22 0.00 0.02 0.00 0.00 56.10 57.77 3h6z s TRP 729 Cb 0.02 -2.92 0.06 0.00 -1.15 0.00 0.00 33.47 29.48 3h6z s TRP 729 CO -0.11 0.42 0.57 0.00 0.02 0.00 0.00 176.95 177.85 3h6z s HIS 731 N -3.76 3.43 0.09 0.00 2.46 -1.26 -0.55 115.29 115.70 3h6z s HIS 731 Ca 0.01 1.67 0.01 0.00 0.47 0.00 0.00 55.06 57.23 3h6z s HIS 731 Cb -0.01 -3.25 0.25 0.00 -0.13 0.00 0.00 32.58 29.44 3h6z s HIS 731 CO -0.13 -0.65 0.46 -1.91 -2.47 0.00 0.00 174.74 170.04 3h6z n GLU 732 N 0.69 -0.02 0.00 2.88 2.13 -0.37 -1.10 120.64 124.85 3h6z n GLU 732 Ca 0.01 0.43 0.13 0.00 0.66 0.00 0.00 57.16 58.40 3h6z n GLU 732 Cb 0.46 -0.70 0.36 0.00 0.27 0.00 0.00 31.44 31.83 3h6z n GLU 732 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3h6z n ASP 733 N -4.12 2.08 -4.77 4.31 8.00 -1.26 -4.67 116.55 116.11 3h6z n ASP 733 Ca 0.07 -1.69 -0.37 0.00 0.71 0.00 0.00 54.79 53.52 3h6z n ASP 733 Cb 0.25 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.33 3h6z n ASP 733 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3h6z s SER 734 N -2.01 6.40 0.00 -2.24 1.04 -0.25 -4.74 113.70 111.90 3h6z s SER 734 Ca 0.34 2.24 0.18 0.00 0.48 0.00 0.00 55.95 59.19 3h6z s SER 734 Cb 0.21 -2.60 0.98 0.00 0.10 0.00 0.00 66.02 64.70 3h6z s SER 734 CO 0.32 -0.75 1.49 -0.81 0.98 0.00 0.00 173.24 174.48 3h6z n PRO 735 N -0.25 0.41 -0.08 4.02 -0.04 -1.26 -3.39 135.00 134.40 3h6z n PRO 735 Ca 0.06 0.06 0.11 0.00 -0.04 0.00 0.00 63.50 63.69 3h6z n PRO 735 Cb 0.48 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.58 3h6z n PRO 735 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3h6z n ILE 736 N -1.14 0.23 -4.37 0.52 -5.35 -1.26 -4.89 119.36 103.10 3h6z n ILE 736 Ca 0.11 -0.61 -0.32 0.00 -0.27 0.00 0.00 62.75 61.66 3h6z n ILE 736 Cb 0.10 1.25 -0.10 0.00 -1.74 0.00 0.00 39.64 39.15 3h6z n ILE 736 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 3h6z s ILE 737 N -1.68 3.78 0.04 7.28 -4.36 -1.22 -2.15 121.20 122.89 3h6z s ILE 737 Ca 0.31 -0.78 -0.02 0.00 -0.26 0.00 0.00 60.65 59.90 3h6z s ILE 737 Cb 0.20 -2.68 -0.02 0.00 1.25 0.00 0.00 42.46 41.21 3h6z s ILE 737 CO 0.29 0.35 0.01 -1.00 0.24 0.00 0.00 174.94 174.84 3h6z s HIS 738 N -1.06 0.33 0.83 1.37 3.76 0.19 -4.97 115.29 115.74 3h6z s HIS 738 Ca 0.19 -0.71 -0.11 0.00 -0.15 0.00 0.00 55.06 54.28 3h6z s HIS 738 Cb -0.11 -0.24 0.09 0.00 1.11 0.00 0.00 32.58 33.43 3h6z s HIS 738 CO 0.09 -0.32 1.09 -1.25 -0.85 0.00 0.00 174.74 173.51 3h6z s PRO 739 N -2.71 1.81 0.21 8.40 0.04 -1.26 -0.25 135.00 141.24 3h6z s PRO 739 Ca -0.04 0.99 -0.30 0.00 0.04 0.00 0.00 61.00 61.69 3h6z s PRO 739 Cb -0.01 -1.86 -0.10 0.00 0.04 0.00 0.00 34.50 32.58 3h6z s PRO 739 CO -0.05 -1.90 1.43 0.14 0.04 0.00 0.00 177.00 176.65 3h6z s VAL 740 N -2.93 2.82 0.00 -0.36 -7.23 -0.61 -2.17 120.40 109.91 3h6z s VAL 740 Ca 0.62 0.66 0.00 0.00 -1.81 0.00 0.00 61.98 61.45 3h6z s VAL 740 Cb -0.17 -3.42 0.00 0.00 0.56 0.00 0.00 36.38 33.35 3h6z s VAL 740 CO 0.56 0.09 0.00 0.61 -0.31 0.00 0.00 175.10 176.05 3h6z n GLY 741 N 2.58 0.37 0.10 2.32 0.00 -1.26 -4.91 105.19 104.39 3h6z n GLY 741 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 3h6z n GLY 741 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3h6z h TRP 742 N 0.00 0.19 -0.50 1.61 7.01 -1.80 -1.24 115.95 121.22 3h6z h TRP 742 Ca 0.00 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.02 3h6z h TRP 742 Cb 0.00 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 26.97 3h6z h TRP 742 CO 0.00 0.11 0.31 0.00 -2.79 0.00 0.00 178.44 176.07 3h6z h ALA 743 N 1.08 0.64 0.00 2.65 0.00 -1.85 -0.27 119.26 121.50 3h6z h ALA 743 Ca 0.07 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3h6z h ALA 743 Cb -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3h6z h ALA 743 CO -0.03 0.03 -0.26 1.79 0.00 0.00 0.00 179.25 180.78 3h6z h THR 744 N 0.63 0.36 0.20 0.00 1.35 -1.75 0.47 112.91 114.18 3h6z h THR 744 Ca 0.19 -1.52 -0.01 0.00 -0.55 0.00 0.00 66.41 64.52 3h6z h THR 744 Cb -0.02 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 3h6z h THR 744 CO -0.07 0.21 -0.10 0.74 -0.25 0.00 0.00 175.52 176.05 3h6z h THR 745 N 0.00 0.88 0.00 6.82 2.02 -0.83 -3.33 112.91 118.47 3h6z h THR 745 Ca -0.00 -0.47 -0.20 0.00 0.77 0.00 0.00 66.41 66.51 3h6z h THR 745 Cb 1.17 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.71 3h6z h THR 745 CO 0.03 0.11 -0.95 0.58 0.37 0.00 0.00 175.52 175.65 3h6z h VAL 746 N -0.50 1.53 0.00 3.16 2.07 -1.05 -3.46 116.25 118.00 3h6z h VAL 746 Ca -0.03 -3.19 0.00 0.00 0.82 0.00 0.00 66.70 64.30 3h6z h VAL 746 Cb 0.38 2.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 3h6z h VAL 746 CO 0.05 0.87 0.00 0.61 0.02 0.00 0.00 177.57 179.12 3h6z n GLY 747 N 1.34 1.01 3.85 2.17 0.00 -0.37 -0.99 105.19 112.21 3h6z n GLY 747 Ca -0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 3h6z n GLY 747 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3h6z s HIS 748 N -2.00 3.39 0.37 1.61 5.04 0.01 -4.97 115.29 118.75 3h6z s HIS 748 Ca 0.00 1.16 -0.28 0.00 -1.54 0.00 0.00 55.06 54.41 3h6z s HIS 748 Cb 0.00 -2.50 -0.10 0.00 0.04 0.00 0.00 32.58 30.02 3h6z s HIS 748 CO 0.00 0.08 1.36 -0.80 -2.34 0.00 0.00 174.74 173.03 3h6z s ASN 749 N -2.42 6.48 -0.02 9.88 0.01 -1.26 -4.42 114.94 123.19 3h6z s ASN 749 Ca 0.53 2.78 0.04 0.00 -0.71 0.00 0.00 52.86 55.50 3h6z s ASN 749 Cb -0.10 -2.65 -0.01 0.00 0.41 0.00 0.00 41.25 38.90 3h6z s ASN 749 CO 0.20 -0.75 -0.13 -0.22 -1.51 0.00 0.00 177.10 174.69 3h6z s LEU 750 N -2.11 1.97 -0.19 0.60 2.96 -1.26 -0.81 118.68 119.84 3h6z s LEU 750 Ca 0.53 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.20 3h6z s LEU 750 Cb -0.41 -0.70 0.04 0.00 0.50 0.00 0.00 46.19 45.61 3h6z s LEU 750 CO 0.54 0.14 -0.12 0.00 -1.32 0.00 0.00 176.35 175.60 3h6z s ALA 751 N -0.17 2.01 0.21 5.97 0.00 0.42 -4.93 121.76 125.27 3h6z s ALA 751 Ca 0.02 -1.14 -0.23 0.00 0.00 0.00 0.00 51.96 50.62 3h6z s ALA 751 Cb -0.07 -1.22 0.05 0.00 0.00 0.00 0.00 23.12 21.88 3h6z s ALA 751 CO 0.00 -0.67 0.71 0.00 0.00 0.00 0.00 175.76 175.81 3h6z s ALA 752 N 1.40 -1.43 0.93 0.00 0.00 -1.26 -1.86 121.76 119.55 3h6z s ALA 752 Ca 0.01 0.08 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 3h6z s ALA 752 Cb -0.15 0.82 0.13 0.00 0.00 0.00 0.00 23.12 23.92 3h6z s ALA 752 CO -0.09 -0.93 1.00 -2.30 0.00 0.00 0.00 175.76 173.44 3h6z n PRO 753 N -0.42 -0.47 -0.02 0.00 -0.02 -1.26 -4.71 135.00 128.09 3h6z n PRO 753 Ca -0.09 -0.08 -0.09 0.00 -2.02 0.00 0.00 63.50 61.22 3h6z n PRO 753 Cb 0.61 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 3h6z n PRO 753 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3h6z h GLN 754 N -1.85 -0.00 -0.63 -0.52 4.15 -2.02 -0.17 115.11 114.07 3h6z h GLN 754 Ca -0.43 0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.03 3h6z h GLN 754 Cb 1.27 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.93 3h6z h GLN 754 CO 0.40 -0.00 0.41 -0.44 -1.93 0.00 0.00 178.83 177.27 3h6z h ASP 755 N -0.00 0.59 -0.03 -0.69 3.45 -1.99 0.87 116.42 118.62 3h6z h ASP 755 Ca 0.08 -0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.42 3h6z h ASP 755 Cb 0.12 -0.13 0.01 0.00 -0.56 0.00 0.00 39.33 38.77 3h6z h ASP 755 CO -0.17 0.39 -0.45 0.22 -1.57 0.00 0.00 179.24 177.67 3h6z h TYR 756 N 0.68 0.50 -0.95 4.55 3.20 -1.84 -0.58 116.97 122.52 3h6z h TYR 756 Ca 0.26 -0.26 0.12 0.00 3.14 0.00 0.00 58.73 62.00 3h6z h TYR 756 Cb 0.18 -0.06 -0.08 0.00 1.54 0.00 0.00 36.73 38.31 3h6z h TYR 756 CO -0.00 1.05 0.61 -0.07 -1.64 0.00 0.00 178.16 178.10 3h6z h LEU 757 N -0.18 0.83 -0.24 2.82 4.07 -0.39 -0.68 115.31 121.54 3h6z h LEU 757 Ca -0.05 0.04 -0.08 0.00 0.08 0.00 0.00 57.88 57.87 3h6z h LEU 757 Cb 1.15 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.76 3h6z h LEU 757 CO 0.09 0.44 -0.18 -0.33 -1.08 0.00 0.00 178.44 177.38 3h6z h GLU 758 N 0.89 0.54 -0.71 1.13 5.08 -0.79 -2.25 114.58 118.48 3h6z h GLU 758 Ca 0.47 -0.27 0.07 0.00 -1.00 0.00 0.00 59.36 58.63 3h6z h GLU 758 Cb 0.55 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 3h6z h GLU 758 CO -0.24 0.84 0.39 -0.09 -1.00 0.00 0.00 179.01 178.92 3h6z h ARG 759 N 0.25 0.68 -0.24 2.33 2.43 -0.49 0.22 114.38 119.56 3h6z h ARG 759 Ca 0.04 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 59.02 3h6z h ARG 759 Cb 0.72 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 3h6z h ARG 759 CO 0.05 0.45 -0.46 0.52 -1.51 0.00 0.00 179.97 179.02 3h6z h MET 760 N 0.70 0.74 -0.50 0.20 2.86 -1.13 -2.56 114.93 115.24 3h6z h MET 760 Ca 0.32 -0.47 -0.07 0.00 -2.06 0.00 0.00 59.70 57.43 3h6z h MET 760 Cb 0.24 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 3h6z h MET 760 CO -0.21 1.09 0.04 -0.07 1.06 0.00 0.00 176.91 178.83 3h6z h LEU 761 N 0.47 0.78 -1.34 1.22 4.07 -1.13 -1.95 115.31 117.42 3h6z h LEU 761 Ca 0.01 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.80 3h6z h LEU 761 Cb 1.06 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.59 3h6z h LEU 761 CO 0.10 0.82 0.00 0.00 -1.08 0.00 0.00 178.44 178.28 3h6z n ALA 762 N -2.47 2.73 -0.01 1.53 0.00 0.75 -1.90 120.51 121.14 3h6z n ALA 762 Ca 0.03 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.07 3h6z n ALA 762 Cb 0.28 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.71 3h6z n ALA 762 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6z n GLY 763 N 0.29 0.04 0.00 0.00 0.00 -0.75 -3.75 105.19 101.03 3h6z n GLY 763 Ca 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.08 3h6z n GLY 763 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3h6z n ARG 764 N -0.59 2.32 0.15 1.61 0.00 -1.08 -3.76 116.66 115.31 3h6z n ARG 764 Ca 0.00 -0.00 0.04 0.00 -0.00 0.00 0.00 57.85 57.89 3h6z n ARG 764 Cb 0.00 -1.03 0.05 0.00 0.00 0.00 0.00 32.46 31.49 3h6z n ARG 764 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 3h6z h GLU 765 N 0.00 0.00 0.00 -0.14 4.39 -1.65 -3.47 114.58 113.71 3h6z h GLU 765 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 3h6z h GLU 765 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 3h6z h GLU 765 CO 0.00 0.39 0.00 0.00 -1.16 0.00 0.00 179.01 178.24 3h6z n ALA 766 N -2.20 0.05 -2.79 3.43 0.00 -1.26 -5.10 120.51 112.63 3h6z n ALA 766 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.31 3h6z n ALA 766 Cb 0.69 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.02 3h6z n ALA 766 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3h6z s MET 767 N 0.95 0.52 -0.02 0.00 -1.94 -1.25 -4.90 119.30 112.68 3h6z s MET 767 Ca 0.00 -0.49 -0.30 0.00 -1.71 0.00 0.00 55.69 53.19 3h6z s MET 767 Cb 0.00 -0.41 -0.06 0.00 2.01 0.00 0.00 34.83 36.37 3h6z s MET 767 CO 0.00 0.10 1.58 -1.50 -0.01 0.00 0.00 175.02 175.19 3h6z s ILE 768 N -0.75 3.51 -0.42 2.53 2.07 -1.25 -3.96 121.20 122.92 3h6z s ILE 768 Ca -0.03 0.77 -0.16 0.00 -1.41 0.00 0.00 60.65 59.81 3h6z s ILE 768 Cb -0.06 -3.50 0.03 0.00 0.13 0.00 0.00 42.46 39.06 3h6z s ILE 768 CO 0.00 -0.04 0.39 -1.83 -1.91 0.00 0.00 174.94 171.56 3h6z s GLU 769 N 3.32 3.04 -0.11 3.50 -1.05 -1.26 -5.06 118.70 121.08 3h6z s GLU 769 Ca 0.71 -0.90 -0.20 0.00 -0.15 0.00 0.00 54.97 54.43 3h6z s GLU 769 Cb -0.34 -3.99 -0.04 0.00 -0.44 0.00 0.00 34.13 29.32 3h6z s GLU 769 CO 0.29 -0.84 0.55 0.08 0.95 0.00 0.00 175.26 176.29 3h6z s VAL 770 N 1.96 5.14 0.13 1.83 1.01 -1.26 -5.03 120.40 124.18 3h6z s VAL 770 Ca 0.09 1.11 0.02 0.00 0.00 0.00 0.00 61.98 63.21 3h6z s VAL 770 Cb -0.18 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 3h6z s VAL 770 CO 0.12 0.30 0.23 -1.00 0.00 0.00 0.00 175.10 174.74 3h6z s HIS 771 N 0.73 3.42 0.60 5.22 3.76 -1.26 -5.01 115.29 122.75 3h6z s HIS 771 Ca 0.30 0.12 0.29 0.00 -0.15 0.00 0.00 55.06 55.62 3h6z s HIS 771 Cb -0.16 -1.66 1.58 0.00 1.11 0.00 0.00 32.58 33.46 3h6z s HIS 771 CO 0.13 0.53 1.98 1.49 -0.85 0.00 0.00 174.74 178.02 3h6z h GLU 772 N 2.45 0.00 -0.43 1.40 4.81 -2.03 -0.28 114.58 120.50 3h6z h GLU 772 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3h6z h GLU 772 Cb 1.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 3h6z h GLU 772 CO 0.69 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.72 3h6z n ASP 773 N -3.59 3.60 -4.71 1.04 8.00 -1.26 -4.96 116.55 114.67 3h6z n ASP 773 Ca 0.04 -2.30 -0.42 0.00 0.71 0.00 0.00 54.79 52.82 3h6z n ASP 773 Cb 0.49 -0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 41.17 3h6z n ASP 773 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3h6z s ASP 774 N -1.17 7.02 -0.27 -2.24 1.01 -0.12 -0.03 116.67 120.86 3h6z s ASP 774 Ca 0.35 2.05 -0.29 0.00 0.71 0.00 0.00 52.55 55.38 3h6z s ASP 774 Cb 0.22 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.59 3h6z s ASP 774 CO 0.18 -0.53 1.03 0.00 0.21 0.00 0.00 175.17 176.06 3h6z s ALA 775 N 1.27 3.60 0.45 5.23 0.00 -0.24 -4.86 121.76 127.20 3h6z s ALA 775 Ca 0.60 0.04 0.07 0.00 0.00 0.00 0.00 51.96 52.67 3h6z s ALA 775 Cb -0.30 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.23 3h6z s ALA 775 CO 0.28 -1.23 0.36 0.99 0.00 0.00 0.00 175.76 176.17 3h6z s THR 776 N 3.35 2.36 0.32 0.00 2.01 -1.26 -1.58 115.64 120.85 3h6z s THR 776 Ca 0.44 -1.42 0.10 0.00 0.31 0.00 0.00 61.69 61.12 3h6z s THR 776 Cb -0.14 -2.79 0.32 0.00 0.01 0.00 0.00 72.50 69.90 3h6z s THR 776 CO 0.10 0.00 1.70 -0.29 -0.69 0.00 0.00 174.62 175.44 3h6z h ILE 777 N 1.01 0.43 0.00 1.82 6.09 -1.95 -0.74 117.51 124.17 3h6z h ILE 777 Ca -0.40 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 62.93 3h6z h ILE 777 Cb 1.27 -0.06 0.00 0.00 0.47 0.00 0.00 36.82 38.51 3h6z h ILE 777 CO 0.59 0.08 0.00 1.05 -3.07 0.00 0.00 178.15 176.80 3h6z h GLU 778 N 0.45 0.00 -0.00 2.19 9.09 -2.02 -0.93 114.58 123.36 3h6z h GLU 778 Ca 0.66 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.07 3h6z h GLU 778 Cb 1.37 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.47 3h6z h GLU 778 CO -0.54 0.00 -0.34 1.28 0.05 0.00 0.00 179.01 179.46 3h6z n LEU 779 N -2.59 0.57 -4.73 3.06 4.77 -0.29 -4.92 117.00 112.87 3h6z n LEU 779 Ca -0.02 -0.01 -0.30 0.00 -0.03 0.00 0.00 56.01 55.65 3h6z n LEU 779 Cb 0.06 -0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 40.84 3h6z n LEU 779 CO 0.15 0.12 -0.30 -0.36 -1.33 0.00 0.00 177.39 175.67 3h6z s PHE 780 N -2.82 3.08 -0.17 -1.77 0.40 -0.35 -4.89 117.98 111.46 3h6z s PHE 780 Ca 0.17 0.03 -0.18 0.00 -0.60 0.00 0.00 56.93 56.35 3h6z s PHE 780 Cb 0.18 -1.58 -0.04 0.00 0.51 0.00 0.00 43.02 42.10 3h6z s PHE 780 CO 0.61 0.50 0.47 0.21 0.70 0.00 0.00 175.22 177.71 3h6z s LYS 781 N -2.31 4.23 0.04 0.44 2.20 -1.26 -5.05 119.74 118.04 3h6z s LYS 781 Ca 0.27 0.36 0.07 0.00 -0.36 0.00 0.00 55.97 56.32 3h6z s LYS 781 Cb -0.12 -3.51 -0.02 0.00 -1.51 0.00 0.00 37.83 32.66 3h6z s LYS 781 CO 0.20 -0.02 -0.20 -1.64 -0.36 0.00 0.00 175.35 173.32 3h6z s MET 782 N 1.22 1.36 -0.01 4.03 -1.94 -1.26 -4.92 119.30 117.78 3h6z s MET 782 Ca 0.23 -0.93 0.10 0.00 -1.71 0.00 0.00 55.69 53.38 3h6z s MET 782 Cb -0.15 -1.47 0.31 0.00 2.01 0.00 0.00 34.83 35.53 3h6z s MET 782 CO 0.09 0.37 1.24 -1.71 -0.01 0.00 0.00 175.02 175.00 3h6z n ASN 783 N 1.85 1.95 -3.04 3.03 2.85 -1.26 -4.91 115.26 115.73 3h6z n ASN 783 Ca -0.17 -2.04 -0.09 0.00 -0.11 0.00 0.00 54.58 52.17 3h6z n ASN 783 Cb 0.53 -0.26 0.01 0.00 1.24 0.00 0.00 39.78 41.31 3h6z n ASN 783 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 3h6z s PHE 784 N -1.57 0.23 0.11 1.20 -0.12 -1.26 -5.08 117.98 111.48 3h6z s PHE 784 Ca 0.23 -0.83 0.06 0.00 -0.05 0.00 0.00 56.93 56.34 3h6z s PHE 784 Cb 0.13 0.71 -0.03 0.00 -0.63 0.00 0.00 43.02 43.19 3h6z s PHE 784 CO 0.15 -1.49 -0.16 0.99 -0.05 0.00 0.00 175.22 174.66 3h6z s THR 785 N -2.52 1.38 0.57 -4.49 2.01 -1.26 -5.04 115.64 106.29 3h6z s THR 785 Ca 0.17 -1.57 0.26 0.00 0.31 0.00 0.00 61.69 60.87 3h6z s THR 785 Cb -0.05 -1.42 0.34 0.00 0.01 0.00 0.00 72.50 71.39 3h6z s THR 785 CO 0.12 -0.27 2.21 -0.26 -0.69 0.00 0.00 174.62 175.73 3h6z h PHE 786 N 3.86 0.00 -0.74 4.92 -1.00 -2.02 -2.34 116.94 119.62 3h6z h PHE 786 Ca -0.42 0.00 0.15 0.00 2.81 0.00 0.00 57.97 60.51 3h6z h PHE 786 Cb 1.19 0.00 -0.14 0.00 3.61 0.00 0.00 35.95 40.61 3h6z h PHE 786 CO 0.64 0.00 -0.20 -0.44 -1.61 0.00 0.00 178.31 176.70 3h6z h ASP 787 N 0.00 -0.73 -0.76 2.17 5.19 -1.98 -1.26 116.42 119.06 3h6z h ASP 787 Ca 0.01 0.22 0.22 0.00 -0.62 0.00 0.00 57.03 56.87 3h6z h ASP 787 Cb 0.06 0.47 -0.03 0.00 0.18 0.00 0.00 39.33 40.01 3h6z h ASP 787 CO -0.00 -0.25 0.56 -0.33 -3.12 0.00 0.00 179.24 176.10 3h6z h GLU 788 N -0.01 0.00 0.07 3.56 5.08 -1.74 0.34 114.58 121.87 3h6z h GLU 788 Ca 0.35 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.35 3h6z h GLU 788 Cb 0.54 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 3h6z h GLU 788 CO -0.76 0.00 -2.11 0.66 -1.00 0.00 0.00 179.01 175.80 3h6z n TYR 789 N -4.26 0.81 -0.04 4.33 4.02 -0.51 -3.78 117.16 117.73 3h6z n TYR 789 Ca 0.15 0.19 0.02 0.00 -0.01 0.00 0.00 57.90 58.25 3h6z n TYR 789 Cb 0.84 -1.11 -0.16 0.00 -0.02 0.00 0.00 39.34 38.89 3h6z n TYR 789 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 176.86 178.33 3h6z n TYR 790 N -3.31 0.09 -0.07 -0.72 0.18 -0.91 -4.16 117.16 108.27 3h6z n TYR 790 Ca -0.33 0.03 -0.06 0.00 1.88 0.00 0.00 57.90 59.42 3h6z n TYR 790 Cb 1.04 -0.76 -0.02 0.00 -0.38 0.00 0.00 39.34 39.22 3h6z n TYR 790 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 3h6z n SER 791 N -2.52 1.60 -4.93 9.48 7.64 0.11 -4.97 113.62 120.04 3h6z n SER 791 Ca -0.16 0.42 -0.26 0.00 1.01 0.00 0.00 58.87 59.88 3h6z n SER 791 Cb 0.83 -0.76 0.03 0.00 -1.01 0.00 0.00 64.21 63.31 3h6z n SER 791 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3h6z s ASP 792 N -5.52 5.55 0.06 6.43 1.01 -1.16 -5.00 116.67 118.04 3h6z s ASP 792 Ca -0.19 0.57 -0.34 0.00 0.71 0.00 0.00 52.55 53.30 3h6z s ASP 792 Cb 0.03 -1.58 -0.13 0.00 1.01 0.00 0.00 42.92 42.25 3h6z s ASP 792 CO 0.28 -1.05 1.68 0.61 0.21 0.00 0.00 175.17 176.90 3h6z n GLY 793 N -2.51 1.21 3.53 0.21 0.00 -1.26 -4.39 105.19 101.99 3h6z n GLY 793 Ca 0.04 0.74 -0.55 0.00 0.00 0.00 0.00 46.02 46.25 3h6z n GLY 793 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h6z n LYS 794 N 4.58 0.49 0.00 1.61 5.02 -1.25 -4.82 118.16 123.79 3h6z n LYS 794 Ca 0.19 0.18 0.04 0.00 -2.02 0.00 0.00 58.31 56.70 3h6z n LYS 794 Cb 0.28 -1.71 0.23 0.00 -0.02 0.00 0.00 35.03 33.82 3h6z n LYS 794 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3h6z n THR 795 N 1.81 0.00 -2.15 -0.18 -1.04 -1.26 -4.89 114.28 106.58 3h6z n THR 795 Ca 0.19 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.79 3h6z n THR 795 Cb 0.14 -0.31 -0.03 0.00 -1.82 0.00 0.00 70.33 68.31 3h6z n THR 795 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3h6z s ASN 796 N -1.52 6.82 0.00 8.00 3.84 -1.26 -4.88 114.94 125.93 3h6z s ASN 796 Ca 0.12 2.46 0.00 0.00 0.21 0.00 0.00 52.86 55.65 3h6z s ASN 796 Cb 0.05 -2.61 0.00 0.00 -0.55 0.00 0.00 41.25 38.15 3h6z s ASN 796 CO 0.09 -0.60 0.00 -1.20 -2.79 0.00 0.00 177.10 172.60 3h6z n SER 797 N 2.82 0.00 -4.74 -4.21 7.64 -1.26 -5.07 113.62 108.80 3h6z n SER 797 Ca 0.07 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.54 3h6z n SER 797 Cb 0.42 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.59 3h6z n SER 797 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3h6z s PHE 798 N -1.00 3.14 0.18 1.43 0.40 -1.26 -5.04 117.98 115.83 3h6z s PHE 798 Ca 0.00 1.06 0.10 0.00 -0.60 0.00 0.00 56.93 57.50 3h6z s PHE 798 Cb 0.00 -3.73 -0.04 0.00 0.51 0.00 0.00 43.02 39.76 3h6z s PHE 798 CO 0.00 -2.39 -0.19 0.54 0.70 0.00 0.00 175.22 173.88 3h6z s VAL 799 N 0.24 2.64 0.08 -0.44 0.11 -1.26 -4.95 120.40 116.82 3h6z s VAL 799 Ca 0.60 -1.88 -0.31 0.00 -2.93 0.00 0.00 61.98 57.46 3h6z s VAL 799 Cb -0.39 -2.27 -0.09 0.00 -1.53 0.00 0.00 36.38 32.09 3h6z s VAL 799 CO 0.39 -0.10 1.80 -1.61 -3.33 0.00 0.00 175.10 172.26 3h6z s GLU 800 N -2.67 4.15 0.00 1.54 2.02 -1.26 -2.35 118.70 120.14 3h6z s GLU 800 Ca 0.22 2.51 0.00 0.00 0.02 0.00 0.00 54.97 57.72 3h6z s GLU 800 Cb -0.08 -3.73 0.00 0.00 0.10 0.00 0.00 34.13 30.42 3h6z s GLU 800 CO 0.11 -0.84 0.00 0.41 0.02 0.00 0.00 175.26 174.97 3h6z n GLY 801 N 4.23 2.12 3.71 -1.39 0.00 0.19 -5.00 105.19 109.04 3h6z n GLY 801 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3h6z n GLY 801 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h6z s MET 802 N -0.47 4.26 0.45 1.61 -1.94 -0.99 -4.42 119.30 117.80 3h6z s MET 802 Ca 0.00 2.19 -0.16 0.00 -1.71 0.00 0.00 55.69 56.01 3h6z s MET 802 Cb 0.00 -3.35 -0.08 0.00 2.01 0.00 0.00 34.83 33.41 3h6z s MET 802 CO 0.00 -0.57 0.90 0.15 -0.01 0.00 0.00 175.02 175.50 3h6z s LYS 803 N 1.65 3.98 0.07 2.03 -0.14 0.10 -1.62 119.74 125.80 3h6z s LYS 803 Ca 0.68 0.85 -0.05 0.00 -1.36 0.00 0.00 55.97 56.09 3h6z s LYS 803 Cb -0.38 -2.23 0.02 0.00 -1.68 0.00 0.00 37.83 33.55 3h6z s LYS 803 CO 0.30 -0.12 0.23 1.47 -0.76 0.00 0.00 175.35 176.47 3h6z n LEU 804 N -1.19 0.00 -4.32 3.17 -0.00 -0.75 -1.48 117.00 112.44 3h6z n LEU 804 Ca 0.05 -0.47 -0.30 0.00 -0.00 0.00 0.00 56.01 55.29 3h6z n LEU 804 Cb 0.54 0.79 -0.15 0.00 -0.00 0.00 0.00 43.42 44.59 3h6z n LEU 804 CO 0.44 -0.16 -0.57 -1.61 -0.00 0.00 0.00 177.39 175.50 3h6z s GLU 805 N -2.02 1.92 -0.05 1.47 2.02 -0.23 0.99 118.70 122.79 3h6z s GLU 805 Ca 0.05 -1.01 -0.15 0.00 0.02 0.00 0.00 54.97 53.88 3h6z s GLU 805 Cb -0.01 -1.97 0.03 0.00 0.10 0.00 0.00 34.13 32.28 3h6z s GLU 805 CO 0.02 0.53 0.35 0.00 0.02 0.00 0.00 175.26 176.18 3h6z s ALA 806 N -0.70 -0.89 0.12 5.21 0.00 0.66 -0.41 121.76 125.75 3h6z s ALA 806 Ca 0.11 0.59 -0.31 0.00 0.00 0.00 0.00 51.96 52.35 3h6z s ALA 806 Cb -0.10 -0.12 -0.10 0.00 0.00 0.00 0.00 23.12 22.80 3h6z s ALA 806 CO 0.01 -0.24 1.69 0.08 0.00 0.00 0.00 175.76 177.29 3h6z s VAL 807 N -0.89 2.72 -0.23 0.00 1.01 -0.65 -1.05 120.40 121.31 3h6z s VAL 807 Ca -0.10 0.32 -0.29 0.00 0.00 0.00 0.00 61.98 61.91 3h6z s VAL 807 Cb -0.04 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 3h6z s VAL 807 CO 0.04 0.01 1.67 -0.62 0.00 0.00 0.00 175.10 176.19 3h6z s ASP 808 N 2.11 6.29 0.60 3.32 -1.08 -0.16 -4.87 116.67 122.88 3h6z s ASP 808 Ca 0.75 1.62 0.39 0.00 -0.52 0.00 0.00 52.55 54.79 3h6z s ASP 808 Cb -0.43 -2.53 2.00 0.00 -1.46 0.00 0.00 42.92 40.49 3h6z s ASP 808 CO 0.33 -1.34 2.19 1.55 0.52 0.00 0.00 175.17 178.43 3h6z h PRO 809 N 11.15 0.00 -0.02 4.34 0.13 -1.91 -0.72 132.00 144.96 3h6z h PRO 809 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3h6z h PRO 809 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3h6z h PRO 809 CO 1.00 0.00 -0.13 1.28 -0.23 0.00 0.00 178.00 179.92 3h6z n LEU 810 N -3.00 2.53 -3.11 1.56 4.77 -1.26 -4.76 117.00 113.72 3h6z n LEU 810 Ca -0.02 -0.86 0.02 0.00 -0.03 0.00 0.00 56.01 55.12 3h6z n LEU 810 Cb 0.14 -0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.22 3h6z n LEU 810 CO 0.21 0.43 0.18 0.21 -1.33 0.00 0.00 177.39 177.10 3h6z s ASN 811 N -2.14 -1.26 0.02 -1.43 2.47 -0.29 -5.04 114.94 107.27 3h6z s ASN 811 Ca 0.26 -0.53 0.12 0.00 0.42 0.00 0.00 52.86 53.13 3h6z s ASN 811 Cb 0.20 1.64 0.50 0.00 -1.45 0.00 0.00 41.25 42.13 3h6z s ASN 811 CO 0.38 -0.15 1.37 0.18 -3.72 0.00 0.00 177.10 175.16 3h6z n LEU 812 N 4.40 0.05 -0.29 3.21 7.99 -1.17 -1.29 117.00 129.90 3h6z n LEU 812 Ca 0.09 0.52 0.14 0.00 -0.01 0.00 0.00 56.01 56.75 3h6z n LEU 812 Cb 0.58 -0.51 0.64 0.00 -0.11 0.00 0.00 43.42 44.02 3h6z n LEU 812 CO -0.03 -0.34 0.93 -1.54 -1.51 0.00 0.00 177.39 174.90 3h6z n SER 813 N -1.56 0.90 -4.17 -1.43 3.41 -1.11 -0.15 113.62 109.51 3h6z n SER 813 Ca 0.02 -1.36 -0.32 0.00 -0.26 0.00 0.00 58.87 56.96 3h6z n SER 813 Cb 0.13 -0.01 -0.17 0.00 -0.26 0.00 0.00 64.21 63.90 3h6z n SER 813 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3h6z s SER 814 N -1.91 3.01 -0.22 4.04 0.15 -0.41 -4.89 113.70 113.47 3h6z s SER 814 Ca 0.40 -0.57 -0.05 0.00 0.70 0.00 0.00 55.95 56.43 3h6z s SER 814 Cb 0.20 -1.39 -0.02 0.00 -1.71 0.00 0.00 66.02 63.10 3h6z s SER 814 CO 0.33 0.10 -0.00 -0.63 1.20 0.00 0.00 173.24 174.23 3h6z s ILE 815 N 0.68 3.77 0.20 6.45 1.01 -1.26 -0.99 121.20 131.07 3h6z s ILE 815 Ca -0.11 -0.36 0.10 0.00 0.00 0.00 0.00 60.65 60.27 3h6z s ILE 815 Cb -0.16 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.54 3h6z s ILE 815 CO 0.02 0.41 -0.19 0.00 0.00 0.00 0.00 174.94 175.17 3h6z n PRO 817 N -0.05 1.52 -4.26 0.00 -0.02 -1.25 -0.25 135.00 130.69 3h6z n PRO 817 Ca -0.10 0.54 -0.15 0.00 -2.02 0.00 0.00 63.50 61.77 3h6z n PRO 817 Cb 0.58 -2.01 -0.10 0.00 -0.02 0.00 0.00 33.50 31.95 3h6z n PRO 817 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h6z s ALA 818 N -1.14 1.49 -0.02 3.55 0.00 0.28 -1.48 121.76 124.43 3h6z s ALA 818 Ca 0.59 -1.78 0.02 0.00 0.00 0.00 0.00 51.96 50.79 3h6z s ALA 818 Cb -0.63 1.27 0.01 0.00 0.00 0.00 0.00 23.12 23.77 3h6z s ALA 818 CO 0.60 -0.55 -0.06 0.99 0.00 0.00 0.00 175.76 176.73 3h6z s THR 819 N -3.92 0.58 -0.28 0.00 2.01 0.15 -1.81 115.64 112.37 3h6z s THR 819 Ca 0.38 -0.25 -0.29 0.00 0.31 0.00 0.00 61.69 61.85 3h6z s THR 819 Cb 0.07 -0.53 -0.01 0.00 0.01 0.00 0.00 72.50 72.03 3h6z s THR 819 CO 0.14 0.19 1.45 -0.69 -0.69 0.00 0.00 174.62 175.03 3h6z s VAL 820 N 0.27 3.92 -0.17 3.82 1.01 -0.64 -0.52 120.40 128.10 