#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hmp s ILE 518 N -3.07 0.77 -0.09 0.00 1.01 -0.09 -4.98 121.20 114.75 3hmp s ILE 518 Ca -0.01 -0.39 -0.03 0.00 0.00 0.00 0.00 60.65 60.21 3hmp s ILE 518 Cb 0.01 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 3hmp s ILE 518 CO -0.07 0.23 0.05 -0.55 0.00 0.00 0.00 174.94 174.61 3hmp s SER 519 N -0.06 5.64 -0.15 3.58 0.15 -1.26 -0.45 113.70 121.16 3hmp s SER 519 Ca 0.01 0.25 -0.04 0.00 0.70 0.00 0.00 55.95 56.87 3hmp s SER 519 Cb -0.06 -1.68 0.07 0.00 -1.71 0.00 0.00 66.02 62.65 3hmp s SER 519 CO -0.00 0.38 0.17 -0.69 1.20 0.00 0.00 173.24 174.30 3hmp s VAL 520 N -0.96 -0.25 -1.46 4.45 1.01 -0.04 -4.88 120.40 118.27 3hmp s VAL 520 Ca 0.15 0.07 -0.07 0.00 0.00 0.00 0.00 61.98 62.12 3hmp s VAL 520 Cb -0.12 -0.50 0.05 0.00 0.00 0.00 0.00 36.38 35.81 3hmp s VAL 520 CO 0.04 -0.08 0.76 0.29 0.00 0.00 0.00 175.10 176.12 3hmp n LYS 521 N 5.31 -4.63 0.00 2.72 4.76 -1.26 -2.00 118.16 123.06 3hmp n LYS 521 Ca -0.05 0.54 0.00 0.00 -2.87 0.00 0.00 58.31 55.93 3hmp n LYS 521 Cb 0.50 -5.16 0.00 0.00 -1.84 0.00 0.00 35.03 28.53 3hmp n LYS 521 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hmp n GLY 522 N -1.68 2.89 3.74 0.72 0.00 -1.26 -5.02 105.19 104.58 3hmp n GLY 522 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 3hmp n GLY 522 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hmp s ARG 523 N -0.13 4.42 -0.10 1.61 0.52 -0.85 -5.03 118.95 119.38 3hmp s ARG 523 Ca 0.00 0.90 -0.12 0.00 -0.52 0.00 0.00 55.73 55.98 3hmp s ARG 523 Cb 0.00 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 32.04 3hmp s ARG 523 CO 0.00 0.25 0.29 0.42 0.02 0.00 0.00 175.30 176.29 3hmp s ILE 524 N 0.13 5.27 -0.07 1.52 1.09 -1.26 -0.86 121.20 127.01 3hmp s ILE 524 Ca 0.36 0.56 0.03 0.00 -1.10 0.00 0.00 60.65 60.49 3hmp s ILE 524 Cb -0.19 -3.60 0.01 0.00 -1.06 0.00 0.00 42.46 37.62 3hmp s ILE 524 CO 0.20 0.51 -0.14 -0.31 -0.10 0.00 0.00 174.94 175.10 3hmp s TYR 525 N -0.43 1.63 -0.03 3.97 2.02 0.40 -3.84 117.35 121.08 3hmp s TYR 525 Ca 0.18 -0.61 -0.14 0.00 -0.37 0.00 0.00 57.07 56.13 3hmp s TYR 525 Cb -0.14 -1.17 -0.05 0.00 -0.40 0.00 0.00 41.96 40.20 3hmp s TYR 525 CO 0.07 -0.30 0.38 -1.54 -1.57 0.00 0.00 175.55 172.59 3hmp s SER 526 N 0.61 6.74 -0.06 2.29 1.04 -0.45 -0.92 113.70 122.95 3hmp s SER 526 Ca -0.15 0.88 -0.23 0.00 0.48 0.00 0.00 55.95 56.93 3hmp s SER 526 Cb -0.16 -2.23 -0.04 0.00 0.10 0.00 0.00 66.02 63.69 3hmp s SER 526 CO 0.05 0.30 0.68 -0.63 0.98 0.00 0.00 173.24 174.62 3hmp s ILE 527 N -0.88 5.05 -0.18 -1.02 1.01 -0.79 -0.95 121.20 123.43 3hmp s ILE 527 Ca 0.23 1.41 -0.10 0.00 0.00 0.00 0.00 60.65 62.18 3hmp s ILE 527 Cb -0.16 -4.02 -0.21 0.00 0.01 0.00 0.00 42.46 38.07 3hmp s ILE 527 CO 0.12 0.27 0.16 0.18 0.00 0.00 0.00 174.94 175.66 3hmp n LEU 528 N 3.71 2.40 -3.77 2.97 4.77 0.65 -4.82 117.00 122.91 3hmp n LEU 528 Ca -0.02 0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 56.16 3hmp n LEU 528 Cb 0.51 -1.02 -0.01 0.00 -2.33 0.00 0.00 43.42 40.58 3hmp n LEU 528 CO 0.47 0.68 0.74 -1.59 -1.33 0.00 0.00 177.39 176.35 3hmp s LYS 529 N -2.49 1.21 -0.19 3.23 -2.85 -1.17 -5.01 119.74 112.47 3hmp s LYS 529 Ca -0.28 -0.69 -0.17 0.00 -1.00 0.00 0.00 55.97 53.83 3hmp s LYS 529 Cb 0.08 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 36.21 3hmp s LYS 529 CO 0.66 -0.56 0.45 -1.14 0.10 0.00 0.00 175.35 174.87 3hmp s GLN 530 N -3.12 4.20 -0.15 1.78 0.74 -1.26 -0.64 119.66 121.21 3hmp s GLN 530 Ca 0.13 0.31 -0.12 0.00 0.05 0.00 0.00 55.36 55.73 3hmp s GLN 530 Cb -0.01 -3.53 -0.07 0.00 1.10 0.00 0.00 33.01 30.49 3hmp s GLN 530 CO 0.03 -0.04 -0.04 0.82 -0.55 0.00 0.00 175.29 175.50 3hmp h ILE 531 N 5.01 0.27 -3.07 -2.34 2.04 -1.29 -3.47 117.51 114.65 3hmp h ILE 531 Ca -0.36 -1.33 -0.62 0.00 1.00 0.00 0.00 64.86 63.56 3hmp h ILE 531 Cb 1.16 0.63 -0.09 0.00 -0.74 0.00 0.00 36.82 37.78 3hmp h ILE 531 CO 0.73 0.09 -0.40 -0.83 0.00 0.00 0.00 178.15 177.74 3hmp s GLY 532 N -4.34 2.17 0.06 5.37 0.00 -0.39 -4.91 107.32 105.28 3hmp s GLY 532 Ca -0.17 -0.55 0.09 0.00 0.00 0.00 0.00 44.72 44.09 3hmp s GLY 532 CO 0.31 0.09 -0.25 -0.56 0.00 0.00 0.00 173.10 172.69 3hmp s SER 533 N -0.15 2.97 0.54 1.64 0.01 -1.26 -1.97 113.70 115.47 3hmp s SER 533 Ca 0.14 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 56.80 3hmp s SER 533 Cb -0.13 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.86 3hmp s SER 533 CO 0.03 0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.50 3hmp n GLY 534 N 1.62 -3.35 1.56 3.44 0.00 -1.26 -4.90 105.19 102.29 3hmp n GLY 534 Ca -0.17 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3hmp n GLY 534 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hmp n GLY 535 N -3.88 -2.70 0.00 -0.02 0.00 -1.26 -4.11 105.19 93.22 3hmp n GLY 535 Ca -0.08 -1.79 0.08 0.00 0.00 0.00 0.00 46.02 44.24 3hmp n GLY 535 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hmp n SER 536 N -0.06 0.00 -4.27 1.61 3.41 -1.26 -4.74 113.62 108.30 3hmp n SER 536 Ca 0.00 -0.27 -0.32 0.00 -0.26 0.00 0.00 58.87 58.02 3hmp n SER 536 Cb 0.00 -0.13 -0.16 0.00 -0.26 0.00 0.00 64.21 63.66 3hmp n SER 536 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3hmp s SER 537 N -2.26 3.20 0.06 4.04 0.15 -1.26 -0.69 113.70 116.94 3hmp s SER 537 Ca 0.21 -0.50 0.05 0.00 0.70 0.00 0.00 55.95 56.41 3hmp s SER 537 Cb 0.12 -1.07 -0.03 0.00 -1.71 0.00 0.00 66.02 63.33 3hmp s SER 537 CO 0.23 0.22 -0.13 -0.54 1.20 0.00 0.00 173.24 174.22 3hmp s LYS 538 N -0.01 0.78 -0.08 5.44 1.02 0.36 -4.13 119.74 123.13 3hmp s LYS 538 Ca -0.08 -0.88 0.05 0.00 0.02 0.00 0.00 55.97 55.08 3hmp s LYS 538 Cb -0.15 -0.74 -0.01 0.00 -0.52 0.00 0.00 37.83 36.41 3hmp s LYS 538 CO 0.05 0.17 -0.23 0.08 -0.92 0.00 0.00 175.35 174.50 3hmp s VAL 539 N -1.22 2.21 0.03 3.17 1.01 -0.83 0.30 120.40 125.07 3hmp s VAL 539 Ca -0.03 -0.99 0.09 0.00 0.00 0.00 0.00 61.98 61.04 3hmp s VAL 539 Cb -0.10 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 3hmp s VAL 539 CO 0.02 0.56 -0.25 -0.36 0.00 0.00 0.00 175.10 175.07 3hmp s PHE 540 N 0.02 2.22 -0.12 5.22 0.08 -0.04 -0.79 117.98 124.57 3hmp s PHE 540 Ca -0.08 -0.41 -0.22 0.00 0.12 0.00 0.00 56.93 56.34 3hmp s PHE 540 Cb -0.15 -1.35 -0.03 0.00 -0.57 0.00 0.00 43.02 40.91 3hmp s PHE 540 CO 0.05 0.08 0.66 -1.14 -0.10 0.00 0.00 175.22 174.77 3hmp s GLN 541 N -1.07 4.35 0.16 0.44 0.74 0.19 -0.37 119.66 124.09 3hmp s GLN 541 Ca 0.11 0.75 -0.02 0.00 0.05 0.00 0.00 55.36 56.25 3hmp s GLN 541 Cb -0.10 -3.49 -0.04 0.00 1.10 0.00 0.00 33.01 30.48 3hmp s GLN 541 CO 0.01 -0.04 0.11 0.14 -0.55 0.00 0.00 175.29 174.96 3hmp s VAL 542 N 1.21 0.06 -0.02 1.34 -7.23 -0.00 -0.25 120.40 115.51 3hmp s VAL 542 Ca 0.33 -1.87 0.04 0.00 -1.81 0.00 0.00 61.98 58.67 3hmp s VAL 542 Cb -0.17 -2.17 -0.01 0.00 0.56 0.00 0.00 36.38 34.60 3hmp s VAL 542 CO 0.14 -0.29 -0.15 -0.76 -0.31 0.00 0.00 175.10 173.73 3hmp s LEU 543 N -3.07 1.95 0.00 1.32 1.43 -0.13 -0.86 118.68 119.32 3hmp s LEU 543 Ca 0.28 -0.28 -0.17 0.00 -1.03 0.00 0.00 54.13 52.93 3hmp s LEU 543 Cb 0.07 -0.80 0.22 0.00 0.03 0.00 0.00 46.19 45.71 3hmp s LEU 543 CO 0.05 0.16 1.30 -0.46 0.23 0.00 0.00 176.35 177.63 3hmp n ASN 544 N 2.94 0.01 0.27 2.29 0.23 -0.38 -1.34 115.26 119.27 3hmp n ASN 544 Ca -0.16 -1.46 0.14 0.00 -0.53 0.00 0.00 54.58 52.56 3hmp n ASN 544 Cb 0.54 -1.00 0.76 0.00 -2.08 0.00 0.00 39.78 38.00 3hmp n ASN 544 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3hmp h GLU 545 N 0.00 0.00 -0.24 -3.83 4.11 -1.91 0.13 114.58 112.84 3hmp h GLU 545 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.01 3hmp h GLU 545 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3hmp h GLU 545 CO 0.30 0.10 0.00 1.63 0.07 0.00 0.00 179.01 181.11 3hmp n LYS 546 N -3.60 1.52 -2.13 1.06 5.02 -1.26 -4.91 118.16 113.87 3hmp n LYS 546 Ca -0.02 -0.78 -0.18 0.00 -2.02 0.00 0.00 58.31 55.31 3hmp n LYS 546 Cb 0.22 -1.19 -0.03 0.00 -0.02 0.00 0.00 35.03 34.02 3hmp n LYS 546 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3hmp n LYS 547 N 0.13 -1.42 -2.82 1.97 4.76 0.46 -5.00 118.16 116.24 3hmp n LYS 547 Ca 0.07 0.96 -0.40 0.00 -2.87 0.00 0.00 58.31 56.07 3hmp n LYS 547 Cb 0.19 -5.42 -0.05 0.00 -1.84 0.00 0.00 35.03 27.91 3hmp n LYS 547 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3hmp s GLN 548 N -4.54 4.66 0.19 1.97 -0.21 -1.26 -4.80 119.66 115.68 3hmp s GLN 548 Ca 0.00 1.33 -0.23 0.00 0.02 0.00 0.00 55.36 56.48 3hmp s GLN 548 Cb 0.00 -3.34 -0.08 0.00 1.00 0.00 0.00 33.01 30.59 3hmp s GLN 548 CO 0.00 0.33 0.76 -1.50 -2.12 0.00 0.00 175.29 172.75 3hmp s ILE 549 N -0.36 4.45 0.14 1.08 2.07 -1.26 -1.25 121.20 126.07 3hmp s ILE 549 Ca 0.43 1.53 -0.08 0.00 -1.41 0.00 0.00 60.65 61.11 3hmp s ILE 549 Cb -0.23 -4.02 -0.01 0.00 0.13 0.00 0.00 42.46 38.34 3hmp s ILE 549 CO 0.28 0.39 0.24 -0.31 -1.91 0.00 0.00 174.94 173.63 3hmp s TYR 550 N -1.31 0.35 -0.18 3.50 2.02 -0.04 -4.64 117.35 117.05 3hmp s TYR 550 Ca 0.39 -0.74 -0.06 0.00 -0.37 0.00 0.00 57.07 56.29 3hmp s TYR 550 Cb -0.20 -0.08 -0.04 0.00 -0.40 0.00 0.00 41.96 41.24 3hmp s TYR 550 CO 0.24 -0.66 0.03 0.00 -1.57 0.00 0.00 175.55 173.59 3hmp s ALA 551 N -3.94 3.25 -0.29 3.71 0.00 0.28 -0.82 121.76 123.96 3hmp s ALA 551 Ca 0.14 -0.82 -0.09 0.00 0.00 0.00 0.00 51.96 51.19 3hmp s ALA 551 Cb 0.04 -1.