#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o7n n ILE 503 N 0.00 0.34 -4.05 2.02 5.41 -1.26 -4.99 119.36 116.82 1o7n n ILE 503 Ca 0.00 -0.08 -0.32 0.00 1.00 0.00 0.00 62.75 63.35 1o7n n ILE 503 Cb 0.00 -1.84 -0.15 0.00 -0.71 0.00 0.00 39.64 36.94 1o7n n ILE 503 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1o7n s ASN 504 N 0.87 4.28 0.00 4.38 3.84 -1.26 -5.00 114.94 122.05 1o7n s ASN 504 Ca 0.73 -1.32 0.21 0.00 0.21 0.00 0.00 52.86 52.68 1o7n s ASN 504 Cb -0.55 -1.49 0.89 0.00 -0.55 0.00 0.00 41.25 39.54 1o7n s ASN 504 CO 0.39 -0.19 1.67 2.30 -2.79 0.00 0.00 177.10 178.48 1o7n n ILE 505 N 4.48 0.57 0.08 -5.21 -5.35 -1.26 -0.16 119.36 112.50 1o7n n ILE 505 Ca -0.14 0.14 -0.07 0.00 -0.27 0.00 0.00 62.75 62.41 1o7n n ILE 505 Cb 0.43 -0.78 0.05 0.00 -1.74 0.00 0.00 39.64 37.59 1o7n n ILE 505 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1o7n h GLN 506 N 0.00 0.24 0.02 6.28 5.75 -1.94 -3.34 115.11 122.12 1o7n h GLN 506 Ca 0.00 -0.21 -0.18 0.00 -0.15 0.00 0.00 58.65 58.10 1o7n h GLN 506 Cb 0.36 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.94 1o7n h GLN 506 CO 0.00 0.89 -1.00 0.93 -2.65 0.00 0.00 178.83 177.00 1o7n h GLU 507 N 0.16 0.04 -5.30 1.69 5.08 -1.78 -3.41 114.58 111.06 1o7n h GLU 507 Ca -0.03 -0.06 -0.69 0.00 -1.00 0.00 0.00 59.36 57.58 1o7n h GLU 507 Cb 1.33 0.02 -0.14 0.00 0.50 0.00 0.00 28.75 30.46 1o7n h GLU 507 CO 0.12 1.03 1.42 -0.51 -1.00 0.00 0.00 179.01 180.06 1o7n s ASP 508 N -6.73 6.80 0.58 1.42 -0.00 0.78 -4.83 116.67 114.69 1o7n s ASP 508 Ca -0.25 -2.35 0.28 0.00 -0.00 0.00 0.00 52.55 50.23 1o7n s ASP 508 Cb 0.04 -2.47 1.76 0.00 -0.00 0.00 0.00 42.92 42.24 1o7n s ASP 508 CO 0.64 -1.06 2.24 0.11 -0.00 0.00 0.00 175.17 177.10 1o7n h LYS 509 N 8.17 0.00 -0.01 8.23 1.79 -1.80 -2.05 116.57 130.90 1o7n h LYS 509 Ca 0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 1o7n h LYS 509 Cb 0.94 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.59 1o7n h LYS 509 CO 1.28 0.01 -0.12 1.28 -1.08 0.00 0.00 179.45 180.83 1o7n n LEU 510 N -3.89 1.26 -4.74 2.94 4.77 -1.26 -4.91 117.00 111.17 1o7n n LEU 510 Ca -0.03 -0.38 -0.37 0.00 -0.03 0.00 0.00 56.01 55.20 1o7n n LEU 510 Cb 0.09 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 1o7n n LEU 510 CO 0.28 0.22 0.09 -0.69 -1.33 0.00 0.00 177.39 175.96 1o7n s VAL 511 N -2.24 5.21 0.54 4.08 1.01 -0.77 -5.06 120.40 123.17 1o7n s VAL 511 Ca 0.32 0.78 -0.15 0.00 0.00 0.00 0.00 61.98 62.92 1o7n s VAL 511 Cb 0.20 -3.73 -0.07 0.00 0.00 0.00 0.00 36.38 32.79 1o7n s VAL 511 CO 0.42 0.39 1.00 -0.94 0.00 0.00 0.00 175.10 175.97 1o7n s SER 512 N 0.28 6.47 0.21 3.32 1.04 -1.26 -4.88 113.70 118.87 1o7n s SER 512 Ca 0.22 1.57 -0.10 0.00 0.48 0.00 0.00 55.95 58.12 1o7n s SER 512 Cb -0.15 -2.50 0.18 0.00 0.10 0.00 0.00 66.02 63.65 1o7n s SER 512 CO 0.08 -0.70 1.87 0.00 0.98 0.00 0.00 173.24 175.47 1o7n h ALA 513 N 0.64 0.95 -0.17 5.32 0.00 -1.98 -1.29 119.26 122.72 1o7n h ALA 513 Ca -0.46 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.44 1o7n h ALA 513 Cb 1.19 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1o7n h ALA 513 CO 0.61 0.30 -0.01 1.25 0.00 0.00 0.00 179.25 181.41 1o7n h HIS 514 N 0.95 -0.02 -0.89 0.00 -0.00 -2.00 -1.38 115.15 111.80 1o7n h HIS 514 Ca 0.28 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.65 1o7n h HIS 514 Cb -0.05 0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 27.36 1o7n h HIS 514 CO -0.03 -0.03 0.49 -0.44 -0.00 0.00 0.00 177.93 177.92 1o7n h ASP 515 N 0.05 1.12 -0.57 3.26 3.45 -1.85 -2.16 116.42 119.72 1o7n h ASP 515 Ca 0.08 -0.10 -0.05 0.00 0.43 0.00 0.00 57.03 57.39 1o7n h ASP 515 Cb 0.10 -0.29 -0.03 0.00 -0.56 0.00 0.00 39.33 38.56 1o7n h ASP 515 CO -0.14 0.90 0.20 0.00 -1.57 0.00 0.00 179.24 178.63 1o7n h ALA 516 N 1.27 1.19 -0.87 3.45 0.00 -0.93 -2.30 119.26 121.07 1o7n h ALA 516 Ca 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1o7n h ALA 516 Cb 0.03 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1o7n h ALA 516 CO -0.05 0.57 0.50 0.93 0.00 0.00 0.00 179.25 181.20 1o7n h GLU 517 N 0.90 1.20 -0.25 0.00 5.08 -0.67 -2.49 114.58 118.36 1o7n h GLU 517 Ca 0.20 -0.13 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 1o7n h GLU 517 Cb 0.25 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1o7n h GLU 517 CO -0.01 0.87 -0.37 0.93 -1.00 0.00 0.00 179.01 179.43 1o7n h GLU 518 N 1.21 