3h6z s VAL 820 Ca -0.03 1.03 0.14 0.00 0.00 0.00 0.00 61.98 63.11 3h6z s VAL 820 Cb -0.08 -3.97 -0.20 0.00 0.00 0.00 0.00 36.38 32.13 3h6z s VAL 820 CO 0.00 -0.43 0.03 0.23 0.00 0.00 0.00 175.10 174.93 3h6z n MET 821 N 7.56 1.21 -3.67 2.72 2.81 0.10 0.54 117.12 128.40 3h6z n MET 821 Ca 0.17 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.97 3h6z n MET 821 Cb 0.46 -1.43 -0.09 0.00 -0.71 0.00 0.00 33.22 31.45 3h6z n MET 821 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h6z s ALA 822 N -2.40 -1.36 -0.28 3.04 0.00 -1.17 -4.86 121.76 114.73 3h6z s ALA 822 Ca -0.10 1.84 -0.20 0.00 0.00 0.00 0.00 51.96 53.50 3h6z s ALA 822 Cb 0.05 -1.16 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 3h6z s ALA 822 CO 0.66 -0.39 0.61 0.08 0.00 0.00 0.00 175.76 176.72 3h6z s VAL 823 N 1.68 4.98 0.01 0.00 1.01 -1.26 -0.13 120.40 126.68 3h6z s VAL 823 Ca -0.09 0.95 0.00 0.00 0.00 0.00 0.00 61.98 62.85 3h6z s VAL 823 Cb -0.08 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.36 3h6z s VAL 823 CO -0.15 -0.04 0.01 0.18 0.00 0.00 0.00 175.10 175.09 3h6z n LEU 824 N 5.76 0.00 -4.90 3.92 4.77 0.37 -4.99 117.00 121.92 3h6z n LEU 824 Ca -0.01 -0.02 -0.28 0.00 -0.03 0.00 0.00 56.01 55.67 3h6z n LEU 824 Cb 0.49 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.60 3h6z n LEU 824 CO 0.44 -0.50 0.58 -0.54 -1.33 0.00 0.00 177.39 176.03 3h6z s LYS 825 N -2.37 3.18 -1.91 3.23 1.02 -0.16 -4.36 119.74 118.37 3h6z s LYS 825 Ca 0.00 0.25 0.00 0.00 0.02 0.00 0.00 55.97 56.24 3h6z s LYS 825 Cb -0.00 -2.22 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 3h6z s LYS 825 CO 0.00 -0.61 0.00 1.19 -0.92 0.00 0.00 175.35 175.01 3h6z n PHE 826 N -2.60 -0.61 -0.07 3.18 3.01 -1.26 -2.38 117.46 116.73 3h6z n PHE 826 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 3h6z n PHE 826 Cb 0.56 -3.73 0.00 0.00 -0.01 0.00 0.00 39.48 36.30 3h6z n PHE 826 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3h6z n GLY 827 N -0.81 1.13 3.79 1.37 0.00 -1.26 -4.92 105.19 104.49 3h6z n GLY 827 Ca -0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 3h6z n GLY 827 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h6z s TYR 828 N -2.48 3.34 0.00 1.61 1.51 -1.00 -0.38 117.35 119.95 3h6z s TYR 828 Ca 0.00 1.66 -0.13 0.00 -1.01 0.00 0.00 57.07 57.59 3h6z s TYR 828 Cb 0.00 -3.01 0.02 0.00 -0.11 0.00 0.00 41.96 38.85 3h6z s TYR 828 CO 0.00 -0.35 0.26 0.00 -1.11 0.00 0.00 175.55 174.35 3h6z s MET 829 N -2.63 0.65 -0.19 -0.62 0.23 -0.84 -0.48 119.30 115.42 3h6z s MET 829 Ca 0.58 -0.32 -0.19 0.00 -1.03 0.00 0.00 55.69 54.74 3h6z s MET 829 Cb -0.18 0.28 -0.03 0.00 -1.53 0.00 0.00 34.83 33.37 3h6z s MET 829 CO 0.23 -0.18 0.54 -1.64 -2.03 0.00 0.00 175.02 171.94 3h6z s MET 830 N -1.60 4.21 0.00 3.16 -1.94 0.82 -1.70 119.30 122.25 3h6z s MET 830 Ca -0.12 0.47 0.02 0.00 -1.71 0.00 0.00 55.69 54.36 3h6z s MET 830 Cb -0.05 -3.55 -0.03 0.00 2.01 0.00 0.00 34.83 33.20 3h6z s MET 830 CO 0.02 -0.14 -0.03 0.42 -0.01 0.00 0.00 175.02 175.28 3h6z s ILE 831 N 1.59 3.92 -0.16 2.53 -1.09 0.28 0.03 121.20 128.30 3h6z s ILE 831 Ca 0.26 -0.69 0.00 0.00 -2.23 0.00 0.00 60.65 57.99 3h6z s ILE 831 Cb -0.16 -2.73 0.00 0.00 -1.58 0.00 0.00 42.46 38.00 3h6z s ILE 831 CO 0.10 0.38 -0.16 -0.60 -1.23 0.00 0.00 174.94 173.43 3h6z s ARG 832 N -1.51 3.16 -0.18 2.79 3.00 0.32 -0.05 118.95 126.48 3h6z s ARG 832 Ca 0.18 -0.77 -0.29 0.00 -1.00 0.00 0.00 55.73 53.85 3h6z s ARG 832 Cb -0.11 -2.62 -0.01 0.00 0.00 0.00 0.00 34.95 32.21 3h6z s ARG 832 CO 0.09 -0.04 1.21 0.42 0.00 0.00 0.00 175.30 176.98 3h6z s ILE 833 N 0.95 4.38 -1.37 4.11 1.09 -1.26 -0.68 121.20 128.42 3h6z s ILE 833 Ca -0.03 1.67 0.26 0.00 -1.10 0.00 0.00 60.65 61.45 3h6z s ILE 833 Cb -0.15 -4.07 0.43 0.00 -1.06 0.00 0.00 42.46 37.60 3h6z s ILE 833 CO -0.03 -0.15 1.89 0.47 -0.10 0.00 0.00 174.94 177.03 3h6z n ASP 834 N 6.52 0.00 0.15 3.58 8.00 -0.55 -2.90 116.55 131.35 3h6z n ASP 834 Ca 0.13 -0.01 0.13 0.00 0.71 0.00 0.00 54.79 55.75 3h6z n ASP 834 Cb 0.45 -0.31 0.36 0.00 -0.02 0.00 0.00 41.12 41.59 3h6z n ASP 834 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3h6z h SER 835 N 0.00 0.00 -4.28 -2.24 4.64 -1.77 -0.39 113.55 109.52 3h6z h SER 835 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 3h6z h SER 835 Cb 0.28 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 62.50 3h6z h SER 835 CO 0.00 0.00 0.32 -0.31 -0.87 0.00 0.00 176.83 175.97 3h6z s TYR 836 N -3.18 2.46 0.45 4.77 4.12 -1.14 -4.15 117.35 120.69 3h6z s TYR 836 Ca 0.09 1.58 -0.25 0.00 0.02 0.00 0.00 57.07 58.51 3h6z s TYR 836 Cb 0.10 -3.12 -0.08 0.00 -1.52 0.00 0.00 41.96 37.33 3h6z s TYR 836 CO 0.60 -1.92 1.40 -1.14 0.02 0.00 0.00 175.55 174.51 3h6z s GLN 837 N -4.66 3.67 -0.57 -0.62 0.74 -1.26 -4.59 119.66 112.38 3h6z s GLN 837 Ca 0.64 2.35 -0.27 0.00 0.05 0.00 0.00 55.36 58.13 3h6z s GLN 837 Cb -0.19 -2.63 -0.03 0.00 1.10 0.00 0.00 33.01 31.27 3h6z s GLN 837 CO 0.53 -0.80 1.93 -1.25 -0.55 0.00 0.00 175.29 175.14 3h6z s PRO 838 N -2.47 2.62 0.00 1.67 0.04 -1.26 -3.95 135.00 131.66 3h6z s PRO 838 Ca 0.61 0.80 0.00 0.00 0.04 0.00 0.00 61.00 62.45 3h6z s PRO 838 Cb -0.42 -4.40 0.00 0.00 0.04 0.00 0.00 34.50 29.72 3h6z s PRO 838 CO 0.54 -2.72 0.00 -3.47 0.04 0.00 0.00 177.00 171.39 3h6z n ASP 839 N 12.94 0.00 0.00 6.66 4.64 -1.26 -4.96 116.55 134.56 3h6z n ASP 839 Ca 0.23 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.64 3h6z n ASP 839 Cb 0.52 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.60 3h6z n ASP 839 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3h6z n ALA 840 N -0.83 1.12 -0.21 -1.67 0.00 -1.25 -4.80 120.51 112.87 3h6z n ALA 840 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h6z n ALA 840 Cb 0.00 -0.75 -0.00 0.00 0.00 0.00 0.00 19.45 18.70 3h6z n ALA 840 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3h6z n SER 841 N -0.81 -0.40 0.00 0.00 7.64 -1.26 0.61 113.62 119.40 3h6z n SER 841 Ca 0.00 -0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.61 3h6z n SER 841 Cb 0.00 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 3h6z n SER 841 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h6z n GLY 842 N 0.92 1.97 0.09 0.23 0.00 -1.26 -4.85 105.19 102.29 3h6z n GLY 842 Ca 0.01 -0.25 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 3h6z n GLY 842 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3h6z h SER 843 N 0.00 -0.14 -0.66 1.61 0.87 -0.15 -3.17 113.55 111.91 3h6z h SER 843 Ca 0.00 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3h6z h SER 843 Cb 0.00 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 3h6z h SER 843 CO 0.00 -0.07 0.00 0.47 -0.53 0.00 0.00 176.83 176.70 3h6z n ASP 844 N -5.16 4.65 -4.75 6.23 9.92 -0.84 -3.08 116.55 123.52 3h6z n ASP 844 Ca -0.06 -2.39 -0.36 0.00 -0.53 0.00 0.00 54.79 51.45 3h6z n ASP 844 Cb 0.09 -0.56 0.03 0.00 -0.64 0.00 0.00 41.12 40.04 3h6z n ASP 844 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 3h6z s TRP 845 N -1.74 2.40 0.01 1.24 0.51 -1.20 -4.78 118.94 115.39 3h6z s TRP 845 Ca 0.51 1.50 0.05 0.00 -2.12 0.00 0.00 56.10 56.04 3h6z s TRP 845 Cb 0.32 -3.52 -0.02 0.00 -0.81 0.00 0.00 33.47 29.45 3h6z s TRP 845 CO 0.26 -2.26 -0.16 0.12 -0.51 0.00 0.00 176.95 174.39 3h6z s PHE 846 N -1.55 1.43 -0.32 -1.98 5.36 0.93 -2.41 117.98 119.44 3h6z s PHE 846 Ca 0.76 -0.31 -0.20 0.00 -0.96 0.00 0.00 56.93 56.22 3h6z s PHE 846 Cb -0.32 -0.89 -0.01 0.00 -0.34 0.00 0.00 43.02 41.47 3h6z s PHE 846 CO 0.35 0.01 0.61 0.00 -1.46 0.00 0.00 175.22 174.73 3h6z s TYR 848 N 2.60 2.52 0.38 0.00 4.12 -0.69 -4.95 117.35 121.32 3h6z s TYR 848 Ca 0.24 -0.59 -0.26 0.00 0.02 0.00 0.00 57.07 56.49 3h6z s TYR 848 Cb -0.15 -1.62 -0.09 0.00 -1.52 0.00 0.00 41.96 38.58 3h6z s TYR 848 CO 0.13 -0.13 1.16 -1.58 0.02 0.00 0.00 175.55 175.15 3h6z s HIS 849 N -0.25 3.14 0.65 2.71 5.65 -1.26 -1.99 115.29 123.94 3h6z s HIS 849 Ca -0.01 1.57 0.31 0.00 0.25 0.00 0.00 55.06 57.18 3h6z s HIS 849 Cb -0.13 -3.38 1.67 0.00 -1.18 0.00 0.00 32.58 29.56 3h6z s HIS 849 CO 0.03 -1.21 1.97 1.05 -0.65 0.00 0.00 174.74 175.92 3h6z h GLU 850 N 2.80 0.00 -0.02 2.88 4.11 -1.07 0.11 114.58 123.40 3h6z h GLU 850 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3h6z h GLU 850 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 3h6z h GLU 850 CO 0.63 0.00 -0.17 1.17 0.07 0.00 0.00 