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.31 3hmp s ALA 551 CO -0.03 0.10 0.12 0.42 0.00 0.00 0.00 175.76 176.37 3hmp s ILE 552 N 0.53 4.51 -0.14 0.00 1.01 0.50 -0.24 121.20 127.39 3hmp s ILE 552 Ca 0.01 -0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.13 3hmp s ILE 552 Cb -0.13 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.08 3hmp s ILE 552 CO 0.02 0.18 0.70 -0.75 0.00 0.00 0.00 174.94 175.08 3hmp s LYS 553 N 1.62 4.32 -0.17 2.79 2.20 0.59 -0.86 119.74 130.23 3hmp s LYS 553 Ca 0.05 0.81 -0.01 0.00 -0.36 0.00 0.00 55.97 56.45 3hmp s LYS 553 Cb -0.16 -3.52 -0.01 0.00 -1.51 0.00 0.00 37.83 32.63 3hmp s LYS 553 CO 0.05 -0.13 -0.11 -0.47 -0.36 0.00 0.00 175.35 174.34 3hmp s TYR 554 N 1.49 2.86 -0.12 4.03 5.04 0.15 -0.07 117.35 130.73 3hmp s TYR 554 Ca 0.34 -0.92 0.02 0.00 -2.44 0.00 0.00 57.07 54.07 3hmp s TYR 554 Cb -0.17 -1.96 -0.00 0.00 0.35 0.00 0.00 41.96 40.18 3hmp s TYR 554 CO 0.14 -0.44 -0.20 0.08 -1.34 0.00 0.00 175.55 173.78 3hmp s VAL 555 N 0.96 2.30 -0.25 3.14 1.01 0.03 -0.48 120.40 127.10 3hmp s VAL 555 Ca -0.02 -0.92 -0.22 0.00 0.00 0.00 0.00 61.98 60.83 3hmp s VAL 555 Cb -0.15 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 3hmp s VAL 555 CO -0.01 0.54 0.71 0.21 0.00 0.00 0.00 175.10 176.56 3hmp s ASN 556 N 0.53 6.68 0.00 3.32 3.84 0.13 -0.87 114.94 128.58 3hmp s ASN 556 Ca -0.13 0.84 0.22 0.00 0.21 0.00 0.00 52.86 54.01 3hmp s ASN 556 Cb -0.17 -2.38 0.51 0.00 -0.55 0.00 0.00 41.25 38.67 3hmp s ASN 556 CO 0.04 -0.43 1.44 0.18 -2.79 0.00 0.00 177.10 175.55 3hmp n LEU 557 N 5.83 2.92 -0.10 3.21 4.77 -0.09 -4.64 117.00 128.89 3hmp n LEU 557 Ca 0.02 -1.25 0.06 0.00 -0.03 0.00 0.00 56.01 54.81 3hmp n LEU 557 Cb 0.48 -0.21 0.40 0.00 -2.33 0.00 0.00 43.42 41.77 3hmp n LEU 557 CO 0.45 0.63 1.19 -0.33 -1.33 0.00 0.00 177.39 178.00 3hmp h GLU 558 N 3.78 0.61 -0.46 3.23 3.07 -1.82 -2.63 114.58 120.35 3hmp h GLU 558 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3hmp h GLU 558 Cb 0.83 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 3hmp h GLU 558 CO 0.00 0.40 0.00 0.39 -1.40 0.00 0.00 179.01 178.40 3hmp n GLU 559 N -4.47 3.35 -3.27 2.33 1.02 -1.26 -4.98 120.64 113.36 3hmp n GLU 559 Ca 0.08 -2.68 -0.39 0.00 -0.02 0.00 0.00 57.16 54.14 3hmp n GLU 559 Cb 0.18 -1.74 -0.07 0.00 -0.02 0.00 0.00 31.44 29.79 3hmp n GLU 559 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hmp s ALA 560 N -1.96 3.57 1.07 0.62 0.00 -0.99 -5.07 121.76 118.99 3hmp s ALA 560 Ca 0.42 -0.53 -0.16 0.00 0.00 0.00 0.00 51.96 51.68 3hmp s ALA 560 Cb 0.28 -2.81 0.22 0.00 0.00 0.00 0.00 23.12 20.81 3hmp s ALA 560 CO 0.17 -0.57 1.15 0.16 0.00 0.00 0.00 175.76 176.68 3hmp s ASP 561 N 1.34 2.12 0.21 0.00 1.47 -1.26 -4.75 116.67 115.80 3hmp s ASP 561 Ca 0.21 0.73 -0.04 0.00 1.18 0.00 0.00 52.55 54.64 3hmp s ASP 561 Cb -0.15 -1.08 0.19 0.00 -0.34 0.00 0.00 42.92 41.53 3hmp s ASP 561 CO 0.09 -3.39 1.62 0.78 0.68 0.00 0.00 175.17 174.94 3hmp h ASN 562 N -2.08 0.75 -0.48 2.11 2.35 -1.98 -0.30 115.58 115.95 3hmp h ASN 562 Ca -0.48 -0.29 -0.03 0.00 -0.55 0.00 0.00 56.30 54.96 3hmp h ASN 562 Cb 1.30 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.44 3hmp h ASN 562 CO 0.45 0.98 0.19 -0.61 -1.65 0.00 0.00 177.43 176.79 3hmp h GLN 563 N 0.63 0.72 0.34 0.81 4.15 -1.98 0.22 115.11 120.00 3hmp h GLN 563 Ca 0.08 -0.13 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 3hmp h GLN 563 Cb 0.78 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.36 3hmp h GLN 563 CO 0.06 0.65 -0.17 1.15 -1.93 0.00 0.00 178.83 178.60 3hmp h THR 564 N 0.63 0.66 -0.57 2.39 2.02 -1.86 -2.04 112.91 114.14 3hmp h THR 564 Ca 0.16 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.45 3hmp h THR 564 Cb 0.20 0.66 -0.09 0.00 -1.74 0.00 0.00 68.15 67.18 3hmp h THR 564 CO -0.01 0.00 0.02 -0.07 0.37 0.00 0.00 175.52 175.83 3hmp h LEU 565 N -0.46 -0.20 -1.21 2.58 3.38 -0.87 -1.99 115.31 116.53 3hmp h LEU 565 Ca -0.05 0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.07 3hmp h LEU 565 Cb 0.35 0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 3hmp h LEU 565 CO 0.08 -0.08 0.54 0.44 0.09 0.00 0.00 178.44 179.51 3hmp h ASP 566 N 0.14 0.91 -0.12 -0.43 3.32 -0.38 -1.54 116.42 118.32 3hmp h ASP 566 Ca 0.29 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.23 3hmp h ASP 566 Cb 0.46 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3hmp h ASP 566 CO -0.46 0.65 -0.22 0.77 -1.72 0.00 0.00 179.24 178.25 3hmp h SER 567 N 1.07 0.55 -0.19 6.45 4.64 -0.66 -1.70 113.55 123.70 3hmp h SER 567 Ca 0.31 -0.18 -0.05 0.00 -0.47 0.00 0.00 61.79 61.40 3hmp h SER 567 Cb -0.07 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 3hmp h SER 567 CO -0.08 0.77 -0.07 1.88 -0.87 0.00 0.00 176.83 178.47 3hmp h TYR 568 N 0.49 0.42 -0.47 4.77 -1.99 -0.89 -1.18 116.97 118.12 3hmp h TYR 568 Ca 0.07 -0.10 -0.05 0.00 2.00 0.00 0.00 58.73 60.65 3hmp h TYR 568 Cb 0.65 -0.10 -0.02 0.00 2.00 0.00 0.00 36.73 39.26 3hmp h TYR 568 CO 0.02 0.65 0.08 0.00 -0.00 0.00 0.00 178.16 178.91 3hmp h ARG 569 N 0.08 0.73 -0.31 4.88 3.08 -1.27 -2.12 114.38 119.45 3hmp h ARG 569 Ca 0.04 -0.15 -0.15 0.00 0.07 0.00 0.00 59.98 59.79 3hmp h ARG 569 Cb 0.53 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 3hmp h ARG 569 CO 0.02 0.69 -0.39 -0.97 -1.07 0.00 0.00 179.97 178.26 3hmp h ASN 570 N 0.70 0.88 -0.33 7.04 -0.73 -1.24 -1.37 115.58 120.53 3hmp h ASN 570 Ca 0.15 -0.49 -0.13 0.00 1.87 0.00 0.00 56.30 57.70 3hmp h ASN 570 Cb 0.32 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.65 3hmp h ASN 570 CO 0.00 1.20 -0.29 -0.08 -0.37 0.00 0.00 177.43 177.89 3hmp h GLU 571 N 0.59 0.85 -0.36 6.67 4.81 -1.12 -2.21 114.58 123.81 3hmp h GLU 571 Ca 0.04 -0.39 -0.02 0.00 -0.13 0.00 0.00 59.36 58.86 3hmp h GLU 571 Cb 0.98 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.33 3hmp h GLU 571 CO 0.09 1.03 0.15 0.82 -0.73 0.00 0.00 179.01 180.38 3hmp h ILE 572 N 0.72 1.18 -0.69 2.32 2.04 -1.36 -0.15 117.51 121.58 3hmp h ILE 572 Ca 0.08 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.40 3hmp h ILE 572 Cb 0.84 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 3hmp h ILE 572 CO 0.07 0.20 0.45 0.00 0.00 0.00 0.00 178.15 178.87 3hmp h ALA 573 N 1.00 0.88 -0.22 1.87 0.00 -1.20 -1.33 119.26 120.26 3hmp h ALA 573 Ca 0.12 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3hmp h ALA 573 Cb 0.17 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3hmp h ALA 573 CO -0.01 0.27 -0.17 1.88 0.00 0.00 0.00 179.25 181.22 3hmp h TYR 574 N 0.91 0.60 -0.87 0.00 -1.99 -1.21 -1.77 116.97 112.64 3hmp h TYR 574 Ca 0.26 -0.17 0.07 0.00 2.00 0.00 0.00 58.73 60.89 3hmp h TYR 574 Cb -0.07 -0.13 -0.07 0.00 2.00 0.00 0.00 36.73 38.47 3hmp h TYR 574 CO -0.03 0.82 0.54 1.25 -0.00 0.00 0.00 178.16 180.74 3hmp h LEU 575 N 0.20 0.83 -0.35 3.88 5.85 -0.92 0.11 115.31 124.91 3hmp h LEU 575 Ca 0.04 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 3hmp h LEU 575 Cb 0.70 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 3hmp h LEU 575 CO 0.04 0.52 0.08 -1.13 -0.34 0.00 0.00 178.44 177.61 3hmp h ASN 576 N 0.96 0.53 -0.07 1.25 -1.24 -1.16 -2.93 115.58 112.92 3hmp h ASN 576 Ca 0.39 -0.24 -0.02 0.00 0.71 0.00 0.00 56.30 57.14 3hmp h ASN 576 Cb 0.22 -0.14 -0.00 0.00 0.73 0.00 0.00 38.32 39.13 3hmp h ASN 576 CO -0.19 0.63 -0.03 0.50 -1.29 0.00 0.00 177.43 177.05 3hmp h LYS 577 N 0.41 0.15 0.00 6.67 3.64 -0.88 -3.32 116.57 123.25 3hmp h LYS 577 Ca 0.11 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3hmp h LYS 577 Cb 0.31 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3hmp h LYS 577 CO 0.00 0.52 0.00 1.28 -2.27 0.00 0.00 179.45 178.98 3hmp n LEU 578 N -4.77 0.00 -0.14 5.20 4.77 0.34 -3.42 117.00 118.97 3hmp n LEU 578 Ca -0.07 0.41 -0.03 0.00 -0.03 0.00 0.00 56.01 56.29 3hmp n LEU 578 Cb 0.25 -0.41 0.05 0.00 -2.33 0.00 0.00 43.42 40.98 3hmp n LEU 578 CO 0.35 -0.05 0.87 1.56 -1.33 0.00 0.00 177.39 178.80 3hmp h GLN 579 N 0.00 0.16 0.00 3.23 4.20 -1.61 -1.40 115.11 119.69 3hmp h GLN 579 Ca 0.00 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3hmp h GLN 579 Cb 0.36 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.11 3hmp h GLN 579 CO 0.00 0.10 0.00 1.04 -0.67 0.00 0.00 178.83 179.30 3hmp n GLN 580 N -5.17 0.25 -0.01 1.46 3.00 -1.22 -3.32 117.38 112.38 3hmp n GLN 580 Ca 0.04 0.12 0.08 0.00 -0.01 0.00 0.00 57.00 57.23 3hmp n GLN 580 Cb 0.23 -1.50 -0.12 0.00 0.00 0.00 0.00 30.24 28.85 3hmp n GLN 580 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 3hmp n HIS 581 N -1.20 0.00 -3.65 1.08 8.25 -0.53 -4.98 115.22 114.19 3hmp n HIS 