0.55 -0.15 2.33 4.39 -1.00 -2.59 114.58 119.32 1o7n h GLU 518 Ca 0.31 -0.26 0.04 0.00 0.34 0.00 0.00 59.36 59.79 1o7n h GLU 518 Cb -0.00 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.60 1o7n h GLU 518 CO -0.05 0.84 -0.11 0.82 -1.16 0.00 0.00 179.01 179.35 1o7n h ILE 519 N 0.46 0.69 -0.88 3.13 1.08 -1.22 -2.46 117.51 118.31 1o7n h ILE 519 Ca 0.05 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.63 1o7n h ILE 519 Cb 0.85 0.69 -0.07 0.00 -3.07 0.00 0.00 36.82 35.23 1o7n h ILE 519 CO 0.07 0.00 0.57 0.25 -0.69 0.00 0.00 178.15 178.35 1o7n h LEU 520 N -0.11 0.75 -1.10 1.44 5.85 -1.20 -1.62 115.31 119.33 1o7n h LEU 520 Ca 0.09 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1o7n h LEU 520 Cb 0.25 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1o7n h LEU 520 CO -0.22 0.43 -0.22 0.08 -0.34 0.00 0.00 178.44 178.16 1o7n h ARG 521 N 0.82 0.36 0.00 1.25 0.11 -1.05 -3.24 114.38 112.63 1o7n h ARG 521 Ca 0.42 -0.12 -0.17 0.00 0.10 0.00 0.00 59.98 60.21 1o7n h ARG 521 Cb 0.50 -0.03 -0.03 0.00 1.11 0.00 0.00 29.97 31.51 1o7n h ARG 521 CO -0.18 0.57 -1.73 1.19 0.10 0.00 0.00 179.97 179.92 1o7n n PHE 522 N -4.16 0.57 0.24 4.08 3.72 -0.86 -4.09 117.46 116.95 1o7n n PHE 522 Ca -0.00 0.19 0.13 0.00 -0.05 0.00 0.00 57.45 57.71 1o7n n PHE 522 Cb 0.36 -0.95 0.49 0.00 -0.94 0.00 0.00 39.48 38.45 1o7n n PHE 522 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 1o7n h PHE 523 N 0.00 0.00 -2.85 1.38 -1.00 -1.34 -3.44 116.94 109.69 1o7n h PHE 523 Ca -0.21 0.00 -0.64 0.00 2.81 0.00 0.00 57.97 59.93 1o7n h PHE 523 Cb 1.59 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 41.09 1o7n h PHE 523 CO 0.00 0.11 -0.51 -0.80 -1.61 0.00 0.00 178.31 175.50 1o7n s ASN 524 N -5.99 6.26 -0.70 2.17 -0.87 -1.22 -4.75 114.94 109.83 1o7n s ASN 524 Ca 0.02 0.31 -0.03 0.00 -1.57 0.00 0.00 52.86 51.59 1o7n s ASN 524 Cb 0.09 -1.94 0.00 0.00 -0.02 0.00 0.00 41.25 39.38 1o7n s ASN 524 CO 0.61 0.26 0.67 0.00 -2.57 0.00 0.00 177.10 176.07 1o7n s HIS 526 N -2.90 3.63 -0.31 0.00 2.46 -1.26 -4.94 115.29 111.97 1o7n s HIS 526 Ca 0.04 1.27 0.02 0.00 0.47 0.00 0.00 55.06 56.86 1o7n s HIS 526 Cb -0.01 -2.76 0.09 0.00 -0.13 0.00 0.00 32.58 29.78 1o7n s HIS 526 CO 0.78 0.19 0.05 0.34 -2.47 0.00 0.00 174.74 173.62 1o7n s ASP 527 N 0.40 4.36 0.30 9.88 -1.08 -1.26 -5.01 116.67 124.26 1o7n s ASP 527 Ca 0.36 -1.80 0.02 0.00 -0.52 0.00 0.00 52.55 50.61 1o7n s ASP 527 Cb -0.18 -1.29 0.58 0.00 -1.46 0.00 0.00 42.92 40.57 1o7n s ASP 527 CO 0.19 -0.37 1.88 0.28 0.52 0.00 0.00 175.17 177.67 1o7n h SER 528 N 7.84 0.88 -0.87 -0.34 0.02 -1.98 -2.22 113.55 116.87 1o7n h SER 528 Ca -0.10 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 1o7n h SER 528 Cb 1.03 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.37 1o7n h SER 528 CO 0.48 0.51 0.47 0.00 -1.14 0.00 0.00 176.83 177.16 1o7n h ALA 529 N 1.53 1.18 -0.59 3.77 0.00 -2.00 -1.94 119.26 121.21 1o7n h ALA 529 Ca 0.44 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 1o7n h ALA 529 Cb 0.38 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1o7n h ALA 529 CO -0.20 0.66 0.01 1.25 0.00 0.00 0.00 179.25 180.97 1o7n h LEU 530 N 1.23 1.02 -0.78 0.00 5.85 -1.83 -0.55 115.31 120.26 1o7n h LEU 530 Ca 0.31 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1o7n h LEU 530 Cb 0.04 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 1o7n h LEU 530 CO -0.05 1.08 0.51 -0.61 -0.34 0.00 0.00 178.44 179.03 1o7n h GLN 531 N 0.94 1.02 -0.37 1.25 -0.00 -0.91 -0.24 115.11 116.80 1o7n h GLN 531 Ca 0.17 -0.06 -0.16 0.00 -0.00 0.00 0.00 58.65 58.60 1o7n h GLN 531 Cb 0.55 -0.23 -0.01 0.00 0.00 0.00 0.00 27.48 27.79 1o7n h GLN 531 CO 0.03 0.67 -0.39 1.96 0.00 0.00 0.00 178.83 181.10 1o7n h GLN 532 N 1.05 0.92 -0.80 1.69 7.50 -1.06 -1.35 115.11 123.06 1o7n h GLN 532 Ca 0.29 -0.49 -0.02 0.00 0.50 0.00 0.00 58.65 58.92 1o7n h GLN 532 Cb -0.11 0.02 -0.04 0.00 0.05 0.00 0.00 27.48 27.40 1o7n h GLN 532 CO -0.07 1.15 0.40 1.49 -1.50 0.00 0.00 178.83 180.31 1o7n h GLU 533 N 0.74 1.13 -0.44 1.46 4.81 -0.87 -1.38 114.58 120.03 1o7n h GLU 533 Ca 0.06 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.04 1o7n h GLU 533 Cb 0.99 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1o7n h GLU 533 CO 0.10 0.86 -0.09 0.00 -0.73 0.00 0.00 179.01 179.15 1o7n h ALA 534 N 1.21 1.01 -0.46 2.92 0.00 -0.85 -1.29 119.26 121.80 1o7n h ALA 534 