179.01 180.71 3h6z n LYS 851 N -3.10 1.62 -1.71 1.06 4.81 -1.26 -4.50 118.16 115.08 3h6z n LYS 851 Ca -0.00 -1.21 -0.43 0.00 -0.87 0.00 0.00 58.31 55.79 3h6z n LYS 851 Cb 0.39 -1.47 -0.02 0.00 0.02 0.00 0.00 35.03 33.95 3h6z n LYS 851 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3h6z n SER 852 N 0.37 3.32 -0.35 3.14 2.88 0.39 -4.80 113.62 118.56 3h6z n SER 852 Ca 0.14 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.82 3h6z n SER 852 Cb 0.47 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 3h6z n SER 852 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3h6z n PRO 853 N 2.13 1.03 -0.08 -1.46 -0.04 -1.26 -2.90 135.00 132.43 3h6z n PRO 853 Ca 0.10 -0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.59 3h6z n PRO 853 Cb 0.34 -1.34 0.10 0.00 -0.04 0.00 0.00 33.50 32.56 3h6z n PRO 853 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h6z s ILE 855 N -1.06 2.61 0.04 0.00 -4.36 -1.14 -1.63 121.20 115.65 3h6z s ILE 855 Ca 0.20 -1.15 -0.03 0.00 -0.26 0.00 0.00 60.65 59.40 3h6z s ILE 855 Cb 0.12 -2.05 -0.02 0.00 1.25 0.00 0.00 42.46 41.76 3h6z s ILE 855 CO 0.17 0.41 0.03 -0.36 0.24 0.00 0.00 174.94 175.43 3h6z s PHE 856 N -0.83 0.30 0.78 1.37 0.08 0.45 -4.91 117.98 115.22 3h6z s PHE 856 Ca 0.13 -0.67 -0.13 0.00 0.12 0.00 0.00 56.93 56.38 3h6z s PHE 856 Cb -0.10 -0.22 0.07 0.00 -0.57 0.00 0.00 43.02 42.19 3h6z s PHE 856 CO 0.03 -0.33 1.16 -2.14 -0.10 0.00 0.00 175.22 173.85 3h6z s PRO 857 N -2.71 1.94 0.35 0.24 0.02 -1.26 -1.07 135.00 132.50 3h6z s PRO 857 Ca -0.04 1.58 -0.28 0.00 0.02 0.00 0.00 61.00 62.27 3h6z s PRO 857 Cb -0.01 -1.83 -0.12 0.00 0.02 0.00 0.00 34.50 32.57 3h6z s PRO 857 CO -0.05 -1.95 1.39 0.00 -0.33 0.00 0.00 177.00 176.06 3h6z n ALA 858 N -3.20 1.79 0.00 -1.55 0.00 -1.26 -2.20 120.51 114.09 3h6z n ALA 858 Ca 0.12 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.92 3h6z n ALA 858 Cb 0.51 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.63 3h6z n ALA 858 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6z n GLY 859 N 0.81 1.52 0.18 0.00 0.00 -1.26 -4.95 105.19 101.48 3h6z n GLY 859 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 3h6z n GLY 859 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3h6z h PHE 860 N 0.00 -0.26 -0.04 1.61 3.57 -1.80 -0.07 116.94 119.95 3h6z h PHE 860 Ca 0.00 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.55 3h6z h PHE 860 Cb 0.00 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 3h6z h PHE 860 CO 0.00 -0.19 -0.01 0.00 -2.23 0.00 0.00 178.31 175.88 3h6z h SER 862 N -0.01 -1.67 -0.73 0.00 0.87 -1.44 -0.64 113.55 109.93 3h6z h SER 862 Ca 0.02 0.19 0.02 0.00 -1.23 0.00 0.00 61.79 60.79 3h6z h SER 862 Cb 0.04 0.64 -0.04 0.00 -0.44 0.00 0.00 62.40 62.59 3h6z h SER 862 CO -0.05 -0.51 0.47 1.62 -0.53 0.00 0.00 176.83 177.83 3h6z h VAL 863 N -0.65 1.13 -0.26 2.23 3.04 -1.07 -2.87 116.25 117.80 3h6z h VAL 863 Ca 0.02 -0.32 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 3h6z h VAL 863 Cb 0.71 0.12 0.00 0.00 -2.01 0.00 0.00 31.29 30.11 3h6z h VAL 863 CO -0.38 0.17 0.00 0.59 -1.01 0.00 0.00 177.57 176.94 3h6z n ASN 864 N -4.62 1.67 -3.03 3.17 4.13 -0.77 -4.89 115.26 110.92 3h6z n ASN 864 Ca 0.08 -2.06 -0.21 0.00 1.68 0.00 0.00 54.58 54.07 3h6z n ASN 864 Cb 0.07 -0.25 0.01 0.00 -1.54 0.00 0.00 39.78 38.07 3h6z n ASN 864 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3h6z n ASN 865 N 0.28 -4.88 -4.81 6.41 3.02 -0.48 -4.98 115.26 109.83 3h6z n ASN 865 Ca 0.09 -0.24 -0.38 0.00 -0.03 0.00 0.00 54.58 54.02 3h6z n ASN 865 Cb 0.29 -4.01 -0.06 0.00 -0.61 0.00 0.00 39.78 35.39 3h6z n ASN 865 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h6z s ILE 866 N -3.00 5.07 -0.25 2.41 1.01 -0.37 -5.05 121.20 121.04 3h6z s ILE 866 Ca 0.28 0.85 -0.25 0.00 0.00 0.00 0.00 60.65 61.53 3h6z s ILE 866 Cb -0.14 -3.73 -0.00 0.00 0.01 0.00 0.00 42.46 38.60 3h6z s ILE 866 CO 0.34 0.52 0.84 -0.94 0.00 0.00 0.00 174.94 175.70 3h6z s SER 867 N -0.64 6.84 0.34 3.58 1.04 -1.26 -4.13 113.70 119.47 3h6z s SER 867 Ca 0.24 1.04 -0.21 0.00 0.48 0.00 0.00 55.95 57.50 3h6z s SER 867 Cb -0.16 -2.44 -0.10 0.00 0.10 0.00 0.00 66.02 63.42 3h6z s SER 867 CO 0.12 -0.54 0.86 0.54 0.98 0.00 0.00 173.24 175.20 3h6z s VAL 868 N 2.89 4.43 -0.27 5.02 0.11 -1.26 -4.75 120.40 126.56 3h6z s VAL 868 Ca 0.35 1.44 -0.24 0.00 -2.93 0.00 0.00 61.98 60.60 3h6z s VAL 868 Cb -0.15 -3.77 -0.00 0.00 -1.53 0.00 0.00 36.38 30.92 3h6z s VAL 868 CO 0.08 -0.05 0.82 -0.89 -3.33 0.00 0.00 175.10 171.73 3h6z s THR 869 N -1.84 4.80 0.85 5.04 2.01 -0.45 -4.95 115.64 121.10 3h6z s THR 869 Ca 0.53 1.42 -0.11 0.00 0.31 0.00 0.00 61.69 63.84 3h6z s THR 869 Cb -0.14 -4.14 0.10 0.00 0.01 0.00 0.00 72.50 68.33 3h6z s THR 869 CO 0.19 -0.17 1.10 -2.16 -0.69 0.00 0.00 174.62 172.89 3h6z s PRO 870 N 2.93 1.62 0.74 4.92 0.04 -1.26 -3.96 135.00 140.04 3h6z s PRO 870 Ca 0.34 0.73 -0.13 0.00 0.04 0.00 0.00 61.00 61.99 3h6z s PRO 870 Cb -0.15 -1.86 0.05 0.00 0.04 0.00 0.00 34.50 32.58 3h6z s PRO 870 CO 0.10 -1.96 1.13 -2.14 0.04 0.00 0.00 177.00 174.17 3h6z s PRO 871 N -5.04 2.24 0.07 0.56 0.02 -1.26 -4.40 135.00 127.18 3h6z s PRO 871 Ca 0.62 1.44 -0.36 0.00 0.02 0.00 0.00 61.00 62.72 3h6z s PRO 871 Cb -0.16 -1.88 -0.16 0.00 0.02 0.00 0.00 34.50 32.32 3h6z s PRO 871 CO 0.56 -1.70 1.47 -1.71 -0.33 0.00 0.00 177.00 175.29 3h6z n ASN 872 N -3.06 2.21 0.00 2.53 4.05 -0.16 -1.13 115.26 119.70 3h6z n ASN 872 Ca 0.11 1.10 0.00 0.00 0.45 0.00 0.00 54.58 56.24 3h6z n ASN 872 Cb 0.52 -1.26 0.00 0.00 1.23 0.00 0.00 39.78 40.27 3h6z n ASN 872 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3h6z n GLY 873 N 3.00 1.11 3.99 8.20 0.00 -1.26 -5.03 105.19 115.20 3h6z n GLY 873 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 3h6z n GLY 873 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h6z s TYR 874 N -3.26 1.45 -0.04 1.61 1.51 -0.28 -5.13 117.35 113.20 3h6z s TYR 874 Ca 0.00 -0.77 0.01 0.00 -1.01 0.00 0.00 57.07 55.30 3h6z s TYR 874 Cb 0.00 -2.10 0.02 0.00 -0.11 0.00 0.00 41.96 39.77 3h6z s TYR 874 CO 0.00 -0.94 -0.05 0.34 -1.11 0.00 0.00 175.55 173.79 3h6z s ASP 875 N -4.54 0.97 0.22 2.29 -1.08 -1.26 -4.87 116.67 108.40 3h6z s ASP 875 Ca 0.52 -0.14 -0.09 0.00 -0.52 0.00 0.00 52.55 52.33 3h6z s ASP 875 Cb -0.04 -0.45 0.20 0.00 -1.46 0.00 0.00 42.92 41.17 3h6z s ASP 875 CO 0.33 -0.03 1.90 0.77 0.52 0.00 0.00 175.17 178.65 3h6z h SER 876 N 7.05 0.96 0.09 -0.34 4.64 -1.95 0.70 113.55 124.70 3h6z h SER 876 Ca -0.37 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 60.88 3h6z h SER 876 Cb 1.16 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.00 3h6z h SER 876 CO 0.48 0.69 -0.16 0.03 -0.87 0.00 0.00 176.83 177.00 3h6z h ARG 877 N 1.13 0.16 0.01 4.77 3.08 -1.98 -3.29 114.38 118.25 3h6z h ARG 877 Ca 0.31 -0.04 -0.36 0.00 0.07 0.00 0.00 59.98 59.96 3h6z h ARG 877 Cb -0.12 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.85 3h6z h ARG 877 CO -0.07 0.32 -2.28 2.41 -1.07 0.00 0.00 179.97 179.28 3h6z n THR 878 N -4.28 1.48 -1.70 2.04 -1.04 -0.73 -5.02 114.28 105.02 3h6z n THR 878 Ca -0.01 -0.77 -0.43 0.00 -2.04 0.00 0.00 64.05 60.80 3h6z n THR 878 Cb 0.27 -0.86 -0.02 0.00 -1.82 0.00 0.00 70.33 67.89 3h6z n THR 878 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 3h6z n PHE 879 N -2.97 2.49 -3.79 -1.42 7.35 0.24 -4.99 117.46 114.37 3h6z n PHE 879 Ca -0.33 0.32 -0.13 0.00 -0.76 0.00 0.00 57.45 56.54 3h6z n PHE 879 Cb 1.10 -2.54 -0.14 0.00 0.35 0.00 0.00 39.48 38.25 3h6z n PHE 879 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 3h6z s THR 880 N 0.13 -0.03 0.24 -2.13 -1.32 -1.26 -5.01 115.64 106.25 3h6z s THR 880 Ca 0.68 0.10 -0.07 0.00 -1.21 0.00 0.00 61.69 61.19 3h6z s THR 880 Cb -0.58 -0.19 0.21 0.00 -1.51 0.00 0.00 72.50 70.43 3h6z s THR 880 CO 0.47 0.04 1.87 -0.50 -2.21 0.00 0.00 174.62 174.30 3h6z h TRP 881 N 6.66 1.03 0.00 9.09 4.06 -1.98 -0.15 115.95 134.67 3h6z h TRP 881 Ca -0.35 0.03 -0.09 0.00 2.06 0.00 0.00 58.89 60.54 3h6z h TRP 881 Cb 1.17 -0.34 -0.01 0.00 -1.00 0.00 0.00 29.16 28.97 3h6z h TRP 881 CO 0.43 0.58 -0.42 0.93 -3.56 0.00 0.00 178.44 176.40 3h6z h GLU 882 N 1.06 0.00 -0.10 0.49 3.07 -1.99 0.18 114.58 117.30 3h6z h GLU 882 Ca 0.35 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 59.00 3h6z h GLU 882 Cb 0.03 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 