581 Ca 0.07 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.39 3hmp n HIS 581 Cb 0.09 -0.34 -0.08 0.00 1.12 0.00 0.00 29.99 30.78 3hmp n HIS 581 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3hmp s SER 582 N -3.75 -0.65 0.00 0.41 0.15 -1.20 -5.01 113.70 103.65 3hmp s SER 582 Ca -0.05 1.20 0.16 0.00 0.70 0.00 0.00 55.95 57.96 3hmp s SER 582 Cb 0.10 1.21 0.83 0.00 -1.71 0.00 0.00 66.02 66.45 3hmp s SER 582 CO 0.66 -0.26 1.55 -0.90 1.20 0.00 0.00 173.24 175.50 3hmp n ASP 583 N 2.55 0.47 -0.93 5.45 5.75 -1.26 -3.26 116.55 125.32 3hmp n ASP 583 Ca -0.14 -1.60 0.08 0.00 -0.01 0.00 0.00 54.79 53.12 3hmp n ASP 583 Cb 0.56 -0.04 0.23 0.00 -1.03 0.00 0.00 41.12 40.84 3hmp n ASP 583 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3hmp n LYS 584 N -0.43 2.17 -4.70 0.11 4.76 -1.26 -4.81 118.16 113.99 3hmp n LYS 584 Ca 0.12 -1.82 -0.33 0.00 -2.87 0.00 0.00 58.31 53.41 3hmp n LYS 584 Cb 0.13 -1.40 -0.13 0.00 -1.84 0.00 0.00 35.03 31.79 3hmp n LYS 584 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3hmp s ILE 585 N -1.33 3.37 0.48 -0.18 1.01 -1.20 -0.61 121.20 122.73 3hmp s ILE 585 Ca 0.34 -0.58 -0.23 0.00 0.00 0.00 0.00 60.65 60.19 3hmp s ILE 585 Cb 0.18 -2.40 -0.09 0.00 0.01 0.00 0.00 42.46 40.17 3hmp s ILE 585 CO 0.23 0.56 1.06 0.00 0.00 0.00 0.00 174.94 176.79 3hmp n ILE 586 N 2.87 2.86 -2.71 2.92 3.06 -0.68 -4.85 119.36 122.82 3hmp n ILE 586 Ca -0.18 -0.50 -0.42 0.00 -2.50 0.00 0.00 62.75 59.15 3hmp n ILE 586 Cb 0.53 -1.26 -0.03 0.00 0.54 0.00 0.00 39.64 39.42 3hmp n ILE 586 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 3hmp s ARG 587 N -2.29 4.38 -0.40 9.51 3.00 -1.26 -4.90 118.95 126.98 3hmp s ARG 587 Ca 0.66 1.34 -0.11 0.00 0.00 0.00 0.00 55.73 57.62 3hmp s ARG 587 Cb -0.50 -3.56 0.05 0.00 0.00 0.00 0.00 34.95 30.94 3hmp s ARG 587 CO 0.54 -0.37 0.26 -1.17 0.00 0.00 0.00 175.30 174.55 3hmp s LEU 588 N 2.24 5.01 -0.00 2.53 2.96 -1.26 -1.60 118.68 128.55 3hmp s LEU 588 Ca 0.46 -1.21 -0.14 0.00 -0.22 0.00 0.00 54.13 53.02 3hmp s LEU 588 Cb -0.17 -2.04 -0.34 0.00 0.50 0.00 0.00 46.19 44.14 3hmp s LEU 588 CO 0.15 -0.48 0.87 1.88 -1.32 0.00 0.00 176.35 177.46 3hmp h TYR 589 N 8.48 0.89 -2.39 5.38 0.05 -1.04 -3.49 116.97 124.85 3hmp h TYR 589 Ca -0.25 -0.65 0.14 0.00 0.05 0.00 0.00 58.73 58.02 3hmp h TYR 589 Cb 1.10 -0.04 -0.11 0.00 1.01 0.00 0.00 36.73 38.70 3hmp h TYR 589 CO 0.59 1.60 0.46 0.34 -1.05 0.00 0.00 178.16 180.11 3hmp s ASP 590 N -7.47 -0.27 0.09 3.88 -1.08 -1.12 -5.02 116.67 105.68 3hmp s ASP 590 Ca -0.12 -0.25 -0.19 0.00 -0.52 0.00 0.00 52.55 51.47 3hmp s ASP 590 Cb 0.04 0.47 0.05 0.00 -1.46 0.00 0.00 42.92 42.02 3hmp s ASP 590 CO 0.91 -0.83 0.47 -0.72 0.52 0.00 0.00 175.17 175.52 3hmp s TYR 591 N -3.28 -0.33 -0.05 -5.34 -0.85 -1.26 -0.80 117.35 105.44 3hmp s TYR 591 Ca 0.09 0.17 0.04 0.00 -0.52 0.00 0.00 57.07 56.85 3hmp s TYR 591 Cb -0.01 0.32 0.00 0.00 0.38 0.00 0.00 41.96 42.65 3hmp s TYR 591 CO -0.02 -0.68 -0.16 -2.00 -1.52 0.00 0.00 175.55 171.16 3hmp s GLU 592 N -3.19 1.81 -0.04 -3.49 2.12 0.05 -4.82 118.70 111.13 3hmp s GLU 592 Ca -0.01 -0.56 -0.02 0.00 0.36 0.00 0.00 54.97 54.74 3hmp s GLU 592 Cb 0.00 -1.53 0.03 0.00 0.26 0.00 0.00 34.13 32.89 3hmp s GLU 592 CO -0.08 0.18 0.07 -1.50 -0.54 0.00 0.00 175.26 173.40 3hmp s ILE 593 N 0.22 -0.12 0.36 -3.70 2.07 -1.26 -0.61 121.20 118.16 3hmp s ILE 593 Ca -0.07 0.36 0.02 0.00 -1.41 0.00 0.00 60.65 59.55 3hmp s ILE 593 Cb -0.13 -0.16 -0.01 0.00 0.13 0.00 0.00 42.46 42.29 3hmp s ILE 593 CO 0.03 0.15 0.09 0.35 -1.91 0.00 0.00 174.94 173.65 3hmp n THR 594 N 5.01 0.00 0.30 4.00 -2.24 -0.18 -5.02 114.28 116.15 3hmp n THR 594 Ca -0.10 -1.99 0.19 0.00 -2.27 0.00 0.00 64.05 59.87 3hmp n THR 594 Cb 0.50 0.63 0.94 0.00 -2.10 0.00 0.00 70.33 70.30 3hmp n THR 594 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3hmp h ASP 595 N 1.26 0.00 0.00 3.42 5.19 -2.01 -3.22 116.42 121.07 3hmp h ASP 595 Ca -0.29 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 55.97 3hmp h ASP 595 Cb 1.03 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.51 3hmp h ASP 595 CO 0.47 0.03 -2.04 0.00 -3.12 0.00 0.00 179.24 174.58 3hmp n GLN 596 N -3.25 0.82 -3.56 3.56 3.00 -1.26 -4.63 117.38 112.06 3hmp n GLN 596 Ca -0.02 -0.10 -0.11 0.00 -0.01 0.00 0.00 57.00 56.77 3hmp n GLN 596 Cb 0.18 -1.46 -0.02 0.00 0.00 0.00 0.00 30.24 28.94 3hmp n GLN 596 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.06 178.58 3hmp s TYR 597 N -2.91 -0.41 -0.05 1.08 -0.85 -1.22 -0.91 117.35 112.08 3hmp s TYR 597 Ca -0.08 0.13 0.05 0.00 -0.52 0.00 0.00 57.07 56.65 3hmp s TYR 597 Cb 0.09 0.57 -0.01 0.00 0.38 0.00 0.00 41.96 42.99 3hmp s TYR 597 CO 0.76 -0.94 -0.21 0.42 -1.52 0.00 0.00 175.55 174.07 3hmp s ILE 598 N -3.80 1.72 -0.12 -3.49 1.01 -0.05 -1.01 121.20 115.46 3hmp s ILE 598 Ca 0.04 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.84 3hmp s ILE 598 Cb -0.02 -1.47 0.00 0.00 0.01 0.00 0.00 42.46 40.98 3hmp s ILE 598 CO -0.07 0.49 -0.21 -0.31 0.00 0.00 0.00 174.94 174.83 3hmp s TYR 599 N -0.02 2.65 -0.14 3.97 2.02 0.22 -0.79 117.35 125.26 3hmp s TYR 599 Ca -0.05 -1.07 0.02 0.00 -0.37 0.00 0.00 57.07 55.61 3hmp s TYR 599 Cb -0.13 -1.78 0.01 0.00 -0.40 0.00 0.00 41.96 39.67 3hmp s TYR 599 CO 0.03 -0.45 -0.21 -1.64 -1.57 0.00 0.00 175.55 171.71 3hmp s MET 600 N 0.52 2.92 -0.33 -0.62 -1.94 0.90 -0.77 119.30 119.97 3hmp s MET 600 Ca -0.13 -0.82 -0.16 0.00 -1.71 0.00 0.00 55.69 52.87 3hmp s MET 600 Cb -0.17 -2.38 -0.01 0.00 2.01 0.00 0.00 34.83 34.28 3hmp s MET 600 CO 0.05 -0.03 0.40 0.08 -0.01 0.00 0.00 175.02 175.50 3hmp s VAL 601 N 0.86 5.13 0.26 -6.03 1.01 0.02 -0.30 120.40 121.36 3hmp s VAL 601 Ca -0.06 0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.14 3hmp s VAL 601 Cb -0.15 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 3hmp s VAL 601 CO -0.03 -0.08 0.05 -0.04 0.00 0.00 0.00 175.10 175.01 3hmp s MET 602 N 2.11 1.44 0.27 2.72 -1.94 0.67 -0.34 119.30 124.24 3hmp s MET 602 Ca 0.14 -1.76 -0.30 0.00 -1.71 0.00 0.00 55.69 52.05 3hmp s MET 602 Cb -0.16 -0.53 -0.11 0.00 2.01 0.00 0.00 34.83 36.04 3hmp s MET 602 CO 0.12 -0.20 1.59 -2.00 -0.01 0.00 0.00 175.02 174.52 3hmp s GLU 603 N -3.94 4.14 -0.15 2.03 2.12 -0.63 -0.55 118.70 121.72 3hmp s GLU 603 Ca 0.34 2.54 -0.25 0.00 0.36 0.00 0.00 54.97 57.96 3hmp s GLU 603 Cb 0.07 -3.04 -0.24 0.00 0.26 0.00 0.00 34.13 31.18 3hmp s GLU 603 CO 0.12 -0.62 0.59 0.00 -0.54 0.00 0.00 175.26 174.81 3hmp n GLY 605 N 1.57 -1.55 0.27 0.00 0.00 -1.26 -4.80 105.19 99.41 3hmp n GLY 605 Ca -0.18 -1.19 -0.23 0.00 0.00 0.00 0.00 46.02 44.41 3hmp n GLY 605 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hmp n ASN 606 N -2.03 1.70 -3.60 1.61 4.13 0.26 -4.99 115.26 112.34 3hmp n ASN 606 Ca 0.00 0.23 -0.10 0.00 1.68 0.00 0.00 54.58 56.39 3hmp n ASN 606 Cb 0.13 -0.63 -0.06 0.00 -1.54 0.00 0.00 39.78 37.68 3hmp n ASN 606 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 3hmp s ILE 607 N -2.42 0.00 0.53 2.41 2.07 -1.19 -5.03 121.20 117.57 3hmp s ILE 607 Ca -0.32 0.00 -0.17 0.00 -1.41 0.00 0.00 60.65 58.75 3hmp s ILE 607 Cb 0.12 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.64 3hmp s ILE 607 CO 0.41 0.00 1.02 1.51 -1.91 0.00 0.00 174.94 175.97 3hmp s ASP 608 N -0.64 6.31 0.28 4.50 -4.77 -1.26 -0.40 116.67 120.69 3hmp s ASP 608 Ca -0.00 1.72 -0.01 0.00 -3.30 0.00 0.00 52.55 50.96 3hmp s ASP 608 Cb -0.02 -2.53 0.46 0.00 -1.09 0.00 0.00 42.92 39.74 3hmp s ASP 608 CO -0.01 -0.81 1.88 0.25 0.70 0.00 0.00 175.17 177.19 3hmp h LEU 609 N 0.91 1.00 -0.35 2.11 5.85 -0.74 -2.40 115.31 121.70 3hmp h LEU 609 Ca -0.47 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.22 3hmp h LEU 609 Cb 1.20 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 3hmp h LEU 609 CO 0.60 0.62 0.05 -1.13 -0.34 0.00 0.00 178.44 178.24 3hmp h ASN 610 N 1.12 0.56 -0.38 1.25 -1.24 -1.81 0.09 115.58 115.17 3hmp h ASN 610 Ca 0.43 -0.27 -0.07 0.00 0.71 0.00 0.00 56.30 57.11 3hmp h ASN 610 Cb 0.22 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.10 3hmp h ASN 610 CO -0.18 0.68 0.00 0.28 -1.29 0.00 0.00 177.43 176.93 3hmp h SER 611 N 0.41 0.72 -0.08 1.15 0.02 -1.88 -1.31 113.55 112.58 3hmp h SER 611 Ca 0.10 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 3hmp h SER 611 Cb 0.37 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 3hmp h SER 611 CO 0.01 0.79 -0.01 -0.25 -1.14 0.00 0.00 176.83 176.23 3hmp h TRP 612 N 0.71 0.15 -0.37 3.45 7.01 -1.26 -2.89 115.95 122.74 3hmp h TRP 612 Ca 0.14 -0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.13 3hmp h TRP 612 Cb 0.43 -0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.43 3hmp h TRP 612 CO 0.02 0.42 0.25 -0.07 -2.79 0.00 0.00 178.44 176.27 3hmp h LEU 613 N -0.16 0.38 -0.61 0.65 3.38 -0.84 -2.58 115.31 115.53 3hmp h LEU 613 Ca 0.02 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 3hmp h LEU 613 Cb 0.37 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3hmp