Ca 0.28 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1o7n h ALA 534 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1o7n h ALA 534 CO -0.04 0.60 0.15 1.15 0.00 0.00 0.00 179.25 181.11 1o7n h THR 535 N 0.71 1.22 -0.21 0.00 2.02 -0.75 -1.33 112.91 114.57 1o7n h THR 535 Ca 0.12 -0.72 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1o7n h THR 535 Cb 0.56 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1o7n h THR 535 CO 0.03 0.26 0.11 0.74 0.37 0.00 0.00 175.52 177.04 1o7n h THR 536 N 0.61 1.12 -0.29 3.16 2.02 -0.91 -0.90 112.91 117.72 1o7n h THR 536 Ca 0.15 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 67.04 1o7n h THR 536 Cb 0.25 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 1o7n h THR 536 CO -0.01 0.11 0.08 0.25 0.37 0.00 0.00 175.52 176.33 1o7n h LEU 537 N 0.23 0.07 -0.88 2.58 5.85 -1.08 -0.58 115.31 121.51 1o7n h LEU 537 Ca 0.07 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.72 1o7n h LEU 537 Cb 0.08 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1o7n h LEU 537 CO -0.01 0.08 -0.44 -0.07 -0.34 0.00 0.00 178.44 177.66 1o7n h LEU 538 N 0.21 0.29 -0.51 2.25 3.38 -1.11 -0.89 115.31 118.92 1o7n h LEU 538 Ca 0.13 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1o7n h LEU 538 Cb 0.12 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1o7n h LEU 538 CO -0.15 0.69 -0.21 0.74 0.09 0.00 0.00 178.44 179.60 1o7n h THR 539 N 0.22 1.27 -0.39 0.22 2.02 -0.69 -1.20 112.91 114.36 1o7n h THR 539 Ca 0.02 -1.37 -0.13 0.00 0.77 0.00 0.00 66.41 65.70 1o7n h THR 539 Cb 0.86 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 1o7n h THR 539 CO 0.07 0.47 -0.26 1.56 0.37 0.00 0.00 175.52 177.73 1o7n h GLN 540 N 0.86 0.86 -0.46 6.66 4.20 -0.84 -1.36 115.11 125.03 1o7n h GLN 540 Ca 0.11 -0.41 0.03 0.00 0.06 0.00 0.00 58.65 58.45 1o7n h GLN 540 Cb 0.78 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.52 1o7n h GLN 540 CO 0.07 1.05 0.25 1.49 -0.67 0.00 0.00 178.83 181.01 1o7n h GLU 541 N 0.67 0.48 -0.23 1.46 4.81 -1.08 -1.76 114.58 118.94 1o7n h GLU 541 Ca 0.08 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1o7n h GLU 541 Cb 0.83 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 1o7n h GLU 541 CO 0.07 0.32 -0.11 0.00 -0.73 0.00 0.00 179.01 178.56 1o7n h ALA 542 N 1.23 1.40 -0.22 2.92 0.00 -1.02 -1.47 119.26 122.11 1o7n h ALA 542 Ca 0.19 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1o7n h ALA 542 Cb 0.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1o7n h ALA 542 CO -0.12 0.41 -0.07 1.25 0.00 0.00 0.00 179.25 180.73 1o7n h HIS 543 N 0.35 0.48 -0.61 0.00 -0.00 -0.86 0.86 115.15 115.37 1o7n h HIS 543 Ca 0.07 -0.11 0.03 0.00 -0.00 0.00 0.00 60.37 60.36 1o7n h HIS 543 Cb 0.40 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 27.66 1o7n h HIS 543 CO 0.01 0.68 0.38 -0.07 -0.00 0.00 0.00 177.93 178.92 1o7n h LEU 544 N 0.15 0.62 -0.54 0.26 3.38 -0.91 -2.04 115.31 116.21 1o7n h LEU 544 Ca 0.05 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1o7n h LEU 544 Cb 0.53 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1o7n h LEU 544 CO 0.02 0.43 -0.03 -0.07 0.09 0.00 0.00 178.44 178.89 1o7n h LEU 545 N 0.74 0.97 -1.25 1.67 3.38 -1.13 -0.86 115.31 118.83 1o7n h LEU 545 Ca 0.24 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1o7n h LEU 545 Cb 0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1o7n h LEU 545 CO -0.10 1.05 0.07 0.44 0.09 0.00 0.00 178.44 179.99 1o7n h ASP 546 N 0.86 0.53 -0.22 -0.43 3.32 -0.33 -0.80 116.42 119.36 1o7n h ASP 546 Ca 0.15 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1o7n h ASP 546 Cb 0.57 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1o7n h ASP 546 CO 0.03 0.56 0.00 2.30 -1.72 0.00 0.00 179.24 180.41 1o7n n ILE 547 N -4.31 0.29 -3.09 0.35 -5.35 -0.81 -4.23 119.36 102.20 1o7n n ILE 547 Ca 0.02 -0.35 -0.19 0.00 -0.27 0.00 0.00 62.75 61.96 1o7n n ILE 547 Cb 0.21 0.24 0.04 0.00 -1.74 0.00 0.00 39.64 38.39 1o7n n ILE 547 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1o7n n GLN 548 N 0.26 -5.11 -1.87 6.28 6.02 -0.31 -4.92 117.38 117.73 1o7n n GLN 548 Ca 0.13 0.75 -0.40 0.00 -0.01 0.00 0.00 57.00 57.47 1o7n n GLN 548 Cb 0.27 -5.36 -0.01 0.00 1.02 0.00 0.00 30.24 26.17 1o7n n GLN 548 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1o7n n ALA 549 N -3.77 6.76 0.00 -1.58 0.00 -0.34 -4.75 120.51 116.82 1o7n