27.96 3h6z h GLU 882 CO -0.13 0.42 -0.74 0.78 -1.40 0.00 0.00 179.01 177.94 3h6z h GLY 883 N 1.38 0.74 0.96 -3.84 0.00 -1.89 -2.89 103.07 97.53 3h6z h GLY 883 Ca -0.00 -1.12 -0.04 0.00 0.00 0.00 0.00 47.33 46.17 3h6z h GLY 883 CO 0.06 0.99 0.13 -1.82 0.00 0.00 0.00 176.54 175.90 3h6z h TYR 884 N 0.34 0.76 -0.49 5.60 3.20 -0.32 -1.49 116.97 124.57 3h6z h TYR 884 Ca -0.07 -0.08 -0.10 0.00 3.14 0.00 0.00 58.73 61.62 3h6z h TYR 884 Cb 1.39 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.43 3h6z h TYR 884 CO 0.10 0.68 -0.11 -0.07 -1.64 0.00 0.00 178.16 177.12 3h6z h LEU 885 N 0.61 0.89 -0.84 2.82 3.38 -0.77 -1.17 115.31 120.23 3h6z h LEU 885 Ca 0.15 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 3h6z h LEU 885 Cb 0.29 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3h6z h LEU 885 CO -0.00 1.01 -0.55 0.77 0.09 0.00 0.00 178.44 179.76 3h6z h SER 886 N 0.80 0.00 0.08 -0.43 4.64 -1.36 0.39 113.55 117.67 3h6z h SER 886 Ca 0.13 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3h6z h SER 886 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3h6z h SER 886 CO 0.04 0.55 -0.04 0.44 -0.87 0.00 0.00 176.83 176.96 3h6z h ASP 887 N 0.00 -0.09 0.59 4.97 3.32 -1.08 -3.30 116.42 120.83 3h6z h ASP 887 Ca -0.01 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.69 3h6z h ASP 887 Cb 1.02 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.59 3h6z h ASP 887 CO 0.07 0.32 -0.17 0.35 -1.72 0.00 0.00 179.24 178.10 3h6z n THR 888 N -4.95 0.00 -1.39 0.35 -2.24 -0.46 -4.90 114.28 100.69 3h6z n THR 888 Ca -0.08 -0.03 -0.14 0.00 -2.27 0.00 0.00 64.05 61.53 3h6z n THR 888 Cb 0.23 -0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.26 3h6z n THR 888 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h6z n GLY 889 N 1.40 1.35 3.95 3.38 0.00 0.11 -4.95 105.19 110.43 3h6z n GLY 889 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 3h6z n GLY 889 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6z s ALA 890 N -2.18 3.50 0.07 4.61 0.00 -1.14 -5.04 121.76 121.57 3h6z s ALA 890 Ca 0.00 -1.15 0.09 0.00 0.00 0.00 0.00 51.96 50.90 3h6z s ALA 890 Cb 0.00 -2.34 -0.03 0.00 0.00 0.00 0.00 23.12 20.75 3h6z s ALA 890 CO 0.00 -1.09 -0.24 0.54 0.00 0.00 0.00 175.76 174.97 3h6z s VAL 891 N -3.04 2.35 -0.14 0.00 0.11 -1.26 -4.83 120.40 113.59 3h6z s VAL 891 Ca 0.59 -1.44 -0.07 0.00 -2.93 0.00 0.00 61.98 58.13 3h6z s VAL 891 Cb -0.10 -1.97 -0.04 0.00 -1.53 0.00 0.00 36.38 32.73 3h6z s VAL 891 CO 0.42 0.28 0.10 0.00 -3.33 0.00 0.00 175.10 172.57 3h6z s ALA 892 N -0.91 3.65 0.28 1.54 0.00 -1.26 0.01 121.76 125.07 3h6z s ALA 892 Ca 0.13 -0.70 -0.30 0.00 0.00 0.00 0.00 51.96 51.09 3h6z s ALA 892 Cb -0.10 -1.93 -0.11 0.00 0.00 0.00 0.00 23.12 20.97 3h6z s ALA 892 CO 0.04 0.43 1.61 0.00 0.00 0.00 0.00 175.76 177.84 3h6z s ALA 893 N -0.42 3.77 0.51 0.00 0.00 -0.55 -4.87 121.76 120.20 3h6z s ALA 893 Ca 0.11 1.58 -0.20 0.00 0.00 0.00 0.00 51.96 53.45 3h6z s ALA 893 Cb -0.12 -3.66 -0.07 0.00 0.00 0.00 0.00 23.12 19.27 3h6z s ALA 893 CO 0.02 -0.98 1.08 0.20 0.00 0.00 0.00 175.76 176.07 3h6z s GLY 894 N 0.59 2.57 0.39 0.00 0.00 -1.26 -4.56 107.32 105.04 3h6z s GLY 894 Ca 0.65 0.70 0.22 0.00 0.00 0.00 0.00 44.72 46.29 3h6z s GLY 894 CO 0.46 1.04 1.62 1.46 0.00 0.00 0.00 173.10 177.68 3h6z h GLN 895 N 1.42 0.13 0.00 2.90 1.08 -1.97 -0.54 115.11 118.14 3h6z h GLN 895 Ca -0.50 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 3h6z h GLN 895 Cb 1.24 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 3h6z h GLN 895 CO 0.58 0.09 0.00 1.12 -0.95 0.00 0.00 178.83 179.67 3h6z h HIS 896 N 0.14 0.00 0.00 2.96 2.07 -2.03 -2.54 115.15 115.75 3h6z h HIS 896 Ca 0.80 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.32 3h6z h HIS 896 Cb 2.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.17 3h6z h HIS 896 CO -0.01 0.00 0.00 -0.07 -3.07 0.00 0.00 177.93 174.78 3h6z h LEU 897 N 0.00 0.00 -9.97 6.12 3.38 -1.46 -3.46 115.31 109.92 3h6z h LEU 897 Ca 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 3h6z h LEU 897 Cb 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3h6z h LEU 897 CO 0.00 0.00 -0.37 -0.36 0.09 0.00 0.00 178.44 177.80 3h6z s PHE 898 N -3.13 3.49 -0.25 1.13 0.40 -0.96 -4.93 117.98 113.73 3h6z s PHE 898 Ca 0.10 0.40 -0.29 0.00 -0.60 0.00 0.00 56.93 56.54 3h6z s PHE 898 Cb 0.11 -1.89 0.01 0.00 0.51 0.00 0.00 43.02 41.76 3h6z s PHE 898 CO 0.60 0.46 1.03 -1.58 0.70 0.00 0.00 175.22 176.44 3h6z s HIS 899 N -1.68 3.29 -0.55 0.36 5.65 -1.26 -4.97 115.29 116.13 3h6z s HIS 899 Ca 0.39 1.38 0.07 0.00 0.25 0.00 0.00 55.06 57.14 3h6z s HIS 899 Cb -0.12 -3.35 0.28 0.00 -1.18 0.00 0.00 32.58 28.20 3h6z s HIS 899 CO 0.27 -0.54 0.75 -3.47 -0.65 0.00 0.00 174.74 171.09 3h6z n ASP 900 N 6.43 2.96 -4.34 9.88 -0.08 -1.26 -4.98 116.55 125.16 3h6z n ASP 900 Ca 0.12 -3.31 -0.33 0.00 -1.51 0.00 0.00 54.79 49.75 3h6z n ASP 900 Cb 0.46 -0.64 -0.15 0.00 2.34 0.00 0.00 41.12 43.14 3h6z n ASP 900 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 3h6z s ILE 901 N -2.65 2.92 -0.53 5.18 -1.09 -1.26 -5.08 121.20 118.69 3h6z s ILE 901 Ca 0.41 -0.70 -0.11 0.00 -2.23 0.00 0.00 60.65 58.01 3h6z s ILE 901 Cb 0.20 -2.22 0.13 0.00 -1.58 0.00 0.00 42.46 38.99 3h6z s ILE 901 CO -0.06 0.52 0.43 -0.63 -1.23 0.00 0.00 174.94 173.97 3h6z s ILE 902 N 0.48 4.62 0.79 2.92 -1.09 -1.26 -4.92 121.20 122.74 3h6z s ILE 902 Ca -0.10 -1.79 -0.13 0.00 -2.23 0.00 0.00 60.65 56.39 3h6z s ILE 902 Cb -0.16 -4.00 0.08 0.00 -1.58 0.00 0.00 42.46 36.80 3h6z s ILE 902 CO 0.04 -0.83 1.20 -2.16 -1.23 0.00 0.00 174.94 171.97 3h6z s PRO 903 N 1.29 1.73 -1.37 2.79 0.04 -1.26 -4.89 135.00 133.33 3h6z s PRO 903 Ca 0.06 1.74 -0.11 0.00 0.04 0.00 0.00 61.00 62.73 3h6z s PRO 903 Cb -0.26 -1.79 0.10 0.00 0.04 0.00 0.00 34.50 32.59 3h6z s PRO 903 CO -0.00 -2.14 2.09 -3.47 0.04 0.00 0.00 177.00 173.52 3h6z n ASP 904 N -3.22 4.85 0.12 6.66 -0.08 -1.26 -4.79 116.55 118.83 3h6z n ASP 904 Ca 0.13 -2.98 -0.02 0.00 -1.51 0.00 0.00 54.79 50.41 3h6z n ASP 904 Cb 0.51 -1.55 0.13 0.00 2.34 0.00 0.00 41.12 42.54 3h6z n ASP 904 CO 0.00 0.00 0.00 1.12 0.12 0.00 0.00 177.20 178.44 3h6z h HIS 905 N 5.77 0.04 0.00 -0.67 2.07 -1.94 -3.47 115.15 116.94 3h6z h HIS 905 Ca 0.50 -0.02 0.00 0.00 -2.85 0.00 0.00 60.37 58.00 3h6z h HIS 905 Cb 0.60 -0.01 0.00 0.00 2.57 0.00 0.00 27.41 30.58 3h6z h HIS 905 CO 1.38 0.68 0.00 0.41 -3.07 0.00 0.00 177.93 177.33 3h6z n GLY 906 N 0.38 1.79 3.77 6.13 0.00 -1.26 -4.45 105.19 111.54 3h6z n GLY 906 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 3h6z n GLY 906 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h6z s PHE 907 N -3.04 2.99 0.06 1.61 0.40 -1.26 -4.95 117.98 113.78 3h6z s PHE 907 Ca 0.00 1.51 -0.11 0.00 -0.60 0.00 0.00 56.93 57.73 3h6z s PHE 907 Cb 0.00 -3.47 0.01 0.00 0.51 0.00 0.00 43.02 40.07 3h6z s PHE 907 CO 0.00 -1.55 0.25 -1.83 0.70 0.00 0.00 175.22 172.79 3h6z s GLU 908 N -2.29 0.79 0.20 0.44 -1.05 -1.26 -5.01 118.70 110.52 3h6z s GLU 908 Ca 0.57 -0.66 -0.33 0.00 -0.15 0.00 0.00 54.97 54.41 3h6z s GLU 908 Cb -0.33 0.34 -0.14 0.00 -0.44 0.00 0.00 34.13 33.56 3h6z s GLU 908 CO 0.41 -0.25 1.38 0.28 0.95 0.00 0.00 175.26 178.03 3h6z n VAL 909 N 0.42 0.68 0.00 1.83 0.31 -1.26 -2.19 118.33 118.12 3h6z n VAL 909 Ca -0.18 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 3h6z n VAL 909 Cb 0.60 -1.29 0.00 0.00 -0.91 0.00 0.00 33.84 32.24 3h6z n VAL 909 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h6z n GLY 910 N 2.39 0.70 3.73 2.92 0.00 -0.16 -5.01 105.19 109.76 3h6z n GLY 910 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3h6z n GLY 910 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h6z s MET 911 N -0.99 4.42 0.22 1.61 -1.94 -0.93 -4.54 119.30 117.14 3h6z s MET 911 Ca 0.00 1.93 -0.23 0.00 -1.71 0.00 0.00 55.69 55.68 3h6z s MET 911 Cb 0.00 -3.26 -0.08 0.00 2.01 0.00 0.00 34.83 33.50 3h6z s MET 911 CO 0.00 -0.25 0.78 -1.12 -0.01 0.00 0.00 175.02 174.43 3h6z s SER 912 N 0.64 7.23 0.31 3.03 0.01 0.29 -1.23 113.70 123.97 3h6z s SER 912 Ca 0.58 1.58 -0.20 0.00 1.31 0.00 0.00 55.95 59.22 3h6z s SER 912 Cb -0.34 -2.48 0.03 0.00 0.21 0.00 0.00 66.02 63.45 3h6z s SER 912 CO 0.34 0.09 0.74 -1.48 0.41 0.00 0.00 173.24 173.33 3h6z s LEU 913 N -1.67 -0.19 -0.10 2.44 2.34 0.01 -1.33 118.68 120.18 3h6z s LEU 913 Ca 0.41 -0.75 -0.02 0.00 0.06 0.00 0.00 54.13 53.84 3h6z s LEU 913 Cb -0.19 2.75 -0.03 0.00 -0.56 0.00 0.00 46.19 48.16 3h6z s LEU 913 CO 0.23 -1.43 -0.01 -1.61 -1.06 0.00 0.00 176.35 172.47 3h6z s GLU 914 N -3.50 3.15 -0.03 1.48 2.02 0.15 -0.95 118.70 121.03 3h6z s GLU 914 Ca 0.12 -0.44 -0.00 0.00 0.02 0.00 0.00 54.97 54.67 3h6z s GLU 914 Cb -0.06 -2.82 0.03 0.00 0.10 0.00 0.00 34.13 31.38 3h6z s GLU 914 CO 0.08 0.58 0.02 0.00 0.02 0.00 0.00 175.26 175.97 3h6z s ALA 916 N 1.27 3.30 -0.59 0.00 0.00 0.51 -0.48 121.76 125.77 3h6z s ALA 916 Ca -0.06 1.39 -0.20 0.00 0.00 0.00 0.00 51.96 53.09 3h6z s ALA 916 Cb -0.13 -3.55 0.09 0.00 0.00 0.00 0.00 23.12 19.53 3h6z s ALA 916 CO -0.03 -1.02 0.73 0.34 0.00 0.00 0.00 175.76 175.78 3h6z s ASP 917 N -0.54 6.19 0.37 0.00 3.68 -0.44 -4.90 116.67 121.03 3h6z s ASP 917 Ca 0.58 -1.27 0.26 0.00 2.13 0.00 0.00 52.55 54.25 3h6z s ASP 917 Cb -0.42 -2.32 1.29 0.00 -1.45 0.00 0.00 42.92 40.03 3h6z s ASP 917 CO 0.54 -1.13 1.79 -0.07 0.13 0.00 0.00 175.17 176.44 3h6z h LEU 918 N 10.14 0.00 0.00 -1.34 4.07 -1.93 0.30 115.31 126.56 3h6z h LEU 918 Ca -0.29 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.62 3h6z h LEU 918 Cb 1.09 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.82 3h6z h LEU 918 CO 1.09 0.00 -0.26 -0.03 -1.08 0.00 0.00 178.44 178.16 3h6z h MET 919 N 0.00 0.00 -1.46 1.13 4.05 -1.98 -3.39 114.93 113.27 3h6z h MET 919 Ca 0.00 0.00 -0.29 0.00 -0.28 0.00 0.00 59.70 59.13 3h6z h MET 919 Cb 0.15 0.00 -0.24 0.00 -0.80 0.00 0.00 31.60 30.71 3h6z h MET 919 CO 0.00 0.23 -0.65 0.34 0.23 0.00 0.00 176.91 177.06 3h6z s ASP 920 N -6.30 -0.45 0.00 1.39 3.68 0.95 -5.04 116.67 110.90 3h6z s ASP 920 Ca 0.05 -2.10 0.00 0.00 2.13 0.00 0.00 52.55 52.63 3h6z s ASP 920 Cb 0.06 1.12 0.00 0.00 -1.45 0.00 0.00 42.92 42.65 3h6z s ASP 920 CO 0.71 -0.10 0.77 -0.81 0.13 0.00 0.00 175.17 175.86 3h6z n PRO 921 N 3.04 0.91 0.06 4.34 -0.04 -0.57 -1.53 135.00 141.22 3h6z n PRO 921 Ca 0.21 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.79 3h6z n PRO 921 Cb 0.53 -1.15 0.22 0.00 -0.04 0.00 0.00 33.50 33.06 3h6z n PRO 921 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 3h6z n ARG 922 N -0.33 0.27 -3.16 0.54 1.85 -1.26 -4.67 116.66 109.90 3h6z n ARG 922 Ca 0.00 0.10 -0.39 0.00 -1.00 0.00 0.00 57.85 56.56 3h6z n ARG 922 Cb 0.07 -1.70 -0.06 0.00 -1.05 0.00 0.00 32.46 29.73 3h6z n ARG 922 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3h6z s LEU 923 N -4.21 4.24 -0.12 2.89 1.02 -0.58 -4.95 118.68 116.97 3h6z s LEU 923 Ca 0.07 0.93 0.02 0.00 0.02 0.00 0.00 54.13 55.17 3h6z s LEU 923 Cb 0.13 -2.88 -0.01 0.00 0.02 0.00 0.00 46.19 43.45 3h6z s LEU 923 CO 0.70 -0.14 -0.18 -0.69 0.02 0.00 0.00 176.35 176.06 3h6z s VAL 924 N 1.17 2.63 0.14 -1.59 1.01 -1.26 -1.32 120.40 121.17 3h6z s VAL 924 Ca 0.30 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.53 3h6z s VAL 924 Cb -0.16 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 3h6z s VAL 924 CO 0.13 0.54 -0.13 0.00 0.00 0.00 0.00 175.10 175.64 3h6z s VAL 926 N -2.56 2.30 0.07 0.00 1.01 0.10 -0.55 120.40 120.78 3h6z s VAL 926 Ca 0.13 0.12 -0.09 0.00 0.00 0.00 0.00 61.98 62.13 3h6z s VAL 926 Cb -0.02 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.28 3h6z s VAL 926 CO 0.03 0.01 0.20 0.00 0.00 0.00 0.00 175.10 175.34 3h6z s ALA 927 N 1.64 -0.30 0.04 5.51 0.00 -0.12 -2.75 121.76 125.76 3h6z s ALA 927 Ca 0.76 -0.46 0.06 0.00 0.00 0.00 0.00 51.96 52.32 3h6z s ALA 927 Cb -0.47 0.41 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 3h6z s ALA 927 CO 0.33 -0.45 -0.17 0.99 0.00 0.00 0.00 175.76 176.45 3h6z s THR 928 N -3.33 1.40 -0.56 0.00 2.01 0.43 -0.81 115.64 114.78 3h6z s THR 928 Ca 0.01 -1.07 -0.27 0.00 0.31 0.00 0.00 61.69 60.67 3h6z s THR 928 Cb 0.02 -1.23 -0.01 0.00 0.01 0.00 0.00 72.50 71.30 3h6z s THR 928 CO -0.08 0.14 1.69 -0.69 -0.69 0.00 0.00 174.62 174.98 3h6z s VAL 929 N -0.78 3.52 0.09 3.82 1.01 -0.36 -0.49 120.40 127.20 3h6z s VAL 929 Ca 0.05 0.39 0.04 0.00 0.00 0.00 0.00 61.98 62.46 3h6z s VAL 929 Cb -0.08 -4.10 -0.23 0.00 0.00 0.00 0.00 36.38 31.97 3h6z s VAL 929 CO 0.01 -0.97 1.16 0.00 0.00 0.00 0.00 175.10 175.31 3h6z h ALA 930 N 13.23 0.33 -2.63 5.51 0.00 -0.53 -0.40 119.26 134.77 3h6z h ALA 930 Ca -0.28 -0.97 -0.11 0.00 0.00 0.00 0.00 54.91 53.55 3h6z h ALA 930 Cb 1.14 -0.03 -0.23 0.00 0.00 0.00 0.00 17.79 18.67 3h6z h ALA 930 CO 1.18 1.22 -0.20 1.03 0.00 0.00 0.00 179.25 182.48 3h6z s ARG 931 N -2.68 0.56 -0.26 0.00 1.81 -0.81 -4.84 118.95 112.72 3h6z s ARG 931 Ca -0.01 0.45 0.00 0.00 -1.72 0.00 0.00 55.73 54.45 3h6z s ARG 931 Cb 0.09 0.27 0.07 0.00 -0.45 0.00 0.00 34.95 34.93 3h6z s ARG 931 CO 0.84 -0.09 0.00 0.54 -0.68 0.00 0.00 175.30 175.91 3h6z s VAL 932 N -0.10 1.36 -0.87 3.52 0.11 -1.26 -0.89 120.40 122.26 3h6z s VAL 932 Ca -0.03 -1.32 -0.06 0.00 -2.93 0.00 0.00 61.98 57.63 3h6z s VAL 932 Cb -0.03 -1.79 0.22 0.00 -1.53 0.00 0.00 36.38 33.25 3h6z s VAL 932 CO 0.02 -0.31 0.78 -0.69 -3.33 0.00 0.00 175.10 171.57 3h6z s VAL 933 N 1.44 4.89 0.00 2.04 1.01 0.13 -4.95 120.40 124.96 3h6z s VAL 933 Ca 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 61.98 58.72 3h6z s VAL 933 Cb -0.18 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.17 3h6z s VAL 933 CO -0.11 -1.05 0.00 0.61 0.00 0.00 0.00 175.10 174.55 3h6z n GLY 934 N 3.02 0.80 0.01 4.51 0.00 -1.26 -1.43 105.19 110.84 3h6z n GLY 934 Ca 0.17 0.46 0.11 0.00 0.00 0.00 0.00 46.02 46.76 3h6z n GLY 934 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3h6z n ARG 935 N 0.00 0.48 -3.98 1.61 0.63 -1.26 -4.95 116.66 109.19 3h6z n ARG 935 Ca 0.00 -0.12 -0.35 0.00 -0.92 0.00 0.00 57.85 56.46 3h6z n ARG 935 Cb 0.00 -1.54 -0.06 0.00 0.45 0.00 0.00 32.46 31.31 3h6z n ARG 935 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 3h6z s LEU 936 N -4.17 4.22 -0.03 6.15 2.96 -0.52 -2.02 118.68 125.27 3h6z s LEU 936 Ca -0.03 0.35 0.07 0.00 -0.22 0.00 0.00 54.13 54.31 3h6z s LEU 936 Cb 0.14 -2.21 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 3h6z s LEU 936 CO 0.89 0.35 -0.25 -0.76 -1.32 0.00 0.00 176.35 175.26 3h6z s LEU 937 N -1.34 2.12 -0.31 -0.68 1.43 -0.05 0.19 118.68 120.03 3h6z s LEU 937 Ca 0.19 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.73 3h6z s LEU 937 Cb -0.12 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 3h6z s LEU 937 CO 0.09 0.32 0.20 -0.75 0.23 0.00 0.00 176.35 176.43 3h6z s LYS 938 N -0.59 3.57 -0.13 1.70 2.20 -0.07 -1.12 119.74 125.30 3h6z s LYS 938 Ca 0.09 -0.58 -0.04 0.00 -0.36 0.00 0.00 55.97 55.08 3h6z s LYS 938 Cb -0.10 -3.68 -0.03 0.00 -1.51 0.00 0.00 37.83 32.50 3h6z s LYS 938 CO -0.00 -0.36 0.00 0.54 -0.36 0.00 0.00 175.35 175.17 3h6z s VAL 939 N 1.70 4.27 -0.09 4.02 0.11 -0.03 0.26 120.40 130.64 3h6z s VAL 939 Ca 0.06 -0.24 0.02 0.00 -2.93 0.00 0.00 61.98 58.89 3h6z s VAL 939 Cb -0.17 -2.85 -0.02 0.00 -1.53 0.00 0.00 36.38 31.81 3h6z s VAL 939 CO 0.09 0.53 -0.13 -2.28 -3.33 0.00 0.00 175.10 169.98 3h6z s HIS 940 N -0.13 2.78 -0.47 1.54 2.46 0.35 -1.25 115.29 120.56 3h6z s HIS 940 Ca 0.04 -0.34 -0.25 0.00 0.47 0.00 0.00 55.06 54.98 3h6z s HIS 940 Cb -0.13 -1.73 0.03 0.00 -0.13 0.00 0.00 32.58 30.62 3h6z s HIS 940 CO 0.02 0.04 0.93 -0.06 -2.47 0.00 0.00 174.74 173.20 3h6z s PHE 941 N -0.27 2.90 -0.41 3.88 0.40 -1.26 -0.43 117.98 122.79 3h6z s PHE 941 Ca 0.02 0.35 -0.43 0.00 -0.60 0.00 0.00 56.93 56.27 3h6z s PHE 941 Cb -0.13 -3.99 -0.18 0.00 0.51 0.00 0.00 43.02 39.23 3h6z s PHE 941 CO 0.03 -1.13 1.75 -0.25 0.70 0.00 0.00 175.22 176.32 3h6z n ASP 942 N 7.22 1.65 0.00 1.36 9.92 -1.11 -1.02 116.55 134.58 3h6z n ASP 942 Ca 0.06 1.05 0.00 0.00 -0.53 0.00 0.00 54.79 55.36 3h6z n ASP 942 Cb 0.48 -1.00 0.00 0.00 -0.64 0.00 0.00 41.12 39.96 3h6z n ASP 942 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3h6z n GLY 943 N 4.62 0.70 3.90 0.44 0.00 -1.26 -4.06 105.19 109.53 3h6z n GLY 943 Ca 0.33 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.14 3h6z n GLY 943 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h6z s TRP 944 N -2.46 2.78 1.12 1.61 0.52 -0.18 -4.44 118.94 117.89 3h6z s TRP 944 Ca 0.00 -0.42 -0.17 0.00 0.02 0.00 0.00 56.10 55.52 3h6z s TRP 944 Cb 0.00 -2.12 0.25 0.00 -1.15 0.00 0.00 33.47 30.45 3h6z s TRP 944 CO 0.00 -0.10 1.14 0.95 0.02 0.00 0.00 176.95 178.96 3h6z s THR 945 N -2.40 1.74 -0.28 