h LEU 613 CO 0.00 0.27 -0.28 0.11 0.09 0.00 0.00 178.44 178.64 3hmp h LYS 614 N 0.45 0.80 -0.54 1.13 1.57 -1.18 -2.94 116.57 115.86 3hmp h LYS 614 Ca 0.14 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 3hmp h LYS 614 Cb 0.02 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3hmp h LYS 614 CO -0.03 0.98 0.00 0.36 -0.57 0.00 0.00 179.45 180.19 3hmp n LYS 615 N -4.09 2.41 -4.20 3.15 2.85 -1.04 -4.91 118.16 112.34 3hmp n LYS 615 Ca -0.01 -1.61 -0.34 0.00 -1.05 0.00 0.00 58.31 55.30 3hmp n LYS 615 Cb 0.47 -1.54 -0.10 0.00 -0.65 0.00 0.00 35.03 33.21 3hmp n LYS 615 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 3hmp s LYS 616 N -1.64 3.70 -0.05 -1.58 2.47 -1.00 -5.00 119.74 116.64 3hmp s LYS 616 Ca 0.29 -0.41 -0.18 0.00 -1.56 0.00 0.00 55.97 54.11 3hmp s LYS 616 Cb 0.18 -3.04 -0.13 0.00 -1.46 0.00 0.00 37.83 33.38 3hmp s LYS 616 CO 0.16 0.35 0.75 0.87 0.16 0.00 0.00 175.35 177.63 3hmp h LYS 617 N 6.39 -0.29 -3.48 4.03 6.56 -1.91 -3.48 116.57 124.40 3hmp h LYS 617 Ca -0.38 0.02 -0.06 0.00 -1.06 0.00 0.00 60.65 59.17 3hmp h LYS 617 Cb 1.18 0.07 -0.14 0.00 -0.57 0.00 0.00 32.23 32.77 3hmp h LYS 617 CO 0.65 0.04 -0.16 -1.54 -2.06 0.00 0.00 179.45 176.38 3hmp s SER 618 N -5.32 -0.14 -0.15 0.86 1.04 -1.26 -5.11 113.70 103.62 3hmp s SER 618 Ca -0.11 -0.38 -0.06 0.00 0.48 0.00 0.00 55.95 55.88 3hmp s SER 618 Cb 0.00 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 3hmp s SER 618 CO 0.38 -0.80 0.05 -0.63 0.98 0.00 0.00 173.24 173.22 3hmp s ILE 619 N -3.71 4.74 0.08 -1.02 1.01 -1.26 -5.06 121.20 115.98 3hmp s ILE 619 Ca 0.03 -0.06 -0.31 0.00 0.00 0.00 0.00 60.65 60.30 3hmp s ILE 619 Cb 0.02 -3.10 -0.11 0.00 0.01 0.00 0.00 42.46 39.29 3hmp s ILE 619 CO -0.11 0.51 1.87 -0.67 0.00 0.00 0.00 174.94 176.54 3hmp n ASP 620 N 3.05 3.97 -0.33 3.58 2.03 -1.26 -4.89 116.55 122.69 3hmp n ASP 620 Ca -0.17 0.97 0.31 0.00 0.52 0.00 0.00 54.79 56.42 3hmp n ASP 620 Cb 0.53 -1.51 0.67 0.00 -0.72 0.00 0.00 41.12 40.08 3hmp n ASP 620 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3hmp h PRO 621 N 9.07 0.13 -0.16 -0.67 0.11 -1.98 -0.47 132.00 138.03 3hmp h PRO 621 Ca -0.48 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.47 3hmp h PRO 621 Cb 1.23 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3hmp h PRO 621 CO 0.94 0.09 -0.52 2.35 -0.21 0.00 0.00 178.00 180.65 3hmp h TRP 622 N 0.13 0.83 -0.40 0.65 7.01 -2.00 -2.66 115.95 119.53 3hmp h TRP 622 Ca 0.59 -0.34 -0.07 0.00 2.11 0.00 0.00 58.89 61.18 3hmp h TRP 622 Cb 2.05 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 28.96 3hmp h TRP 622 CO -0.00 1.12 -0.04 1.49 -2.79 0.00 0.00 178.44 178.22 3hmp h GLU 623 N 0.31 0.73 -0.80 2.65 4.81 -1.65 -1.52 114.58 119.10 3hmp h GLU 623 Ca -0.02 -0.25 0.02 0.00 -0.13 0.00 0.00 59.36 58.97 3hmp h GLU 623 Cb 1.14 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.42 3hmp h GLU 623 CO 0.11 0.84 0.53 -0.09 -0.73 0.00 0.00 179.01 179.66 3hmp h ARG 624 N 0.54 1.03 -0.51 1.92 2.43 -1.18 0.12 114.38 118.74 3hmp h ARG 624 Ca 0.11 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.11 3hmp h ARG 624 Cb 0.54 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 3hmp h ARG 624 CO 0.03 0.68 -0.11 -0.22 -1.51 0.00 0.00 179.97 178.84 3hmp h LYS 625 N 1.06 0.95 -0.20 0.20 3.64 -1.35 -1.49 116.57 119.38 3hmp h LYS 625 Ca 0.30 -0.34 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 3hmp h LYS 625 Cb -0.09 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 3hmp h LYS 625 CO -0.08 1.00 -0.00 1.03 -2.27 0.00 0.00 179.45 179.13 3hmp h SER 626 N 0.85 0.34 -0.65 4.20 0.87 -0.84 -1.81 113.55 116.50 3hmp h SER 626 Ca 0.13 -0.31 0.02 0.00 -1.23 0.00 0.00 61.79 60.40 3hmp h SER 626 Cb 0.65 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.48 3hmp h SER 626 CO 0.05 0.57 0.42 1.88 -0.53 0.00 0.00 176.83 179.21 3hmp h TYR 627 N 0.11 0.79 -0.64 2.24 0.05 -0.74 -2.07 116.97 116.70 3hmp h TYR 627 Ca 0.06 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.92 3hmp h TYR 627 Cb 0.39 -0.26 -0.05 0.00 1.01 0.00 0.00 36.73 37.82 3hmp h TYR 627 CO 0.03 0.47 0.34 2.35 -1.05 0.00 0.00 178.16 180.31 3hmp h TRP 628 N 0.83 0.63 -0.26 4.88 2.91 -1.19 -0.47 115.95 123.28 3hmp h TRP 628 Ca 0.25 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.30 3hmp h TRP 628 Cb -0.03 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 28.42 3hmp h TRP 628 CO -0.04 0.29 0.16 0.87 -1.03 0.00 0.00 178.44 178.69 3hmp h LYS 629 N 0.63 0.32 -0.16 2.65 1.57 -0.90 -0.93 116.57 119.75 3hmp h LYS 629 Ca 0.29 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 59.09 3hmp h LYS 629 Cb 0.20 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 3hmp h LYS 629 CO -0.19 0.21 -0.07 -0.91 -0.57 0.00 0.00 179.45 177.92 3hmp h ASN 630 N 0.33 -0.23 -0.35 0.86 -0.26 -0.95 -1.31 115.58 113.68 3hmp h ASN 630 Ca 0.10 0.06 0.04 0.00 -0.56 0.00 0.00 56.30 55.94 3hmp h ASN 630 Cb -0.02 0.13 -0.04 0.00 -1.06 0.00 0.00 38.32 37.34 3hmp h ASN 630 CO -0.04 -0.09 0.12 0.24 -1.06 0.00 0.00 177.43 176.60 3hmp h MET 631 N -0.05 0.25 -0.67 0.81 2.86 -0.89 -1.35 114.93 115.91 3hmp h MET 631 Ca 0.09 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.76 3hmp h MET 631 Cb 0.17 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 3hmp h MET 631 CO -0.19 0.17 0.40 -0.07 1.06 0.00 0.00 176.91 178.27 3hmp h LEU 632 N 0.26 0.62 -0.29 1.22 3.38 -1.07 -1.88 115.31 117.55 3hmp h LEU 632 Ca 0.16 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3hmp h LEU 632 Cb 0.13 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3hmp h LEU 632 CO -0.16 0.41 0.10 -0.08 0.09 0.00 0.00 178.44 178.79 3hmp h GLU 633 N 0.75 0.45 -0.31 1.13 4.81 -0.78 0.24 114.58 120.88 3hmp h GLU 633 Ca 0.29 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 3hmp h GLU 633 Cb 0.11 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3hmp h GLU 633 CO -0.15 0.49 0.16 0.00 -0.73 0.00 0.00 179.01 178.78 3hmp h ALA 634 N 0.93 0.40 -0.25 2.92 0.00 -1.21 -2.10 119.26 119.95 3hmp h ALA 634 Ca 0.09 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 3hmp h ALA 634 Cb 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3hmp h ALA 634 CO -0.00 -0.05 -0.61 0.28 0.00 0.00 0.00 179.25 178.86 3hmp h VAL 635 N 0.37 1.28 -0.70 0.00 2.07 -1.26 -2.64 116.25 115.36 3hmp h VAL 635 Ca 0.11 -1.79 0.11 0.00 0.82 0.00 0.00 66.70 65.95 3hmp h VAL 635 Cb 0.10 1.74 -0.08 0.00 -1.52 0.00 0.00 31.29 31.53 3hmp h VAL 635 CO -0.01 0.58 0.30 -0.74 0.02 0.00 0.00 177.57 177.72 3hmp h HIS 636 N 0.62 0.53 -0.52 1.57 6.17 -0.97 -1.57 115.15 120.98 3hmp h HIS 636 Ca -0.01 0.03 0.02 0.00 0.71 0.00 0.00 60.37 61.12 3hmp h HIS 636 Cb 1.22 -0.13 -0.03 0.00 2.52 0.00 0.00 27.41 30.99 3hmp h HIS 636 CO 0.08 0.13 0.32 1.15 0.71 0.00 0.00 177.93 180.32 3hmp h THR 637 N 0.49 1.08 -0.32 6.26 2.02 -1.03 -1.13 112.91 120.28 3hmp h THR 637 Ca 0.37 -0.22 -0.16 0.00 0.77 0.00 0.00 66.41 67.17 3hmp h THR 637 Cb 0.48 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 3hmp h THR 637 CO -0.33 0.12 -0.43 0.16 0.37 0.00 0.00 175.52 175.40 3hmp h ILE 638 N 0.65 1.28 -0.90 3.11 3.07 -1.18 -2.73 117.51 120.81 3hmp h ILE 638 Ca 0.20 -1.61 0.04 0.00 1.55 0.00 0.00 64.86 65.04 3hmp h ILE 638 Cb -0.02 1.49 -0.05 0.00 -0.27 0.00 0.00 36.82 37.97 3hmp h ILE 638 CO -0.07 0.53 0.59 0.45 -1.05 0.00 0.00 178.15 178.59 3hmp h HIS 639 N 0.66 1.08 0.00 0.16 3.86 -1.08 -1.21 115.15 118.62 3hmp h HIS 639 Ca 0.04 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 3hmp h HIS 639 Cb 1.01 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 29.12 3hmp h HIS 639 CO 0.06 0.62 0.00 1.96 0.86 0.00 0.00 177.93 181.43 3hmp h GLN 640 N 1.11 0.00 -0.17 2.45 4.20 -0.88 -2.28 115.11 119.54 3hmp h GLN 640 Ca 0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.07 3hmp h GLN 640 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3hmp h GLN 640 CO -0.11 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.77 3hmp n HIS 641 N -2.84 0.57 -0.66 2.96 8.25 -0.54 -4.98 115.22 117.98 3hmp n HIS 641 Ca -0.02 -0.87 0.00 0.00 -0.26 0.00 0.00 57.72 56.57 3hmp n HIS 641 Cb 0.09 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 30.97 3hmp n HIS 641 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hmp n GLY 642 N -0.71 0.75 3.66 -1.41 0.00 -0.86 -5.04 105.19 101.58 3hmp n GLY 642 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 3hmp n GLY 642 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hmp s ILE 643 N -2.65 5.22 -0.20 -0.61 1.01 -0.68 -4.99 121.20 118.31 3hmp s ILE 643 Ca 0.00 0.59 -0.04 0.00 0.00 0.00 0.00 60.65 61.20 3hmp s ILE 643 Cb 0.00 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.77 3hmp s ILE 643 CO 0.00 0.25 -0.03 -0.69 0.00 0.00 0.00 174.94 174.47 3hmp s VAL 644 N 1.41 3.69 0.02 2.92 1.01 -1.26 -3.06 120.40 125.12 3hmp s VAL 644 Ca 0.16 -0.40 -0.22 0.00 0.00 0.00 0.00 61.98 61.52 3hmp s VAL 644 Cb -0.15 -2.66 -0.16 0.00 0.00 0.00 0.00 