n ALA 549 Ca -0.06 -3.98 -0.02 0.00 0.00 0.00 0.00 53.44 49.38 1o7n n ALA 549 Cb 0.58 -2.96 0.24 0.00 0.00 0.00 0.00 19.45 17.31 1o7n n ALA 549 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1o7n h TYR 550 N 4.88 0.56 -0.32 0.00 0.99 -1.92 0.88 116.97 122.05 1o7n h TYR 550 Ca 0.70 -0.09 -0.07 0.00 2.00 0.00 0.00 58.73 61.27 1o7n h TYR 550 Cb 0.35 -0.15 -0.01 0.00 1.00 0.00 0.00 36.73 37.92 1o7n h TYR 550 CO 1.62 0.63 -0.06 0.00 -0.00 0.00 0.00 178.16 180.35 1o7n h ARG 551 N 0.48 0.60 -0.72 4.88 3.08 -1.94 -1.27 114.38 119.49 1o7n h ARG 551 Ca 0.09 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 1o7n h ARG 551 Cb 0.52 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 1o7n h ARG 551 CO 0.03 0.78 0.38 0.00 -1.07 0.00 0.00 179.97 180.09 1o7n h ALA 552 N 0.81 1.31 -0.28 0.04 0.00 -1.81 -0.07 119.26 119.26 1o7n h ALA 552 Ca 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1o7n h ALA 552 Cb 0.55 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1o7n h ALA 552 CO 0.03 0.55 0.15 2.35 0.00 0.00 0.00 179.25 182.33 1o7n h TRP 553 N 1.01 0.38 -0.58 0.00 7.01 -0.63 0.17 115.95 123.31 1o7n h TRP 553 Ca 0.25 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.25 1o7n h TRP 553 Cb 0.05 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 26.95 1o7n h TRP 553 CO 0.01 0.33 0.38 1.25 -2.79 0.00 0.00 178.44 177.62 1o7n h LEU 554 N 0.33 0.65 -0.32 0.65 5.85 -0.73 0.15 115.31 121.89 1o7n h LEU 554 Ca 0.10 -0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.61 1o7n h LEU 554 Cb 0.07 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1o7n h LEU 554 CO -0.01 0.47 -0.73 -0.33 -0.34 0.00 0.00 178.44 177.49 1o7n h GLU 555 N 0.77 0.57 0.00 1.25 5.08 -0.77 -2.91 114.58 118.57 1o7n h GLU 555 Ca 0.22 -0.45 -0.13 0.00 -1.00 0.00 0.00 59.36 57.99 1o7n h GLU 555 Cb -0.07 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1o7n h GLU 555 CO -0.06 1.08 -2.03 1.58 -1.00 0.00 0.00 179.01 178.58 1o7n n HIS 556 N -3.88 0.13 0.00 4.33 -0.00 0.59 -4.67 115.22 111.70 1o7n n HIS 556 Ca -0.05 0.04 0.00 0.00 0.46 0.00 0.00 57.72 58.17 1o7n n HIS 556 Cb 0.71 -0.73 0.00 0.00 -0.12 0.00 0.00 29.99 29.85 1o7n n HIS 556 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1o7n s VAL 558 N -0.99 2.37 0.48 0.00 1.01 -1.10 -0.31 120.40 121.86 1o7n s VAL 558 Ca 0.00 -0.87 -0.19 0.00 0.00 0.00 0.00 61.98 60.92 1o7n s VAL 558 Cb 0.00 -1.98 -0.09 0.00 0.00 0.00 0.00 36.38 34.31 1o7n s VAL 558 CO 0.00 0.53 0.99 -0.83 0.00 0.00 0.00 175.10 175.79 1o7n s GLY 559 N 0.90 2.31 0.55 4.51 0.00 0.29 -4.79 107.32 111.08 1o7n s GLY 559 Ca -0.04 0.39 0.23 0.00 0.00 0.00 0.00 44.72 45.30 1o7n s GLY 559 CO -0.03 0.68 2.09 1.48 0.00 0.00 0.00 173.10 177.33 1o7n h SER 560 N 1.43 0.00 -0.50 1.64 4.64 -1.96 -2.02 113.55 116.79 1o7n h SER 560 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1o7n h SER 560 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1o7n h SER 560 CO 0.60 0.00 0.00 -1.84 -0.87 0.00 0.00 176.83 174.72 1o7n n GLU 561 N -4.24 2.45 -1.70 4.77 0.00 -1.26 -4.40 120.64 116.25 1o7n n GLU 561 Ca 0.03 -1.91 -0.40 0.00 0.00 0.00 0.00 57.16 54.87 1o7n n GLU 561 Cb 0.33 -1.51 0.02 0.00 0.00 0.00 0.00 31.44 30.29 1o7n n GLU 561 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.13 178.68 1o7n n VAL 562 N 0.92 2.87 -4.09 3.84 3.14 -0.76 -4.89 118.33 119.35 1o7n n VAL 562 Ca 0.18 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.73 1o7n n VAL 562 Cb 0.51 -1.55 -0.15 0.00 -1.06 0.00 0.00 33.84 31.59 1o7n n VAL 562 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 1o7n s GLN 563 N -2.37 2.67 -0.34 1.45 0.74 -0.58 -4.01 119.66 117.22 1o7n s GLN 563 Ca 0.64 -1.05 -0.04 0.00 0.05 0.00 0.00 55.36 54.96 1o7n s GLN 563 Cb -0.48 -2.73 0.06 0.00 1.10 0.00 0.00 33.01 30.96 1o7n s GLN 563 CO 0.56 -0.37 0.09 -0.47 -0.55 0.00 0.00 175.29 174.55 1o7n s TYR 564 N 1.21 3.35 -0.07 1.67 5.04 0.07 -1.23 117.35 127.40 1o7n s TYR 564 Ca -0.01 -1.87 0.02 0.00 -2.44 0.00 0.00 57.07 52.77 1o7n s TYR 564 Cb -0.16 -2.49 0.01 0.00 0.35 0.00 0.00 41.96 39.67 1o7n s TYR 564 CO -0.09 -0.83 -0.12 -1.14 -1.34 0.00 0.00 175.55 172.03 1o7n s GLN 565 N 1.27 1.75 -0.12 4.97 0.74 0.16 -0.58 119.66 127.86 1o7n s GLN 565 Ca -0.00 -0.42 -0.00 0.00 0.05 0.00 0.00 55.36 54.98 1o7n s GLN 565 Cb -0.21 -1.45 0.02 0.00 1.10 0.00 0.00 33.01 32.47 1o7n s GLN 565 CO -0.01 0.01 -0.08 