2.01 -4.23 -1.26 -4.87 115.64 106.35 3h6z s THR 945 Ca 0.48 0.00 0.27 0.00 -1.18 0.00 0.00 61.69 61.26 3h6z s THR 945 Cb -0.05 -2.58 0.35 0.00 1.34 0.00 0.00 72.50 71.56 3h6z s THR 945 CO 0.29 0.00 1.76 0.44 -0.54 0.00 0.00 174.62 176.57 3h6z h ASP 946 N -2.27 0.00 0.72 3.99 3.45 -2.00 -3.22 116.42 117.09 3h6z h ASP 946 Ca -0.47 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.99 3h6z h ASP 946 Cb 1.29 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.06 3h6z h ASP 946 CO 0.40 0.00 0.00 -1.84 -1.57 0.00 0.00 179.24 176.23 3h6z n GLU 947 N -2.98 0.20 0.00 3.56 0.28 -1.26 -1.31 120.64 119.13 3h6z n GLU 947 Ca 0.03 0.43 0.14 0.00 -0.16 0.00 0.00 57.16 57.59 3h6z n GLU 947 Cb 0.43 -1.88 0.50 0.00 1.43 0.00 0.00 31.44 31.92 3h6z n GLU 947 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3h6z n TYR 948 N -2.25 0.00 -1.37 -1.84 4.02 -1.21 -4.77 117.16 109.73 3h6z n TYR 948 Ca 0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.56 3h6z n TYR 948 Cb 0.23 -0.08 0.10 0.00 -0.02 0.00 0.00 39.34 39.57 3h6z n TYR 948 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3h6z s ASP 949 N -2.27 4.00 -0.07 7.72 1.01 -0.43 -4.76 116.67 121.87 3h6z s ASP 949 Ca 0.32 2.48 0.01 0.00 0.71 0.00 0.00 52.55 56.07 3h6z s ASP 949 Cb 0.20 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.55 3h6z s ASP 949 CO 0.43 -2.40 -0.10 -1.10 0.21 0.00 0.00 175.17 172.22 3h6z s GLN 950 N -3.82 1.51 -0.35 8.23 -0.21 -0.38 -2.74 119.66 121.89 3h6z s GLN 950 Ca 0.77 -0.32 -0.29 0.00 0.02 0.00 0.00 55.36 55.54 3h6z s GLN 950 Cb -0.32 -1.36 0.02 0.00 1.00 0.00 0.00 33.01 32.34 3h6z s GLN 950 CO 0.46 -0.07 1.11 -1.58 -2.12 0.00 0.00 175.29 173.09 3h6z s TRP 951 N 1.00 3.03 0.07 0.91 0.52 0.79 -0.85 118.94 124.40 3h6z s TRP 951 Ca -0.09 1.07 0.05 0.00 0.02 0.00 0.00 56.10 57.16 3h6z s TRP 951 Cb -0.15 -3.86 -0.03 0.00 -1.15 0.00 0.00 33.47 28.29 3h6z s TRP 951 CO -0.00 -0.97 -0.15 -0.51 0.02 0.00 0.00 176.95 175.34 3h6z s LEU 952 N 3.89 2.25 0.52 2.99 1.02 -0.27 -4.92 118.68 124.16 3h6z s LEU 952 Ca 0.47 -0.59 -0.20 0.00 0.02 0.00 0.00 54.13 53.83 3h6z s LEU 952 Cb -0.12 -0.58 -0.06 0.00 0.02 0.00 0.00 46.19 45.45 3h6z s LEU 952 CO 0.19 -0.03 1.14 -0.62 0.02 0.00 0.00 176.35 177.05 3h6z s ASP 953 N -1.61 5.85 0.61 2.29 2.15 -1.26 -0.87 116.67 123.82 3h6z s ASP 953 Ca -0.00 2.21 0.32 0.00 0.43 0.00 0.00 52.55 55.51 3h6z s ASP 953 Cb -0.09 -2.59 1.85 0.00 -0.30 0.00 0.00 42.92 41.78 3h6z s ASP 953 CO 0.02 -1.13 2.18 0.00 -0.17 0.00 0.00 175.17 176.08 3h6z n GLU 955 N -3.62 3.88 -1.71 0.00 1.02 -1.26 -4.90 120.64 114.05 3h6z n GLU 955 Ca -0.01 -2.93 -0.42 0.00 -0.02 0.00 0.00 57.16 53.78 3h6z n GLU 955 Cb 0.21 -1.98 -0.00 0.00 -0.02 0.00 0.00 31.44 29.64 3h6z n GLU 955 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3h6z n SER 956 N 0.36 2.81 -0.57 1.62 2.88 0.08 -4.89 113.62 115.90 3h6z n SER 956 Ca 0.24 1.19 0.05 0.00 -1.33 0.00 0.00 58.87 59.02 3h6z n SER 956 Cb 0.98 -1.50 0.14 0.00 -0.75 0.00 0.00 64.21 63.08 3h6z n SER 956 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h6z n ALA 957 N 0.22 2.45 1.04 -1.46 0.00 -1.26 -3.74 120.51 117.76 3h6z n ALA 957 Ca 0.05 -0.54 0.12 0.00 0.00 0.00 0.00 53.44 53.07 3h6z n ALA 957 Cb 0.37 -0.98 0.21 0.00 0.00 0.00 0.00 19.45 19.05 3h6z n ALA 957 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3h6z n ASP 958 N 0.40 2.70 -4.40 0.00 10.43 -1.26 -4.75 116.55 119.66 3h6z n ASP 958 Ca 0.10 -1.89 -0.31 0.00 2.57 0.00 0.00 54.79 55.27 3h6z n ASP 958 Cb 0.26 -0.03 -0.14 0.00 1.84 0.00 0.00 41.12 43.05 3h6z n ASP 958 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 3h6z s ILE 959 N -1.94 2.52 0.02 0.53 -4.36 -1.25 -0.36 121.20 116.36 3h6z s ILE 959 Ca 0.31 -1.18 -0.06 0.00 -0.26 0.00 0.00 60.65 59.46 3h6z s ILE 959 Cb 0.20 -2.01 -0.01 0.00 1.25 0.00 0.00 42.46 41.90 3h6z s ILE 959 CO 0.31 0.41 0.10 -0.31 0.24 0.00 0.00 174.94 175.69 3h6z s TYR 960 N -0.82 0.13 0.58 1.37 1.51 0.17 -4.90 117.35 115.38 3h6z s TYR 960 Ca 0.13 -0.31 -0.19 0.00 -1.01 0.00 0.00 57.07 55.68 3h6z s TYR 960 Cb -0.10 -0.10 -0.04 0.00 -0.11 0.00 0.00 41.96 41.61 3h6z s TYR 960 CO 0.03 -0.30 1.20 -2.14 -1.11 0.00 0.00 175.55 173.23 3h6z s PRO 961 N -1.80 3.06 0.18 -1.71 0.02 -1.26 0.31 135.00 133.79 3h6z s PRO 961 Ca -0.12 1.82 -0.32 0.00 0.02 0.00 0.00 61.00 62.40 3h6z s PRO 961 Cb -0.06 -1.98 -0.11 0.00 0.02 0.00 0.00 34.50 32.37 3h6z s PRO 961 CO -0.01 -1.13 1.73 0.14 -0.33 0.00 0.00 177.00 177.40 3h6z s VAL 962 N -1.60 2.25 0.00 3.83 -7.23 -1.26 -1.36 120.40 115.04 3h6z s VAL 962 Ca 0.76 0.09 0.00 0.00 -1.81 0.00 0.00 61.98 61.02 3h6z s VAL 962 Cb -0.30 -3.06 0.00 0.00 0.56 0.00 0.00 36.38 33.58 3h6z s VAL 962 CO 0.33 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.73 3h6z n GLY 963 N 4.02 0.63 0.24 2.32 0.00 -1.26 -0.76 105.19 110.38 3h6z n GLY 963 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 3h6z n GLY 963 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3h6z h TRP 964 N 0.00 -0.52 -0.37 1.61 7.01 -1.57 -2.38 115.95 119.73 3h6z h TRP 964 Ca 0.00 0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.08 3h6z h TRP 964 Cb 0.00 0.21 -0.09 0.00 -2.10 0.00 0.00 29.16 27.18 3h6z h TRP 964 CO 0.00 -0.30 -0.25 0.00 -2.79 0.00 0.00 178.44 175.10 3h6z h VAL 966 N -0.20 1.18 0.85 0.00 3.04 -1.74 0.40 116.25 119.78 3h6z h VAL 966 Ca 0.18 -0.49 -0.04 0.00 -1.01 0.00 0.00 66.70 65.34 3h6z h VAL 966 Cb 0.48 0.41 0.01 0.00 -2.01 0.00 0.00 31.29 30.18 3h6z h VAL 966 CO -0.48 0.21 -0.41 0.25 -1.01 0.00 0.00 177.57 176.13 3h6z h LEU 967 N 0.82 -0.97 -1.07 3.16 6.46 -0.59 -3.13 115.31 119.99 3h6z h LEU 967 Ca 0.21 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 58.00 3h6z h LEU 967 Cb 0.05 0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.23 3h6z h LEU 967 CO -0.03 -0.68 0.00 0.58 -0.62 0.00 0.00 178.44 177.69 3h6z h VAL 968 N -1.17 0.00 -2.97 1.05 2.07 -0.81 -3.47 116.25 110.96 3h6z h VAL 968 Ca -0.12 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 66.93 3h6z h VAL 968 Cb 0.87 1.31 0.03 0.00 -1.52 0.00 0.00 31.29 31.99 3h6z h VAL 968 CO 0.19 0.00 -0.15 -3.20 0.02 0.00 0.00 177.57 174.43 3h6z n ASN 969 N -2.73 -2.31 -4.19 0.57 5.15 0.12 -4.32 115.26 107.55 3h6z n ASN 969 Ca 0.01 -0.13 -0.25 0.00 -0.60 0.00 0.00 54.58 53.62 3h6z n ASN 969 Cb 0.29 -1.40 -0.15 0.00 -0.53 0.00 0.00 39.78 37.99 3h6z n ASN 969 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 3h6z s HIS 970 N -3.07 1.66 0.29 1.20 2.46 -0.12 -4.89 115.29 112.82 3h6z s HIS 970 Ca 0.03 -0.32 -0.30 0.00 0.47 0.00 0.00 55.06 54.94 3h6z s HIS 970 Cb -0.00 -1.05 -0.11 0.00 -0.13 0.00 0.00 32.58 31.28 3h6z s HIS 970 CO 0.14 -0.01 1.57 0.21 -2.47 0.00 0.00 174.74 174.18 3h6z s LYS 971 N -0.57 4.14 -0.20 2.88 2.20 -1.26 -4.37 119.74 122.56 3h6z s LYS 971 Ca 0.07 2.54 -0.04 0.00 -0.36 0.00 0.00 55.97 58.18 3h6z s LYS 971 Cb -0.07 -3.03 -0.01 0.00 -1.51 0.00 0.00 37.83 33.20 3h6z s LYS 971 CO -0.00 -0.60 -0.04 -1.17 -0.36 0.00 0.00 175.35 173.18 3h6z s LEU 972 N -0.54 2.99 -0.05 5.43 2.96 -1.26 -4.32 118.68 123.88 3h6z s LEU 972 Ca 0.62 -0.31 -0.26 0.00 -0.22 0.00 0.00 54.13 53.96 3h6z s LEU 972 Cb -0.47 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.44 3h6z s LEU 972 CO 0.48 0.04 0.81 -1.61 -1.32 0.00 0.00 176.35 174.75 3h6z s GLU 973 N 1.11 4.47 0.58 1.98 0.41 -0.28 -0.88 118.70 126.08 3h6z s GLU 973 Ca 0.02 1.09 0.05 0.00 -0.41 0.00 0.00 54.97 55.71 3h6z s GLU 973 Cb -0.15 -3.47 0.10 0.00 -1.78 0.00 0.00 34.13 28.84 3h6z s GLU 973 CO -0.00 -0.02 0.79 0.41 -0.49 0.00 0.00 175.26 175.95 3h6z n GLY 974 N 3.07 1.40 3.66 -1.39 0.00 -1.26 -0.73 105.19 109.94 3h6z n GLY 974 Ca 0.02 -2.13 -0.41 0.00 0.00 0.00 0.00 46.02 43.50 3h6z n GLY 974 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h6z n PRO 975 N -2.36 1.63 -2.54 1.61 -0.04 -1.26 -4.81 135.00 127.24 3h6z n PRO 975 Ca 0.15 0.59 -0.38 0.00 -0.04 0.00 0.00 63.50 63.82 3h6z n PRO 975 Cb 0.53 -2.24 -0.04 0.00 -0.04 0.00 0.00 33.50 31.71 3h6z n PRO 975 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3h6z s PRO 976 N -2.18 4.34 0.00 0.54 0.04 -1.26 -5.06 135.00 131.42 3h6z s PRO 976 Ca 0.63 1.59 0.00 0.00 0.04 0.00 0.00 61.00 63.26 3h6z s PRO 976 Cb -0.52 -2.77 0.00 0.00 0.04 0.00 0.00 34.50 31.25 3h6z s PRO 976 CO 0.57 0.00 0.00 0.54 0.04 0.00 0.00 177.00 178.15