36.38 33.41 3hmp s VAL 644 CO 0.08 0.44 1.31 -0.74 0.00 0.00 0.00 175.10 176.19 3hmp h HIS 645 N 7.56 0.30 0.00 5.22 2.76 -1.94 -3.47 115.15 125.58 3hmp h HIS 645 Ca -0.36 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 57.72 3hmp h HIS 645 Cb 1.18 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 30.07 3hmp h HIS 645 CO 0.58 0.68 0.00 -1.13 -1.30 0.00 0.00 177.93 176.76 3hmp n SER 646 N -4.64 0.00 -2.79 3.26 3.41 -1.26 -4.54 113.62 107.06 3hmp n SER 646 Ca -0.07 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.54 3hmp n SER 646 Cb 0.33 -0.86 0.07 0.00 -0.26 0.00 0.00 64.21 63.50 3hmp n SER 646 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3hmp n ASP 647 N 0.00 0.77 -4.75 4.04 2.03 -1.26 -5.02 116.55 112.36 3hmp n ASP 647 Ca 0.00 -2.07 -0.41 0.00 0.52 0.00 0.00 54.79 52.83 3hmp n ASP 647 Cb 0.00 -0.17 -0.04 0.00 -0.72 0.00 0.00 41.12 40.19 3hmp n ASP 647 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3hmp s LEU 648 N -3.88 4.49 0.23 -2.67 1.43 -1.26 -4.98 118.68 112.03 3hmp s LEU 648 Ca 0.22 2.32 -0.13 0.00 -1.03 0.00 0.00 54.13 55.51 3hmp s LEU 648 Cb 0.35 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.95 3hmp s LEU 648 CO -0.06 -0.29 0.46 -0.54 0.23 0.00 0.00 176.35 176.15 3hmp s LYS 649 N -1.02 1.46 0.31 1.70 1.02 -1.26 -4.83 119.74 117.12 3hmp s LYS 649 Ca 0.48 -1.17 0.07 0.00 0.02 0.00 0.00 55.97 55.37 3hmp s LYS 649 Cb -0.33 0.47 0.75 0.00 -0.52 0.00 0.00 37.83 38.20 3hmp s LYS 649 CO 0.41 -0.60 1.79 -1.35 -0.92 0.00 0.00 175.35 174.68 3hmp h PRO 650 N 2.29 0.73 0.00 -1.68 0.11 -1.95 -2.64 132.00 128.85 3hmp h PRO 650 Ca -0.27 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3hmp h PRO 650 Cb 1.25 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3hmp h PRO 650 CO 0.37 0.49 0.00 0.00 -0.21 0.00 0.00 178.00 178.65 3hmp h ALA 651 N 1.63 1.00 0.00 -0.75 0.00 -1.95 -1.12 119.26 118.08 3hmp h ALA 651 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 3hmp h ALA 651 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3hmp h ALA 651 CO -0.36 0.00 0.00 0.09 0.00 0.00 0.00 179.25 178.98 3hmp n ASN 652 N -2.94 0.00 -4.50 0.00 4.13 -1.00 -4.77 115.26 106.18 3hmp n ASN 652 Ca -0.01 0.29 -0.33 0.00 1.68 0.00 0.00 54.58 56.20 3hmp n ASN 652 Cb 0.17 -0.42 -0.12 0.00 -1.54 0.00 0.00 39.78 37.87 3hmp n ASN 652 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3hmp s PHE 653 N -2.83 2.90 -0.12 3.10 0.08 -0.42 -0.62 117.98 120.06 3hmp s PHE 653 Ca 0.15 -0.21 -0.01 0.00 0.12 0.00 0.00 56.93 56.98 3hmp s PHE 653 Cb 0.15 -1.78 -0.02 0.00 -0.57 0.00 0.00 43.02 40.80 3hmp s PHE 653 CO 0.39 0.11 -0.10 -1.17 -0.10 0.00 0.00 175.22 174.35 3hmp s LEU 654 N -0.29 2.90 -0.24 -0.37 2.96 0.30 -0.26 118.68 123.68 3hmp s LEU 654 Ca 0.04 -0.24 -0.24 0.00 -0.22 0.00 0.00 54.13 53.47 3hmp s LEU 654 Cb -0.13 -1.66 -0.01 0.00 0.50 0.00 0.00 46.19 44.90 3hmp s LEU 654 CO 0.03 0.20 0.79 -0.63 -1.32 0.00 0.00 176.35 175.41 3hmp s ILE 655 N 0.17 4.87 -0.19 6.68 1.01 0.47 0.02 121.20 134.23 3hmp s ILE 655 Ca -0.05 1.48 -0.01 0.00 0.00 0.00 0.00 60.65 62.06 3hmp s ILE 655 Cb -0.15 -4.08 0.05 0.00 0.01 0.00 0.00 42.46 38.30 3hmp s ILE 655 CO 0.04 -0.05 -0.03 -0.69 0.00 0.00 0.00 174.94 174.21 3hmp s VAL 656 N 2.75 1.04 -1.43 2.92 1.01 0.14 -0.58 120.40 126.26 3hmp s VAL 656 Ca 0.33 -0.73 -0.06 0.00 0.00 0.00 0.00 61.98 61.52 3hmp s VAL 656 Cb -0.15 -1.32 0.04 0.00 0.00 0.00 0.00 36.38 34.94 3hmp s VAL 656 CO 0.08 -0.01 0.74 0.47 0.00 0.00 0.00 175.10 176.38 3hmp n ASP 657 N 4.88 -2.27 -1.37 3.32 8.00 -1.26 -0.78 116.55 127.07 3hmp n ASP 657 Ca -0.11 -0.86 -0.17 0.00 0.71 0.00 0.00 54.79 54.36 3hmp n ASP 657 Cb 0.47 -3.71 -0.07 0.00 -0.02 0.00 0.00 41.12 37.78 3hmp n ASP 657 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hmp n GLY 658 N -1.68 1.56 3.34 0.44 0.00 -1.26 -5.00 105.19 102.59 3hmp n GLY 658 Ca -0.17 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 3hmp n GLY 658 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hmp s MET 659 N -3.57 2.83 0.04 1.61 -1.94 0.04 -4.94 119.30 113.38 3hmp s MET 659 Ca 0.00 -0.79 -0.28 0.00 -1.71 0.00 0.00 55.69 52.91 3hmp s MET 659 Cb 0.00 -2.36 -0.05 0.00 2.01 0.00 0.00 34.83 34.43 3hmp s MET 659 CO 0.00 0.37 0.89 -0.51 -0.01 0.00 0.00 175.02 175.76 3hmp s LEU 660 N -0.10 4.43 -0.03 -0.03 1.43 -1.26 0.24 118.68 123.36 3hmp s LEU 660 Ca -0.04 1.61 0.05 0.00 -1.03 0.00 0.00 54.13 54.72 3hmp s LEU 660 Cb -0.14 -3.44 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 3hmp s LEU 660 CO 0.04 -0.11 -0.18 -0.54 0.23 0.00 0.00 176.35 175.78 3hmp s LYS 661 N 0.39 1.69 -0.00 1.70 1.02 0.10 -4.72 119.74 119.93 3hmp s LYS 661 Ca 0.46 -0.66 -0.30 0.00 0.02 0.00 0.00 55.97 55.49 3hmp s LYS 661 Cb -0.21 -1.54 -0.05 0.00 -0.52 0.00 0.00 37.83 35.50 3hmp s LYS 661 CO 0.26 0.33 1.36 -1.17 -0.92 0.00 0.00 175.35 175.21 3hmp s LEU 662 N -0.21 4.31 0.07 3.17 2.96 0.22 -0.54 118.68 128.66 3hmp s LEU 662 Ca 0.02 2.06 0.13 0.00 -0.22 0.00 0.00 54.13 56.12 3hmp s LEU 662 Cb -0.09 -3.56 -0.15 0.00 0.50 0.00 0.00 46.19 42.89 3hmp s LEU 662 CO 0.01 -0.68 0.95 0.40 -1.32 0.00 0.00 176.35 175.71 3hmp h ILE 663 N 4.89 0.88 -3.27 6.68 2.04 -1.21 -1.80 117.51 125.72 3hmp h ILE 663 Ca -0.37 -2.50 0.02 0.00 1.00 0.00 0.00 64.86 63.00 3hmp h ILE 663 Cb 1.18 2.36 -0.07 0.00 -0.74 0.00 0.00 36.82 39.54 3hmp h ILE 663 CO 0.89 0.50 0.09 1.51 0.00 0.00 0.00 178.15 181.14 3hmp s ASP 664 N -6.15 -0.20 0.00 1.72 1.47 -1.26 -4.87 116.67 107.38 3hmp s ASP 664 Ca -0.02 -0.72 0.07 0.00 1.18 0.00 0.00 52.55 53.06 3hmp s ASP 664 Cb 0.09 0.67 0.15 0.00 -0.34 0.00 0.00 42.92 43.48 3hmp s ASP 664 CO 0.81 -1.25 1.02 0.49 0.68 0.00 0.00 175.17 176.91 3hmp n PHE 665 N -0.42 0.20 -1.20 2.11 3.72 -1.26 -4.99 117.46 115.60 3hmp n PHE 665 Ca -0.03 -0.34 -0.07 0.00 -0.05 0.00 0.00 57.45 56.96 3hmp n PHE 665 Cb 0.60 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 39.09 3hmp n PHE 665 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hmp n GLY 666 N 0.22 0.83 0.12 1.37 0.00 -1.26 -4.44 105.19 102.03 3hmp n GLY 666 Ca 0.06 -0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 3hmp n GLY 666 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hmp h ILE 667 N 0.00 1.45 -2.09 -0.61 2.04 -1.91 -3.47 117.51 112.93 3hmp h ILE 667 Ca -0.14 -2.56 -0.63 0.00 1.00 0.00 0.00 64.86 62.52 3hmp h ILE 667 Cb 0.75 3.15 0.10 0.00 -0.74 0.00 0.00 36.82 40.07 3hmp h ILE 667 CO 0.21 0.74 0.12 0.00 0.00 0.00 0.00 178.15 179.22 3hmp n ALA 668 N -2.68 -0.75 0.06 1.87 0.00 -1.26 -4.89 120.51 112.87 3hmp n ALA 668 Ca -0.14 0.43 -0.03 0.00 0.00 0.00 0.00 53.44 53.69 3hmp n ALA 668 Cb 0.89 -1.98 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 3hmp n ALA 668 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 3hmp h ASN 669 N 2.49 -0.16 -5.06 0.00 -0.00 -1.87 -3.49 115.58 107.49 3hmp h ASN 669 Ca -0.40 0.01 -0.02 0.00 -0.00 0.00 0.00 56.30 55.89 3hmp h ASN 669 Cb 1.35 0.04 -0.10 0.00 -0.00 0.00 0.00 38.32 39.61 3hmp h ASN 669 CO 0.64 0.00 0.07 0.00 -0.00 0.00 0.00 177.43 178.15 3hmp s GLN 670 N -2.28 1.35 0.00 6.67 -2.07 -1.26 -5.14 119.66 116.93 3hmp s GLN 670 Ca -0.03 -0.77 0.00 0.00 -1.82 0.00 0.00 55.36 52.74 3hmp s GLN 670 Cb 0.00 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.46 3hmp s GLN 670 CO 0.08 -0.58 0.00 -1.33 -1.32 0.00 0.00 175.29 172.15 3hmp n MET 671 N -0.34 0.00 0.00 9.60 2.81 -1.26 -5.08 117.12 122.85 3hmp n MET 671 Ca -0.12 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 3hmp n MET 671 Cb 0.63 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.14 3hmp n MET 671 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3hmp n SER 682 N -0.28 0.85 -3.67 7.83 3.41 -1.26 -4.79 113.62 115.70 3hmp n SER 682 Ca 0.00 -0.14 -0.41 0.00 -0.26 0.00 0.00 58.87 58.06 3hmp n SER 682 Cb 0.00 0.45 0.01 0.00 -0.26 0.00 0.00 64.21 64.41 3hmp n SER 682 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hmp n GLN 683 N -0.54 4.68 -3.72 4.33 6.02 -1.26 -4.92 117.38 121.97 3hmp n GLN 683 Ca 0.00 -4.01 -0.10 0.00 -0.01 0.00 0.00 57.00 52.88 3hmp n GLN 683 Cb 0.00 -2.61 -0.06 0.00 1.02 0.00 0.00 30.24 28.59 3hmp n GLN 683 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3hmp s VAL 684 N -2.12 0.09 0.00 5.09 0.11 -1.26 -5.05 120.40 117.27 3hmp s VAL 684 Ca 0.43 -0.78 0.00 0.00 -2.93 0.00 0.00 61.98 58.70 3hmp s VAL 684 Cb 0.15 -1.19 0.00 0.00 -1.53 0.00 0.00 36.38 33.81 3hmp s VAL 684 CO -0.06 -0.43 0.00 0.61 -3.33 0.00 0.00 175.10 171.89 3hmp n GLY 685 N -0.05 0.55 3.60 6.54 0.00 -1.26 -5.09 105.19 109.47 3hmp n GLY 685 Ca -0.16 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 44.79 3hmp n GLY 685 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3hmp n THR 686 N 0.00 3.24 -0.43 2.61 5.66 -1.26 -4.93 114.28 119.17 3hmp n THR 686 Ca 0.00 -0.50 0.11 0.00 -3.05 0.00 0.00 64.05 60.61 3hmp n THR 686 Cb 0.00 -1.13 0.34 0.00 -1.55 0.00 0.00 70.33 67.99 3hmp n THR 686 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 3hmp n VAL 687 N -1.40 1.27 0.26 1.08 3.14 -1.26 -4.67 118.33 116.75 3hmp n VAL 687 Ca 0.12 -1.05 0.12 0.00 -2.96 0.00 0.00 64.34 60.57 3hmp n VAL 687 Cb 0.45 0.36 0.68 0.00 -1.06 0.00 0.00 33.84 34.28 3hmp n VAL 687 CO 0.00 0.00 0.00 0.78 -6.46 0.00 0.00 176.83 171.15 3hmp h ASN 688 N 4.24 0.00 -0.32 6.55 2.35 -1.97 -2.22 115.58 124.20 3hmp h ASN 688 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3hmp h ASN 688 Cb 1.