0.08 -0.55 0.00 0.00 175.29 174.74 1o7n s VAL 566 N 0.72 1.08 0.23 1.34 1.01 -0.29 -1.12 120.40 123.36 1o7n s VAL 566 Ca -0.13 -0.32 0.08 0.00 0.00 0.00 0.00 61.98 61.60 1o7n s VAL 566 Cb -0.16 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1o7n s VAL 566 CO 0.03 0.38 0.09 0.27 0.00 0.00 0.00 175.10 175.87 1o7n s ILE 567 N 1.66 4.01 -0.22 2.22 -4.36 0.48 -0.27 121.20 124.72 1o7n s ILE 567 Ca 0.04 -1.53 0.02 0.00 -0.26 0.00 0.00 60.65 58.93 1o7n s ILE 567 Cb -0.13 -3.12 0.04 0.00 1.25 0.00 0.00 42.46 40.51 1o7n s ILE 567 CO -0.08 -0.28 -0.14 -0.55 0.24 0.00 0.00 174.94 174.13 1o7n s SER 568 N -3.53 3.80 -0.13 4.36 0.15 -0.16 -1.09 113.70 117.09 1o7n s SER 568 Ca 0.31 -1.04 -0.17 0.00 0.70 0.00 0.00 55.95 55.75 1o7n s SER 568 Cb -0.08 -1.47 -0.04 0.00 -1.71 0.00 0.00 66.02 62.72 1o7n s SER 568 CO 0.22 -0.12 0.43 -0.60 1.20 0.00 0.00 173.24 174.38 1o7n s ARG 569 N 1.22 4.31 0.40 5.44 3.52 -1.26 -1.57 118.95 131.01 1o7n s ARG 569 Ca -0.03 0.36 -0.27 0.00 -0.13 0.00 0.00 55.73 55.66 1o7n s ARG 569 Cb -0.17 -3.44 -0.10 0.00 -1.56 0.00 0.00 34.95 29.68 1o7n s ARG 569 CO -0.08 0.16 1.41 -2.00 -0.81 0.00 0.00 175.30 173.98 1o7n s GLU 570 N 0.64 3.99 -0.17 5.12 2.12 0.28 -4.93 118.70 125.74 1o7n s GLU 570 Ca 0.23 2.40 -0.29 0.00 0.36 0.00 0.00 54.97 57.67 1o7n s GLU 570 Cb -0.15 -2.85 -0.02 0.00 0.26 0.00 0.00 34.13 31.38 1o7n s GLU 570 CO 0.09 -0.56 1.33 -0.51 -0.54 0.00 0.00 175.26 175.07 1o7n s LEU 571 N -2.31 4.16 0.19 2.70 1.02 -1.26 -4.99 118.68 118.19 1o7n s LEU 571 Ca 0.55 1.72 0.06 0.00 0.02 0.00 0.00 54.13 56.48 1o7n s LEU 571 Cb -0.43 -3.54 -0.05 0.00 0.02 0.00 0.00 46.19 42.19 1o7n s LEU 571 CO 0.57 -0.84 -0.11 -0.13 0.02 0.00 0.00 176.35 175.86 1o7n s ARG 572 N 3.69 1.26 0.42 1.70 1.81 -1.26 -5.12 118.95 121.45 1o7n s ARG 572 Ca 0.58 -1.57 -0.25 0.00 -1.72 0.00 0.00 55.73 52.77 1o7n s ARG 572 Cb -0.23 -0.93 -0.08 0.00 -0.45 0.00 0.00 34.95 33.26 1o7n s ARG 572 CO 0.18 0.12 1.22 0.00 -0.68 0.00 0.00 175.30 176.14 1o7n s ALA 573 N -3.12 3.14 0.49 2.13 0.00 -1.26 -4.88 121.76 118.26 1o7n s ALA 573 Ca 0.22 1.07 0.18 0.00 0.00 0.00 0.00 51.96 53.42 1o7n s ALA 573 Cb 0.01 -3.42 1.23 0.00 0.00 0.00 0.00 23.12 20.94 1o7n s ALA 573 CO 0.05 -0.69 2.09 0.00 0.00 0.00 0.00 175.76 177.21 1o7n h ALA 574 N 2.49 1.77 -0.42 0.00 0.00 -2.03 -1.68 119.26 119.39 1o7n h ALA 574 Ca -0.49 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1o7n h ALA 574 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1o7n h ALA 574 CO 0.62 0.11 0.00 -1.13 0.00 0.00 0.00 179.25 178.84 1o7n n SER 575 N -4.31 2.49 -4.72 0.00 3.41 -1.26 -4.96 113.62 104.27 1o7n n SER 575 Ca -0.03 -1.95 -0.42 0.00 -0.26 0.00 0.00 58.87 56.21 1o7n n SER 575 Cb 0.16 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.80 1o7n n SER 575 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1o7n s GLU 576 N -1.44 4.31 0.00 4.33 2.56 -0.63 -4.89 118.70 122.93 1o7n s GLU 576 Ca 0.33 2.13 0.00 0.00 0.00 0.00 0.00 54.97 57.42 1o7n s GLU 576 Cb 0.17 -3.22 0.00 0.00 2.00 0.00 0.00 34.13 33.08 1o7n s GLU 576 CO 0.23 -0.45 0.01 0.54 -0.56 0.00 0.00 175.26 175.04 1o7n n ARG 577 N 3.77 0.09 -0.12 4.30 1.74 -1.26 -4.94 116.66 120.25 1o7n n ARG 577 Ca 0.11 -0.01 -0.19 0.00 -0.77 0.00 0.00 57.85 56.99 1o7n n ARG 577 Cb 0.42 -0.32 -0.10 0.00 -1.02 0.00 0.00 32.46 31.44 1o7n n ARG 577 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1o7n n ARG 578 N -0.02 0.58 -2.17 5.56 1.74 -1.26 -4.93 116.66 116.16 1o7n n ARG 578 Ca 0.00 0.16 -0.43 0.00 -0.77 0.00 0.00 57.85 56.81 1o7n n ARG 578 Cb 0.14 -1.46 -0.02 0.00 -1.02 0.00 0.00 32.46 30.10 1o7n n ARG 578 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1o7n s TYR 579 N -2.47 2.17 -0.17 -1.55 5.04 -1.26 -4.90 117.35 114.21 1o7n s TYR 579 Ca -0.33 0.63 0.16 0.00 -2.44 0.00 0.00 57.07 55.09 1o7n s TYR 579 Cb 0.09 -4.07 0.34 0.00 0.35 0.00 0.00 41.96 38.67 1o7n s TYR 579 CO 0.52 -2.60 1.23 1.63 -1.34 0.00 0.00 175.55 174.99 1o7n n LYS 580 N 7.88 2.02 -1.66 4.97 5.02 -1.26 -5.04 118.16 130.09 1o7n n LYS 580 Ca 0.19 -2.54 -0.30 0.00 -2.02 0.00 0.00 58.31 53.63 1o7n n LYS 580 Cb 0.46 -1.55 0.07 0.00 -0.02 0.00 0.00 35.03 33.99 1o7n n LYS 580 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1o7n s LEU 581 N -2.61 2.81 -0.22 -0.35 1.02 -1.26 -4.85 118.68 113.21 1o7n s LEU 581 Ca 0.32 1.33 -0.20 0.00 0.02 0.00 0.00 54.13 55.60 1o7n s LEU 581 Cb 0.27 -4.06 -0.09 0.00 0.02 0.00 0.00 46.19 42.33 1o7n s LEU 581 CO 0.05 -1.66 0.83 0.59 0.02 0.00 0.00 176.35 176.18 1o7n n ASN 582 N -3.23 0.42 0.11 2.29 5.03 -1.26 -4.83 115.26 113.79 1o7n n ASN 582 Ca 0.07 0.40 -0.02 0.00 0.87 0.00 0.00 54.58 55.90 1o7n n ASN 582 Cb 0.56 -0.39 0.01 0.00 -1.02 0.00 0.00 39.78 38.94 1o7n n ASN 582 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 1o7n h GLU 583 N 3.12 0.00 -3.99 3.52 5.08 -1.97 -3.47 114.58 116.87 1o7n h GLU 583 Ca -0.11 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.13 1o7n h GLU 583 Cb 0.61 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.73 1o7n h GLU 583 CO 0.46 0.73 -0.38 0.00 -1.00 0.00 0.00 179.01 178.81 1o7n s ALA 584 N -2.98 0.18 0.24 3.43 0.00 -1.26 -0.56 121.76 120.80 1o7n s ALA 584 Ca 0.02 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.04 1o7n s ALA 584 Cb 0.10 0.87 -0.05 0.00 0.00 0.00 0.00 23.12 24.04 1o7n s ALA 584 CO 0.77 -0.62 -0.11 0.00 0.00 0.00 0.00 175.76 175.81 1o7n s MET 585 N -3.99 1.44 -0.41 0.00 0.23 -0.61 -4.96 119.30 111.00 1o7n s MET 585 Ca 0.19 -1.68 -0.13 0.00 -1.03 0.00 0.00 55.69 53.04 1o7n s MET 585 Cb 0.04 -1.16 0.03 0.00 -1.53 0.00 0.00 34.83 32.22 1o7n s MET 585 CO 0.01 0.13 0.28 -0.80 -2.03 0.00 0.00 175.02 172.60 1o7n s ASN 586 N -3.38 5.95 0.13 -1.18 0.01 -1.26 -0.99 114.94 114.22 1o7n s ASN 586 Ca 0.26 -1.03 -0.14 0.00 -0.71 0.00 0.00 52.86 51.24 1o7n s ASN 586 Cb 0.01 -2.10 -0.03 0.00 0.41 0.00 0.00 41.25 39.54 1o7n s ASN 586 CO 0.09 -0.46 1.52 0.58 -1.51 0.00 0.00 177.10 177.33 1o7n h VAL 587 N 5.77 1.28 -4.06 1.60 2.07 -0.96 -3.43 116.25 118.50 1o7n h VAL 587 Ca -0.26 -1.21 -0.45 0.00 0.82 0.00 0.00 66.70 65.60 1o7n h VAL 587 Cb 1.11 1.24 -0.26 0.00 -1.52 0.00 0.00 31.29 31.87 1o7n h VAL 587 CO 0.73 0.41 -0.79 -0.31 0.02 0.00 0.00 177.57 177.62 1o7n s TYR 588 N -4.75 1.21 -0.50 1.57 1.51 -0.88 -4.94 117.35 110.57 1o7n s TYR 588 Ca -0.12 -0.33 0.06 0.00 -1.01 0.00 0.00 57.07 55.67 1o7n s TYR 588 Cb 0.10 -0.73 0.22 0.00 -0.11 0.00 0.00 41.96 41.45 1o7n s TYR 588 CO 0.82 0.02 0.85 -1.71 -1.11 0.00 0.00 175.55 174.42 1o7n n ASN 589 N 2.06 -3.05 -4.57 2.29 5.15 -1.16 -1.14 115.26 114.85 1o7n n ASN 589 Ca -0.17 -3.14 -0.34 0.00 -0.60 0.00 0.00 54.58 50.33 1o7n n ASN 589 Cb 0.55 1.78 -0.11 0.00 -0.53 0.00 0.00 39.78 41.47 1o7n n ASN 589 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1o7n s GLU 590 N 0.75 2.92 0.79 1.20 0.41 0.26 -4.88 118.70 120.14 1o7n s GLU 590 Ca 0.31 -0.54 -0.04 0.00 -0.41 0.00 0.00 54.97 54.29 1o7n s GLU 590 Cb 0.16 -2.65 0.16 0.00 -1.78 0.00 0.00 34.13 30.02 1o7n s GLU 590 CO -0.18 0.59 1.08 0.27 -0.49 0.00 0.00 175.26 176.53 1o7n n ASN 591 N 2.46 1.04 -0.13 -0.19 0.23 -1.26 -0.75 115.26 116.66 1o7n n ASN 591 Ca -0.18 -1.98 -0.07 0.00 -0.53 0.00 0.00 54.58 51.82 1o7n n ASN 591 Cb 0.53 -0.74 0.01 0.00 -2.08 0.00 0.00 39.78 37.50 1o7n n ASN 591 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1o7n h PHE 592 N -0.90 0.46 -0.78 -2.53 3.04 -1.77 -0.63 116.94 113.83 1o7n h PHE 592 Ca -0.36 0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.62 1o7n h PHE 592 Cb 1.21 -0.15 -0.04 0.00 2.56 0.00 0.00 35.95 39.53 1o7n h PHE 592 CO 0.00 0.28 0.52 0.37 -2.02 0.00 0.00 178.31 177.45 1o7n h GLN 593 N 0.50 1.03 -0.48 1.11 -0.00 -1.95 0.99 115.11 116.30 1o7n h GLN 593 Ca 0.16 -0.06 -0.13 0.00 -0.00 0.00 0.00 58.65 58.61 1o7n h GLN 593 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 27.48 27.22 1o7n h GLN 593 CO -0.06 0.68 -0.23 1.96 0.00 0.00 0.00 178.83 181.18 1o7n h GLN 594 N 1.06 1.00 -0.74 1.69 4.20 -1.80 -0.25 115.11 120.27 1o7n h GLN 594 Ca 0.29 -0.44 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 1o7n h GLN 594 Cb -0.12 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 1o7n h GLN 594 CO -0.06 1.11 0.40 -0.07 -0.67 0.00 0.00 178.83 179.54 1o7n h LEU 595 N 0.86 0.93 -0.86 1.46 3.38 -0.57 -2.00 115.31 118.52 1o7n h LEU 595 Ca 0.11 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1o7n h LEU 595 Cb 0.81 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 1o7n h LEU 595 CO 0.07 0.77 0.56 0.50 0.09 0.00 0.00 178.44 180.43 1o7n h LYS 596 N 1.03 1.10 -0.65 1.13 3.64 -0.40 0.19 116.57 122.60 1o7n h LYS 596 Ca 0.26 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.62 1o7n h LYS 596 Cb 0.05 -0.25 -0.05 0.00 -0.41 0.00 0.00 32.23 31.57 1o7n h LYS 