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.52 3hmp h ASN 688 CO 0.08 0.14 0.00 -1.22 -1.65 0.00 0.00 177.43 174.78 3hmp n TYR 689 N -3.63 0.42 -2.65 1.19 4.01 -1.26 -4.76 117.16 110.48 3hmp n TYR 689 Ca -0.02 -0.27 -0.42 0.00 -0.16 0.00 0.00 57.90 57.04 3hmp n TYR 689 Cb 0.26 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.26 3hmp n TYR 689 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 3hmp s MET 690 N -1.26 4.54 0.54 -0.72 1.75 -0.84 -4.18 119.30 119.13 3hmp s MET 690 Ca 0.31 1.50 -0.18 0.00 -1.25 0.00 0.00 55.69 56.08 3hmp s MET 690 Cb 0.18 -3.43 -0.06 0.00 2.84 0.00 0.00 34.83 34.36 3hmp s MET 690 CO 0.25 -0.07 1.03 -1.25 -0.65 0.00 0.00 175.02 174.33 3hmp s PRO 691 N 0.91 3.64 0.23 4.11 0.04 -1.26 -5.00 135.00 137.67 3hmp s PRO 691 Ca 0.53 1.20 -0.05 0.00 0.04 0.00 0.00 61.00 62.72 3hmp s PRO 691 Cb -0.23 -2.08 0.23 0.00 0.04 0.00 0.00 34.50 32.46 3hmp s PRO 691 CO 0.29 -0.54 1.72 -1.00 0.04 0.00 0.00 177.00 177.50 3hmp h PRO 692 N 0.96 0.92 0.00 0.56 0.13 -1.87 -2.50 132.00 130.21 3hmp h PRO 692 Ca -0.48 -0.26 -0.02 0.00 -0.87 0.00 0.00 66.00 64.38 3hmp h PRO 692 Cb 1.21 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3hmp h PRO 692 CO 0.59 0.90 -0.09 1.05 -0.23 0.00 0.00 178.00 180.22 3hmp h GLU 693 N 0.86 0.00 -0.25 0.86 9.09 -1.94 0.13 114.58 123.33 3hmp h GLU 693 Ca 0.16 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.43 3hmp h GLU 693 Cb 0.47 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.56 3hmp h GLU 693 CO 0.02 0.09 -0.46 0.00 0.05 0.00 0.00 179.01 178.71 3hmp h ALA 694 N 1.91 0.74 0.21 1.06 0.00 -1.78 -1.94 119.26 119.46 3hmp h ALA 694 Ca -0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 54.91 54.14 3hmp h ALA 694 Cb 0.33 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.06 3hmp h ALA 694 CO 0.01 0.67 -1.29 0.82 0.00 0.00 0.00 179.25 179.46 3hmp h ILE 695 N 0.51 1.33 0.00 0.00 2.04 -1.24 -3.20 117.51 116.94 3hmp h ILE 695 Ca 0.03 -2.61 -0.04 0.00 1.00 0.00 0.00 64.86 63.24 3hmp h ILE 695 Cb 0.99 3.01 -0.01 0.00 -0.74 0.00 0.00 36.82 40.07 3hmp h ILE 695 CO 0.09 0.78 -0.19 0.11 0.00 0.00 0.00 178.15 178.94 3hmp h LYS 696 N 0.06 0.00 0.00 2.37 1.57 -0.88 -3.13 116.57 116.56 3hmp h LYS 696 Ca -0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3hmp h LYS 696 Cb 2.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.31 3hmp h LYS 696 CO 0.24 0.19 0.00 -3.47 -0.57 0.00 0.00 179.45 175.84 3hmp n ASP 697 N -3.53 0.00 -0.98 0.86 2.03 -0.73 -5.07 116.55 109.13 3hmp n ASP 697 Ca -0.01 -0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.23 3hmp n ASP 697 Cb 0.34 -0.25 0.00 0.00 -0.72 0.00 0.00 41.12 40.49 3hmp n ASP 697 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 3hmp n MET 698 N -1.25 0.57 -4.34 -0.67 2.81 -1.19 -5.08 117.12 107.98 3hmp n MET 698 Ca 0.10 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.73 3hmp n MET 698 Cb 0.15 -1.22 -0.10 0.00 -0.71 0.00 0.00 33.22 31.34 3hmp n MET 698 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3hmp s LYS 710 N 0.38 1.92 0.14 0.03 -0.14 -1.26 -5.16 119.74 115.64 3hmp s LYS 710 Ca 0.00 -1.38 -0.31 0.00 -1.36 0.00 0.00 55.97 52.93 3hmp s LYS 710 Cb 0.00 -2.05 -0.08 0.00 -1.68 0.00 0.00 37.83 34.02 3hmp s LYS 710 CO 0.00 0.41 1.32 0.42 -0.76 0.00 0.00 175.35 176.74 3hmp s ILE 711 N -1.80 3.42 0.34 2.17 1.09 -1.26 -4.86 121.20 120.30 3hmp s ILE 711 Ca 0.25 1.08 0.03 0.00 -1.10 0.00 0.00 60.65 60.90 3hmp s ILE 711 Cb -0.08 -3.69 -0.01 0.00 -1.06 0.00 0.00 42.46 37.62 3hmp s ILE 711 CO 0.14 0.12 0.37 -0.94 -0.10 0.00 0.00 174.94 174.53 3hmp s SER 712 N 0.77 1.35 0.59 3.58 1.04 -1.26 -5.01 113.70 114.75 3hmp s SER 712 Ca 0.60 -1.64 0.28 0.00 0.48 0.00 0.00 55.95 55.67 3hmp s SER 712 Cb -0.35 0.61 1.64 0.00 0.10 0.00 0.00 66.02 68.02 3hmp s SER 712 CO 0.33 -1.18 2.09 -0.65 0.98 0.00 0.00 173.24 174.82 3hmp h PRO 713 N 2.12 0.00 0.00 4.02 0.11 -1.95 -1.53 132.00 134.77 3hmp h PRO 713 Ca -0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 3hmp h PRO 713 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3hmp h PRO 713 CO 0.37 0.00 -0.15 0.87 -0.21 0.00 0.00 178.00 178.88 3hmp h LYS 714 N 0.00 0.00 -0.92 1.05 1.79 -1.93 -2.26 116.57 114.31 3hmp h LYS 714 Ca 0.09 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.58 3hmp h LYS 714 Cb 0.51 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.11 3hmp h LYS 714 CO -0.00 0.15 0.61 0.77 -1.08 0.00 0.00 179.45 179.90 3hmp h SER 715 N 0.00 1.03 0.22 0.86 0.02 -1.64 -1.69 113.55 112.35 3hmp h SER 715 Ca -0.00 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.84 3hmp h SER 715 Cb 0.29 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3hmp h SER 715 CO 0.02 0.73 -0.35 0.44 -1.14 0.00 0.00 176.83 176.54 3hmp h ASP 716 N 1.21 0.19 -0.41 3.07 3.32 -1.52 -3.03 116.42 119.25 3hmp h ASP 716 Ca 0.35 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 3hmp h ASP 716 Cb -0.09 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3hmp h ASP 716 CO -0.09 0.53 0.17 0.58 -1.72 0.00 0.00 179.24 178.71 3hmp h VAL 717 N 0.17 1.20 -0.23 -1.35 2.07 -1.18 -0.71 116.25 116.21 3hmp h VAL 717 Ca 0.02 -0.60 0.06 0.00 0.82 0.00 0.00 66.70 67.00 3hmp h VAL 717 Cb 0.70 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 3hmp h VAL 717 CO 0.05 0.22 -0.15 -0.25 0.02 0.00 0.00 177.57 177.47 3hmp h TRP 718 N 0.52 -0.36 -0.36 1.57 2.91 -1.31 0.20 115.95 119.12 3hmp h TRP 718 Ca 0.14 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 60.11 3hmp h TRP 718 Cb 0.18 0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 29.02 3hmp h TRP 718 CO -0.00 -0.21 -0.09 0.77 -1.03 0.00 0.00 178.44 177.88 3hmp h SER 719 N -0.13 0.70 -0.53 2.65 0.02 -1.42 0.13 113.55 114.96 3hmp h SER 719 Ca 0.13 -0.36 0.10 0.00 -0.84 0.00 0.00 61.79 60.81 3hmp h SER 719 Cb 0.32 -0.19 -0.08 0.00 0.14 0.00 0.00 62.40 62.59 3hmp h SER 719 CO -0.31 0.90 0.07 -0.07 -1.14 0.00 0.00 176.83 176.28 3hmp h LEU 720 N 0.48 -0.08 -0.79 5.07 3.38 -1.02 -0.93 115.31 121.42 3hmp h LEU 720 Ca 0.09 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.29 3hmp h LEU 720 Cb 0.60 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.43 3hmp h LEU 720 CO 0.04 -0.02 0.39 1.23 0.09 0.00 0.00 178.44 180.17 3hmp h GLY 721 N 0.20 1.23 1.61 0.83 0.00 0.64 -0.51 103.07 107.06 3hmp h GLY 721 Ca 0.27 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 3hmp h GLY 721 CO -0.39 0.01 -0.18 0.00 0.00 0.00 0.00 176.54 175.98 3hmp h ILE 723 N 0.42 1.27 -0.63 0.00 2.04 -0.21 -2.02 117.51 118.39 3hmp h ILE 723 Ca 0.07 -0.96 -0.09 0.00 1.00 0.00 0.00 64.86 64.89 3hmp h ILE 723 Cb 0.56 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 3hmp h ILE 723 CO 0.04 0.29 0.06 0.25 0.00 0.00 0.00 178.15 178.79 3hmp h LEU 724 N 0.09 1.04 -1.33 1.44 5.85 -1.05 -1.20 115.31 120.15 3hmp h LEU 724 Ca 0.05 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.54 3hmp h LEU 724 Cb 0.45 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 3hmp h LEU 724 CO 0.02 1.06 0.49 0.22 -0.34 0.00 0.00 178.44 179.89 3hmp h TYR 725 N 0.98 0.83 -0.24 1.25 5.03 -0.98 0.89 116.97 124.72 3hmp h TYR 725 Ca 0.19 0.02 -0.19 0.00 2.58 0.00 0.00 58.73 61.32 3hmp h TYR 725 Cb 0.49 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.50 3hmp h TYR 725 CO 0.04 0.45 -0.61 -0.92 -1.32 0.00 0.00 178.16 175.80 3hmp h TYR 726 N 0.83 1.05 0.00 -3.82 3.20 -1.00 0.77 116.97 118.00 3hmp h TYR 726 Ca 0.31 -0.40 0.00 0.00 3.14 0.00 0.00 58.73 61.79 3hmp h TYR 726 Cb 0.18 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.26 3hmp h TYR 726 CO -0.00 1.22 0.00 0.52 -1.64 0.00 0.00 178.16 178.26 3hmp h MET 727 N 0.61 0.00 0.00 1.82 2.86 -0.54 -1.48 114.93 118.20 3hmp h MET 727 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3hmp h MET 727 Cb 1.21 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.87 3hmp h MET 727 CO 0.13 0.00 -0.80 2.41 1.06 0.00 0.00 176.91 179.71 3hmp n THR 728 N -2.96 1.45 0.13 2.22 -1.04 0.24 -4.68 114.28 109.64 3hmp n THR 728 Ca 0.01 0.15 0.12 0.00 -2.04 0.00 0.00 64.05 62.28 3hmp n THR 728 Cb 0.29 -2.33 0.24 0.00 -1.82 0.00 0.00 70.33 66.71 3hmp n THR 728 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3hmp n TYR 729 N -4.54 0.61 -0.87 -1.42 4.01 0.25 -4.97 117.16 110.22 3hmp n TYR 729 Ca -0.13 -0.32 0.00 0.00 -0.16 0.00 0.00 57.90 57.29 3hmp n TYR 729 Cb 0.40 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 3hmp n TYR 729 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hmp n GLY 730 N 1.51 0.69 3.31 2.72 0.00 -0.56 -4.96 105.19 107.90 3hmp n GLY 730 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 3hmp n GLY 730 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hmp s LYS 731 N -0.31 1.11 0.53 1.61 -2.85 -1.25 -5.01 119.74 113.57 3hmp s LYS 731 Ca 0.00 -1.18 -0.07 0.00 -1.00 0.00 0.00 55.97 53.73 3hmp s LYS 731 Cb 0.00 0.36 -0.03 0.00 -2.06 0.00 0.00 37.83 36.10 3hmp s LYS 731 CO 0.00 -0.40 0.85 0.95 0.10 0.00 0.00 175.35 176.86 3hmp s THR 732 N -3.97 4.69 0.38 3.79 -4.23 -1.26 -3.31 115.64 111.73 3hmp s THR 732 Ca 0.17 0.32 0.12 0.00 -1.18 0.00 0.00 61.69 61.12 3hmp s THR 732 Cb 0.04 -3.81 0.34 0.00 1.34 0.00 0.00 72.50 70.41 3hmp s THR 732 CO -0.01 -0.86 1.86 -0.65 -0.54 0.00 0.00 174.62 174.42 3hmp h PRO 733 N 0.05 0.55 -0.08 3.99 0.11 -1.86 -2.62 132.00 132.14 3hmp h PRO 733 Ca -0.46 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hmp h PRO 733 Cb 1.21 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 3hmp h PRO 733 CO 0.62 0.37 -0.00 1.19 -0.21 0.00 0.00 178.00 179.96 3hmp n PHE 734 N -4.55 0.30 0.33 0.65 3.72 -1.26 -4.77 117.46 111.87 3hmp n PHE 734 Ca 0.18 -0.97 0.21 0.00 -0.05 0.00 0.00 57.45 56.83 3hmp n PHE 734 Cb 0.56 -0.20 1.12 0.00 -0.94 0.00 0.00 39.48 40.02 3hmp n PHE 734 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 3hmp h GLN 735 N 0.57 0.00 0.00 -1.08 4.15 -1.84 -2.67 115.11 114.25 3hmp h GLN 735 Ca 0.00 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.26 3hmp h GLN 735 Cb 1.14 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.81 3hmp h GLN 735 CO 0.07 0.00 -0.76 1.96 -1.93 0.00 0.00 178.83 178.18 3hmp h GLN 736 N 0.00 0.00 -6.27 1.69 7.50 -1.86 -3.44 115.11 112.73 3hmp h GLN 736 Ca -0.00 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.59 3hmp h GLN 736 Cb 0.08 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.58 3hmp h GLN 736 CO 0.00 0.76 1.11 0.42 -1.50 0.00 0.00 178.83 179.62 3hmp s ILE 737 N -3.20 3.73 -0.01 2.54 1.01 -1.01 -4.91 121.20 119.35 3hmp s ILE 737 Ca -0.00 0.83 -0.23 0.00 0.00 0.00 0.00 60.65 61.25 3hmp s ILE 737 Cb 0.11 -3.71 -0.15 0.00 0.01 0.00 0.00 42.46 38.72 3hmp s ILE 737 CO 0.78 -0.26 1.07 0.40 0.00 0.00 0.00 174.94 176.93 3hmp h ILE 738 N 6.04 0.48 -3.16 2.92 2.04 -1.89 -3.44 117.51 120.49 3hmp h ILE 738 Ca -0.34 -0.62 -0.53 0.00 1.00 0.00 0.00 64.86 64.37 3hmp h ILE 738 Cb 1.15 0.72 0.01 0.00 -0.74 0.00 0.00 36.82 37.96 3hmp h ILE 738 CO 1.00 0.09 0.58 0.21 0.00 0.00 0.00 178.15 180.03 3hmp s ASN 739 N -4.99 7.04 0.20 1.72 3.84 -1.26 -4.95 114.94 116.53 3hmp s ASN 739 Ca -0.13 2.06 -0.07 0.00 0.21 0.00 0.00 52.86 54.93 3hmp s ASN 739 Cb 0.02 -2.58 0.12 0.00 -0.55 0.00 0.00 41.25 38.26 3hmp s ASN 739 CO 0.47 -0.50 1.63 1.56 -2.79 0.00 0.00 177.10 177.47 3hmp h GLN 740 N 6.81 0.93 -0.39 0.43 1.08 -1.99 0.31 115.11 122.29 3hmp h GLN 740 Ca -0.42 -0.34 0.00 0.00 -1.45 0.00 0.00 58.65 56.44 3hmp h GLN 740 Cb 1.21 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.56 3hmp h GLN 740 CO 0.82 1.00 0.25 0.82 -0.95 0.00 0.00 178.83 180.76 3hmp h ILE 741 N 0.83 1.11 -0.45 2.54 2.04 -1.98 -1.12 117.51 120.48 3hmp h ILE 741 Ca 0.13 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.76 3hmp h ILE 741 Cb 0.67 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 3hmp h ILE 741 CO 0.05 0.11 0.29 0.28 0.00 0.00 0.00 178.15 178.88 3hmp h SER 742 N 0.52 0.49 -0.45 1.72 0.02 -1.92 -1.70 113.55 112.23 3hmp h SER 742 Ca 0.14 -0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.16 3hmp h SER 742 Cb -0.03 -0.11 -0.06 0.00 0.14 0.00 0.00 62.40 62.34 3hmp h SER 742 CO -0.03 0.35 0.08 0.50 -1.14 0.00 0.00 176.83 176.59 3hmp h LYS 743 N 0.58 0.21 -0.53 3.45 3.64 -0.55 0.18 116.57 123.55 3hmp h LYS 743 Ca 0.17 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 3hmp h LYS 743 Cb -0.04 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.71 3hmp h LYS 743 CO -0.05 0.14 0.23 -0.07 -2.27 0.00 0.00 179.45 177.42 3hmp h LEU 744 N 0.21 0.69 -0.62 5.20 3.38 -1.02 -1.11 115.31 122.04 3hmp h LEU 744 Ca 0.22 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.01 3hmp h LEU 744 Cb 0.29 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3hmp h LEU 744 CO -0.30 0.61 -0.05 0.45 0.09 0.00 0.00 178.44 179.24 3hmp h HIS 745 N 0.76 1.13 -0.44 1.13 3.86 -0.23 -2.99 115.15 118.38 3hmp h HIS 745 Ca 0.18 -0.21 -0.05 0.00 -1.16 0.00 0.00 60.37 59.13 3hmp h HIS 745 Cb 0.13 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.29 3hmp h HIS 745 CO 0.01 1.02 0.06 0.00 0.86 0.00 0.00 177.93 179.88 3hmp h ALA 746 N 1.00 0.58 -0.99 2.45 0.00 -0.16 -2.57 119.26 119.56 3hmp h ALA 746 Ca 0.16 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.92 3hmp h ALA 746 Cb 0.61 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 3hmp h ALA 746 CO 0.04 0.32 0.64 0.82 0.00 0.00 0.00 179.25 181.06 3hmp h ILE 747 N 0.59 1.04 -0.00 0.00 2.04 -1.17 -2.34 117.51 117.67 3hmp h ILE 747 Ca 0.13 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.61 3hmp h ILE 747 Cb 0.40 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.31 3hmp h ILE 747 CO 0.01 0.20 -0.42 2.30 0.00 0.00 0.00 178.15 180.24 3hmp n ILE 748 N -4.53 0.00 -3.08 -0.67 -5.35 -1.13 -4.62 119.36 99.98 3hmp n ILE 748 Ca 0.16 -0.07 -0.42 0.00 -0.27 0.00 0.00 62.75 62.15 3hmp n ILE 748 Cb 0.23 0.41 -0.06 0.00 -1.74 0.00 0.00 39.64 38.48 3hmp n ILE 748 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3hmp s ASP 749 N -2.75 6.40 0.35 7.28 2.15 -0.88 -4.95 116.67 124.27 3hmp s ASP 749 Ca 0.17 -0.03 0.04 0.00 0.43 0.00 0.00 52.55 53.16 3hmp s ASP 749 Cb 0.18 -2.34 0.67 0.00 -0.30 0.00 0.00 42.92 41.14 3hmp s ASP 749 CO 0.62 -0.71 1.98 -0.65 -0.17 0.00 0.00 175.17 176.25 3hmp h PRO 750 N 8.67 0.80 0.00 4.34 0.11 -1.90 -0.90 132.00 143.12 3hmp h PRO 750 Ca -0.26 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3hmp h PRO 750 Cb 1.10 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3hmp h PRO 750 CO 0.88 0.53 0.00 -0.91 -0.21 0.00 0.00 178.00 178.29 3hmp h ASN 751 N 0.83 0.00 -2.32 -2.05 2.35 -1.95 -3.39 115.58 109.05 3hmp h ASN 751 Ca 0.28 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.43 3hmp h ASN 751 Cb 0.07 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.33 3hmp h ASN 751 CO -0.08 0.00 0.90 -2.28 -1.65 0.00 0.00 177.43 174.33 3hmp s HIS 752 N -3.58 2.52 -0.08 1.19 2.46 -0.35 -5.00 115.29 112.45 3hmp s HIS 752 Ca 0.01 -0.43 -0.28 0.00 0.47 0.00 0.00 55.06 54.83 3hmp s HIS 752 Cb 0.09 -4.49 -0.02 0.00 -0.13 0.00 0.00 32.58 28.03 3hmp s HIS 752 CO 0.45 -1.86 0.92 -1.21 -2.47 0.00 0.00 174.74 170.58 3hmp s GLU 753 N 4.79 4.45 0.23 2.88 2.02 -1.26 -4.90 118.70 126.91 3hmp s GLU 753 Ca 0.31 1.26 -0.30 0.00 0.02 0.00 0.00 54.97 56.27 3hmp s GLU 753 Cb -0.10 -3.51 -0.09 0.00 0.10 0.00 0.00 34.13 30.54 3hmp s GLU 753 CO 0.08 -0.17 1.12 0.42 0.02 0.00 0.00 175.26 176.73 3hmp s ILE 754 N 1.53 3.58 0.03 -1.63 1.01 -1.26 -5.02 121.20 119.43 3hmp s ILE 754 Ca 0.46 1.47 -0.18 0.00 0.00 0.00 0.00 60.65 62.41 3hmp s ILE 754 Cb -0.19 -3.94 -0.06 0.00 0.01 0.00 0.00 42.46 38.28 3hmp s ILE 754 CO 0.20 0.30 0.51 -0.70 0.00 0.00 0.00 174.94 175.26 3hmp s GLU 755 N -0.93 4.13 -0.53 2.79 2.12 -1.26 -5.03 118.70 119.99 3hmp s GLU 755 Ca 0.48 0.61 0.05 0.00 0.36 0.00 0.00 54.97 56.47 3hmp s GLU 755 Cb -0.32 -3.26 0.19 0.00 0.26 0.00 0.00 34.13 31.00 3hmp s GLU 755 CO 0.39 0.59 0.46 1.19 -0.54 0.00 0.00 175.26 177.35 3hmp n PHE 756 N 2.01 0.98 -1.67 5.30 3.72 -1.26 -5.08 117.46 121.47 3hmp n PHE 756 Ca -0.11 -3.76 -0.42 0.00 -0.05 0.00 0.00 57.45 53.12 3hmp n PHE 756 Cb 0.51 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.87 3hmp n PHE 756 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3hmp n PRO 757 N 2.16 1.79 -1.88 -1.08 -0.02 -1.26 -4.88 135.00 129.82 3hmp n PRO 757 Ca 0.26 0.63 -0.41 0.00 -2.02 0.00 0.00 63.50 61.96 3hmp n PRO 757 Cb 0.44 -2.24 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 3hmp n PRO 757 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hmp s ASP 758 N -0.53 6.45 0.08 2.55 1.11 -1.26 -5.02 116.67 120.06 3hmp s ASP 758 Ca 0.60 2.95 -0.00 0.00 0.18 0.00 0.00 52.55 56.28 3hmp s ASP 758 Cb -0.55 -2.66 -0.04 0.00 1.07 0.00 0.00 42.92 40.74 3hmp s ASP 758 CO 0.59 -0.79 -0.02 0.27 1.18 0.00 0.00 175.17 176.39 3hmp s ILE 759 N -1.04 0.34 0.21 0.77 -4.36 -1.26 -5.07 121.20 110.80 3hmp s ILE 759 Ca 0.52 -1.87 -0.08 0.00 -0.26 0.00 0.00 60.65 58.96 3hmp s ILE 759 Cb -0.45 -1.68 0.15 0.00 1.25 0.00 0.00 42.46 41.74 3hmp s ILE 759 CO 0.60 -0.85 1.79 -0.65 0.24 0.00 0.00 174.94 176.06 3hmp h PRO 760 N 3.03 0.62 -6.16 0.37 0.11 -2.05 -3.35 132.00 124.56 3hmp h PRO 760 Ca -0.35 -0.04 -0.57 0.00 0.11 0.00 0.00 66.00 65.16 3hmp h PRO 760 Cb 1.16 -0.14 -0.09 0.00 0.11 0.00 0.00 31.00 32.04 3hmp h PRO 760 CO 0.64 0.41 1.34 -1.21 -0.21 0.00 0.00 178.00 178.98 3hmp s GLU 761 N -6.08 3.42 0.35 1.05 2.02 -1.26 -4.81 118.70 113.39 3hmp s GLU 761 Ca -0.13 -0.81 0.10 0.00 0.02 0.00 0.00 54.97 54.15 3hmp s GLU 761 Cb 0.17 -5.00 0.63 0.00 0.10 0.00 0.00 34.13 30.03 3hmp s GLU 761 CO 0.76 -2.25 1.80 0.87 0.02 0.00 0.00 175.26 176.46 3hmp h LYS 762 N 10.01 0.15 -0.50 1.61 1.79 -2.00 -2.50 116.57 125.12 3hmp h LYS 762 Ca 0.05 -0.06 -0.10 0.00 -2.18 0.00 0.00 60.65 58.36 3hmp h LYS 762 Cb 1.02 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.65 3hmp h LYS 762 CO 1.38 0.47 -0.10 -0.44 -1.08 0.00 0.00 179.45 179.67 3hmp h ASP 763 N 0.13 0.92 -0.58 0.86 3.32 -1.95 -1.23 116.42 117.90 3hmp h ASP 763 Ca 0.02 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.75 3hmp h ASP 763 Cb 0.65 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 3hmp h ASP 763 CO 0.05 1.04 0.28 0.25 -1.72 0.00 0.00 179.24 179.14 3hmp h LEU 764 N 0.83 0.76 -0.76 1.55 5.85 -1.89 -1.61 115.31 120.03 3hmp h LEU 764 Ca 0.13 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3hmp h LEU 764 Cb 0.64 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 3hmp h LEU 764 CO 0.04 0.67 0.39 -0.61 -0.34 0.00 0.00 178.44 178.59 3hmp h GLN 765 N 0.79 1.07 -0.47 1.25 4.15 -1.21 -2.42 115.11 118.27 3hmp h GLN 765 Ca 0.20 -0.14 -0.10 0.00 0.77 0.00 0.00 58.65 59.37 3hmp h GLN 765 Cb 0.12 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.59 3hmp h GLN 765 CO -0.03 0.82 -0.12 0.22 -1.93 0.00 0.00 178.83 177.79 3hmp h ASP 766 N 1.06 0.87 -0.30 -0.69 3.58 -0.99 -2.41 116.42 117.53 3hmp h ASP 766 Ca 0.26 -0.28 0.03 0.00 0.42 0.00 0.00 57.03 57.47 3hmp h ASP 766 Cb 0.08 -0.24 -0.03 0.00 1.72 0.00 0.00 39.33 40.86 3hmp h ASP 766 CO -0.04 1.00 0.10 0.58 -2.88 0.00 0.00 179.24 178.00 3hmp h VAL 767 N 0.78 0.92 -0.75 2.25 2.07 -1.00 -1.06 116.25 119.46 3hmp h VAL 767 Ca 0.13 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.60 3hmp h VAL 767 Cb 0.64 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3hmp h VAL 767 CO 0.04 0.04 0.47 -0.07 0.02 0.00 0.00 177.57 178.08 3hmp h LEU 768 N 0.23 0.77 -0.60 2.57 3.38 -1.34 -0.08 115.31 120.25 3hmp h LEU 768 Ca 0.13 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 3hmp h LEU 768 Cb 0.10 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3hmp h LEU 768 CO -0.14 0.53 -0.37 0.11 0.09 0.00 0.00 178.44 178.66 3hmp h LYS 769 N 0.91 0.71 -0.38 1.13 1.57 -1.18 -1.72 116.57 117.62 3hmp h LYS 769 Ca 0.30 -0.35 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 3hmp h LYS 769 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 3hmp h LYS 769 CO -0.12 0.96 -0.25 0.00 -0.57 0.00 0.00 179.45 179.47 3hmp n LEU 772 N -3.84 6.52 -4.68 0.00 4.77 -0.66 -3.98 117.00 115.13 3hmp n LEU 772 Ca -0.03 -3.45 -0.43 0.00 -0.03 0.00 0.00 56.01 52.07 3hmp n LEU 772 Cb 0.66 -0.81 -0.02 0.00 -2.33 0.00 0.00 43.42 40.92 3hmp n LEU 772 CO 0.46 0.96 0.91 -0.54 -1.33 0.00 0.00 177.39 177.85 3hmp s LYS 773 N -3.16 4.34 0.45 3.23 1.02 -1.22 -4.96 119.74 119.44 3hmp s LYS 773 Ca 0.56 1.51 0.10 0.00 0.02 0.00 0.00 55.97 58.16 3hmp s LYS 773 Cb 0.46 -3.60 1.01 0.00 -0.52 0.00 0.00 37.83 35.18 3hmp s LYS 773 CO 0.12 -0.48 2.09 0.00 -0.92 0.00 0.00 175.35 176.16 3hmp h ARG 774 N 7.45 0.34 -6.12 1.68 3.08 -1.94 -3.39 114.38 115.48 3hmp h ARG 774 Ca -0.29 -0.02 -0.58 0.00 0.07 0.00 0.00 59.98 59.16 3hmp h ARG 774 Cb 1.13 -0.08 -0.10 0.00 0.08 0.00 0.00 29.97 31.00 3hmp h ARG 774 CO 0.91 0.23 0.76 0.34 -1.07 0.00 0.00 179.97 181.14 3hmp s ASP 775 N -6.83 6.34 0.45 7.04 -1.08 -1.26 -4.64 116.67 116.69 3hmp s ASP 775 Ca -0.07 -0.27 0.24 0.00 -0.52 0.00 0.00 52.55 51.94 3hmp s ASP 775 Cb 0.17 -2.49 1.26 0.00 -1.46 0.00 0.00 42.92 40.40 3hmp s ASP 775 CO 0.71 -1.40 1.79 1.55 0.52 0.00 0.00 175.17 178.34 3hmp h PRO 776 N 9.50 0.25 -0.93 4.34 0.13 -1.94 0.13 132.00 143.47 3hmp h PRO 776 Ca -0.26 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 64.87 3hmp h PRO 776 Cb 1.06 -0.06 -0.05 0.00 0.13 0.00 0.00 31.00 32.09 3hmp h PRO 776 CO 1.15 0.16 0.62 0.87 -0.23 0.00 0.00 178.00 180.57 3hmp h LYS 777 N 0.25 1.20 0.00 0.86 1.57 -1.94 -2.79 116.57 115.73 3hmp h LYS 777 Ca 0.57 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 3hmp h LYS 777 Cb 1.72 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 33.76 3hmp h LYS 777 CO -0.19 0.80 -0.56 1.96 -0.57 0.00 0.00 179.45 180.88 3hmp h GLN 778 N 1.24 0.00 -6.92 3.15 1.08 -1.17 -3.46 115.11 109.02 3hmp h GLN 778 Ca 0.35 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 57.02 3hmp h GLN 778 Cb -0.10 0.00 0.08 0.00 -0.05 0.00 0.00 27.48 27.41 3hmp h GLN 778 CO -0.09 0.00 0.66 0.50 -0.95 0.00 0.00 178.83 178.95 3hmp s ARG 779 N -3.20 4.12 0.65 1.46 3.52 -0.53 -4.98 118.95 119.99 3hmp s ARG 779 Ca 0.06 2.28 -0.17 0.00 -0.13 0.00 0.00 55.73 57.76 3hmp s ARG 779 Cb 0.12 -2.91 -0.01 0.00 -1.56 0.00 0.00 34.95 30.59 3hmp s ARG 779 CO 0.71 -0.41 1.20 -1.50 -0.81 0.00 0.00 175.30 174.50 3hmp s ILE 780 N -1.18 2.57 0.46 4.11 2.07 -1.02 -4.98 121.20 123.23 3hmp s ILE 780 Ca 0.53 0.32 0.05 0.00 -1.41 0.00 0.00 60.65 60.14 3hmp s ILE 780 Cb -0.41 -3.01 0.01 0.00 0.13 0.00 0.00 42.46 39.19 3hmp s ILE 780 CO 0.54 -0.11 0.64 -0.94 -1.91 0.00 0.00 174.94 173.16 3hmp s SER 781 N -1.83 5.58 0.10 4.50 1.04 -1.26 -4.91 113.70 116.93 3hmp s SER 781 Ca 0.76 -0.17 -0.16 0.00 0.48 0.00 0.00 55.95 56.85 3hmp s SER 781 Cb -0.29 -0.90 -0.05 0.00 0.10 0.00 0.00 66.02 64.87 3hmp s SER 781 CO 0.38 -0.84 1.52 0.40 0.98 0.00 0.00 173.24 175.68 3hmp h ILE 782 N 0.45 1.27 -0.88 -1.02 1.08 -1.96 -0.73 117.51 115.72 3hmp h ILE 782 Ca -0.42 -1.06 0.07 0.00 -0.39 0.00 0.00 64.86 63.06 3hmp h ILE 782 Cb 1.28 1.30 -0.07 0.00 -3.07 0.00 0.00 36.82 36.26 3hmp h ILE 782 CO 0.50 0.34 0.54 -0.65 -0.69 0.00 0.00 178.15 178.19 3hmp h PRO 783 N 0.39 0.93 -0.62 2.37 0.11 -1.98 -0.71 132.00 132.49 3hmp h PRO 783 Ca 0.09 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.10 3hmp h PRO 783 Cb 0.52 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.39 3hmp h PRO 783 CO 0.03 0.61 0.21 0.93 -0.21 0.00 0.00 178.00 179.57 3hmp h GLU 784 N 0.96 0.96 -0.21 1.05 5.08 -1.94 -2.75 114.58 117.72 3hmp h GLU 784 Ca 0.40 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 3hmp h GLU 784 Cb 0.24 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3hmp h GLU 784 CO -0.20 0.84 0.09 -0.07 -1.00 0.00 0.00 179.01 178.67 3hmp h LEU 785 N 0.89 0.25 -0.51 1.33 3.38 -0.64 -2.47 115.31 117.54 3hmp h LEU 785 Ca 0.20 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 3hmp h LEU 785 Cb 0.26 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3hmp h LEU 785 CO -0.01 0.23 -0.18 -0.07 0.09 0.00 0.00 178.44 178.50 3hmp h LEU 786 N 0.29 0.00 -1.59 1.67 3.38 -0.86 -2.62 115.31 115.57 3hmp h LEU 786 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3hmp h LEU 786 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3hmp h LEU 786 CO -0.01 0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.70 3hmp n ALA 787 N -2.16 2.49 -1.78 1.53 0.00 -1.01 -4.75 120.51 114.83 3hmp n ALA 787 Ca 0.02 -0.68 -0.40 0.00 0.00 0.00 0.00 53.44 52.38 3hmp n ALA 787 Cb 0.52 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 18.94 3hmp n ALA 787 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3hmp s HIS 788 N -1.77 3.58 0.44 0.00 5.04 -0.96 -4.84 115.29 116.78 3hmp s HIS 788 Ca 0.34 1.69 0.21 0.00 -1.54 0.00 0.00 55.06 55.77 3hmp s HIS 788 Cb 0.20 -3.29 1.19 0.00 0.04 0.00 0.00 32.58 30.72 3hmp s HIS 788 CO 0.30 -0.56 1.84 -1.00 -2.34 0.00 0.00 174.74 172.97 3hmp h PRO 789 N 3.93 0.30 -0.77 2.88 0.13 -1.92 -0.58 132.00 135.97 3hmp h PRO 789 Ca -0.46 -0.02 0.12 0.00 -0.87 0.00 0.00 66.00 64.77 3hmp h PRO 789 Cb 1.21 -0.07 -0.08 0.00 0.13 0.00 0.00 31.00 32.19 3hmp h PRO 789 CO 0.67 0.20 0.38 -0.92 -0.23 0.00 0.00 178.00 178.10 3hmp h TYR 790 N 0.30 0.67 0.00 1.56 3.20 -1.91 -0.56 116.97 120.23 3hmp h TYR 790 Ca 0.50 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.40 3hmp h TYR 790 Cb 1.41 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.50 3hmp h TYR 790 CO -0.00 0.19 -0.96 1.33 -1.64 0.00 0.00 178.16 177.08 3hmp n VAL 791 N -4.88 0.33 -0.10 1.81 0.24 -0.35 -4.54 118.33 110.84 3hmp n VAL 791 Ca 0.14 -0.35 -0.16 0.00 -2.04 0.00 0.00 64.34 61.93 3hmp n VAL 791 Cb 0.35 -0.05 -0.13 0.00 -1.47 0.00 0.00 33.84 32.54 3hmp n VAL 791 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hmp n GLN 792 N -2.21 0.67 -3.48 7.34 1.13 -0.48 -5.01 117.38 115.34 3hmp n GLN 792 Ca 0.01 0.14 -0.38 0.00 -1.94 0.00 0.00 57.00 54.83 3hmp n GLN 792 Cb 0.47 -1.56 -0.06 0.00 0.11 0.00 0.00 30.24 29.20 3hmp n GLN 792 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3hmp s ILE 793 N -2.52 5.06 0.00 5.09 1.01 -0.26 -5.05 121.20 124.53 3hmp s ILE 793 Ca -0.25 0.84 0.00 0.00 0.00 0.00 0.00 60.65 61.24 3hmp s ILE 793 Cb 0.08 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.83 3hmp s ILE 793 CO 0.70 0.54 0.00 0.00 0.00 0.00 0.00 174.94 176.17