596 CO -0.04 0.73 0.37 0.28 -2.27 0.00 0.00 179.45 178.51 1o7n h VAL 597 N 1.13 0.99 -0.28 2.00 2.07 -0.67 0.36 116.25 121.86 1o7n h VAL 597 Ca 0.32 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.52 1o7n h VAL 597 Cb -0.09 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 29.91 1o7n h VAL 597 CO -0.08 0.13 -0.20 0.03 0.02 0.00 0.00 177.57 177.46 1o7n h ARG 598 N 0.69 0.50 -0.39 1.57 3.08 -0.64 -0.71 114.38 118.48 1o7n h ARG 598 Ca 0.28 -0.17 -0.13 0.00 0.07 0.00 0.00 59.98 60.03 1o7n h ARG 598 Cb 0.14 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1o7n h ARG 598 CO -0.16 0.68 -0.27 0.28 -1.07 0.00 0.00 179.97 179.43 1o7n h VAL 599 N 0.45 1.28 -0.75 2.04 2.07 -0.49 -1.48 116.25 119.37 1o7n h VAL 599 Ca 0.07 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 66.13 1o7n h VAL 599 Cb 0.60 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1o7n h VAL 599 CO 0.04 0.48 0.33 -0.33 0.02 0.00 0.00 177.57 178.11 1o7n h GLU 600 N 0.69 1.10 -0.80 1.57 4.39 -0.64 -1.42 114.58 119.47 1o7n h GLU 600 Ca 0.08 -0.18 0.01 0.00 0.34 0.00 0.00 59.36 59.61 1o7n h GLU 600 Cb 0.84 -0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 29.26 1o7n h GLU 600 CO 0.07 0.87 0.52 1.25 -1.16 0.00 0.00 179.01 180.57 1o7n h HIS 601 N 1.08 1.01 -0.50 4.33 2.76 -0.91 -1.03 115.15 121.89 1o7n h HIS 601 Ca 0.26 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.38 1o7n h HIS 601 Cb 0.16 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 28.76 1o7n h HIS 601 CO 0.02 0.65 0.05 1.96 -1.30 0.00 0.00 177.93 179.30 1o7n h GLN 602 N 1.09 0.80 -0.00 5.26 1.08 -0.61 -3.16 115.11 119.56 1o7n h GLN 602 Ca 0.29 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1o7n h GLN 602 Cb -0.11 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.21 1o7n h GLN 602 CO -0.06 0.78 -0.35 1.28 -0.95 0.00 0.00 178.83 179.53 1o7n n LEU 603 N -4.24 0.63 -4.73 1.46 4.32 -0.60 -4.91 117.00 108.94 1o7n n LEU 603 Ca 0.03 -0.05 -0.42 0.00 -0.02 0.00 0.00 56.01 55.55 1o7n n LEU 603 Cb 0.27 -0.22 -0.03 0.00 -1.62 0.00 0.00 43.42 41.82 1o7n n LEU 603 CO 0.41 0.13 1.09 -0.62 -1.22 0.00 0.00 177.39 177.18 1o7n s ASP 604 N -2.78 6.75 0.00 -1.43 2.15 -0.44 -4.88 116.67 116.03 1o7n s ASP 604 Ca 0.17 2.49 0.14 0.00 0.43 0.00 0.00 52.55 55.79 1o7n s ASP 604 Cb 0.18 -2.60 0.71 0.00 -0.30 0.00 0.00 42.92 40.91 1o7n s ASP 604 CO 0.61 -0.67 1.38 -0.81 -0.17 0.00 0.00 175.17 175.51 1o7n n PRO 605 N 3.19 0.20 -0.62 4.34 -0.04 -1.26 -1.65 135.00 139.17 1o7n n PRO 605 Ca 0.09 0.15 0.08 0.00 -0.04 0.00 0.00 63.50 63.79 1o7n n PRO 605 Cb 0.41 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.69 1o7n n PRO 605 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1o7n n GLN 606 N -1.28 3.78 -2.79 0.54 6.02 -1.26 -4.76 117.38 117.63 1o7n n GLN 606 Ca 0.07 -2.90 -0.43 0.00 -0.01 0.00 0.00 57.00 53.73 1o7n n GLN 606 Cb 0.11 -1.95 -0.03 0.00 1.02 0.00 0.00 30.24 29.39 1o7n n GLN 606 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1o7n s ASN 607 N -1.25 6.58 0.50 1.08 3.84 -0.66 -4.82 114.94 120.21 1o7n s ASN 607 Ca 0.47 -1.82 0.19 0.00 0.21 0.00 0.00 52.86 51.91 1o7n s ASN 607 Cb 0.35 -2.46 1.26 0.00 -0.55 0.00 0.00 41.25 39.84 1o7n s ASN 607 CO 0.15 -1.23 2.09 -0.50 -2.79 0.00 0.00 177.10 174.82 1o7n h TRP 608 N 9.19 0.00 0.00 0.43 -0.00 -1.88 -1.49 115.95 122.20 1o7n h TRP 608 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.07 1o7n h TRP 608 Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.18 1o7n h TRP 608 CO 1.21 0.10 0.00 0.41 -0.00 0.00 0.00 178.44 180.16 1o7n n GLY 609 N -1.17 -1.18 0.89 1.49 0.00 -1.26 -2.25 105.19 101.71 1o7n n GLY 609 Ca -0.03 0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.07 1o7n n GLY 609 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1o7n n ASN 610 N -1.89 2.56 -3.87 1.61 3.02 -0.56 -4.77 115.26 111.36 1o7n n ASN 610 Ca 0.03 -2.10 -0.25 0.00 -0.03 0.00 0.00 54.58 52.23 1o7n n ASN 610 Cb 0.22 -0.35 -0.17 0.00 -0.61 0.00 0.00 39.78 38.87 1o7n n ASN 610 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1o7n s SER 611 N -0.90 1.84 0.74 6.41 0.15 -0.95 -2.95 113.70 118.04 1o7n s SER 611 Ca 0.29 -0.22 -0.13 0.00 0.70 0.00 0.00 55.95 56.60 1o7n s SER 611 Cb 0.17 -0.68 0.04 0.00 -1.71 0.00 0.00 66.02 63.84 1o7n s SER 611 CO 0.18 -0.12 1.11 -2.16 1.20 0.00 0.00 173.24 173.45 1o7n s PRO 612 N 1.63 2.36 0.19 5.44 0.04 -1.26 -5.01 135.00 138.38 1o7n s PRO 612 Ca 0.02 1.34 -0.33 0.00 0.04 0.00 0.00 61.00 62.07 1o7n s PRO 612 Cb -0.13 -1.90 -0.14 0.00 0.04 0.00 0.00 34.50 32.37 1o7n s PRO 612 CO -0.06 -1.59 1.41 1.17 0.04 0.00 0.00 177.00 177.98 1o7n n LYS 613 N -3.07 1.83 -1.23 4.56 4.81 -1.15 -4.80 118.16 119.11 1o7n n LYS 613 Ca 0.10 0.65 -0.31 0.00 -0.87 0.00 0.00 58.31 57.89 1o7n n LYS 613 Cb 0.52 -2.32 0.10 0.00 0.02 0.00 0.00 35.03 33.36 1o7n n LYS 613 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1o7n s LEU 614 N 0.46 2.85 -0.10 3.14 1.02 -1.26 -4.86 118.68 119.93 1o7n s LEU 614 Ca 0.74 1.76 0.02 0.00 0.02 0.00 0.00 54.13 56.67 1o7n s LEU 614 Cb -0.73 -4.38 0.01 0.00 0.02 0.00 0.00 46.19 41.11 1o7n s LEU 614 CO 0.46 -2.21 -0.15 -0.13 0.02 0.00 0.00 176.35 174.34 1o7n s ARG 615 N -4.90 2.15 -0.00 1.70 1.81 -0.44 -5.01 118.95 114.26 1o7n s ARG 615 Ca 0.62 -0.55 0.07 0.00 -1.72 0.00 0.00 55.73 54.15 1o7n s ARG 615 Cb -0.18 -1.80 -0.03 0.00 -0.45 0.00 0.00 34.95 32.50 1o7n s ARG 615 CO 0.56 -0.02 -0.20 -0.06 -0.68 0.00 0.00 175.30 174.90 1o7n s PHE 616 N 0.86 2.51 -0.06 -0.53 0.40 -1.26 -0.89 117.98 119.00 1o7n s PHE 616 Ca -0.10 -0.30 -0.02 0.00 -0.60 0.00 0.00 56.93 55.91 1o7n s PHE 616 Cb -0.15 -1.51 0.04 0.00 0.51 0.00 0.00 43.02 41.90 1o7n s PHE 616 CO 0.01 0.14 0.10 0.99 0.70 0.00 0.00 175.22 177.16 1o7n s THR 617 N -0.77 -0.14 -0.02 0.64 2.01 -0.38 -4.79 115.64 112.18 1o7n s THR 617 Ca 0.12 0.34 0.04 0.00 0.31 0.00 0.00 61.69 62.50 1o7n s THR 617 Cb -0.10 -0.20 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 1o7n s THR 617 CO 0.02 0.14 -0.13 -0.13 -0.69 0.00 0.00 174.62 173.83 1o7n s ARG 618 N 1.89 2.45 -0.22 4.92 0.52 -1.26 -0.83 118.95 126.42 1o7n s ARG 618 Ca 0.00 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.47 1o7n s ARG 618 Cb -0.12 -2.39 0.05 0.00 0.52 0.00 0.00 34.95 33.02 1o7n s ARG 618 CO -0.04 0.61 -0.06 -0.06 0.02 0.00 0.00 175.30 175.76 1o7n s PHE 619 N -0.84 2.25 -0.21 -0.53 0.08 0.42 -4.99 117.98 114.16 1o7n s PHE 619 Ca 0.14 -1.59 -0.08 0.00 0.12 0.00 0.00 56.93 55.51 1o7n s PHE 619 Cb -0.11 -1.53 -0.04 0.00 -0.57 0.00 0.00 43.02 40.77 1o7n s PHE 619 CO 0.03 -0.74 0.09 0.42 -0.10 0.00 0.00 175.22 174.92 1o7n s ILE 620 N 1.45 4.90 0.34 0.64 -1.09 -1.26 -1.26 121.20 124.92 1o7n s ILE 620 Ca -0.04 0.01 0.07 0.00 -2.23 0.00 0.00 60.65 58.47 1o7n s ILE 620 Cb -0.18 -3.24 -0.03 0.00 -1.58 0.00 0.00 42.46 37.43 1o7n s ILE 620 CO -0.07 0.41 0.27 0.42 -1.23 0.00 0.00 174.94 174.74 1o7n s THR 621 N 0.71 0.05 -1.48 2.92 -4.23 -0.37 -4.95 115.64 108.28 1o7n s THR 621 Ca 0.05 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.47 1o7n s THR 621 Cb -0.13 -2.48 0.06 0.00 1.34 0.00 0.00 72.50 71.29 1o7n s THR 621 CO 0.02 0.00 0.79 0.59 -0.54 0.00 0.00 174.62 175.48 1o7n n ASN 622 N -1.55 -2.96 -4.71 3.99 4.13 -1.26 -0.80 115.26 112.09 1o7n n ASN 622 Ca 0.06 -0.86 -0.42 0.00 1.68 0.00 0.00 54.58 55.04 1o7n n ASN 622 Cb 0.62 -3.62 -0.03 0.00 -1.54 0.00 0.00 39.78 35.21 1o7n n ASN 622 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1o7n s VAL 623 N -3.50 3.86 0.03 2.41 1.01 -1.26 -4.21 120.40 118.74 1o7n s VAL 623 Ca 0.41 1.35 0.03 0.00 0.00 0.00 0.00 61.98 63.77 1o7n s VAL 623 Cb -0.21 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 1o7n s VAL 623 CO 0.85 0.11 -0.10 -1.10 0.00 0.00 0.00 175.10 174.86 1o7n s GLN 624 N 1.00 0.71 0.01 2.72 -0.21 -0.01 -4.99 119.66 118.88 1o7n s GLN 624 Ca 0.60 -0.64 0.01 0.00 0.02 0.00 0.00 55.36 55.35 1o7n s GLN 624 Cb -0.31 -0.64 -0.01 0.00 1.00 0.00 0.00 33.01 33.05 1o7n s GLN 624 CO 0.30 0.15 -0.04 0.00 -2.12 0.00 0.00 175.29 173.59 1o7n s ALA 625 N -0.85 0.26 -0.16 6.09 0.00 -1.26 -0.79 121.76 125.05 1o7n s ALA 625 Ca -0.02 -0.29 -0.12 0.00 0.00 0.00 0.00 51.96 51.53 1o7n s ALA 625 Cb -0.07 -0.01 0.05 0.00 0.00 0.00 0.00 23.12 23.09 1o7n s ALA 625 CO 0.01 0.01 0.41 0.00 0.00 0.00 0.00 175.76 176.18 1o7n s ALA 626 N -0.49 -1.02 0.40 0.00 0.00 0.24 -4.80 121.76 116.10 1o7n s ALA 626 Ca -0.03 1.32 -0.26 0.00 0.00 0.00 0.00 51.96 52.99 1o7n s ALA 626 Cb -0.04 -0.79 -0.09 0.00 0.00 0.00 0.00 23.12 22.21 1o7n s ALA 626 CO -0.00 -0.23 1.33 -1.64 0.00 0.00 0.00 175.76 175.22 1o7n s MET 627 N 0.77 3.97 0.38 0.00 -1.94 -1.26 -0.31 119.30 120.91 1o7n s MET 627 Ca -0.05 2.21 -0.27 0.00 -1.71 0.00 0.00 55.69 55.88 1o7n s MET 627 Cb -0.05 -2.78 -0.09 0.00 2.01 0.00 0.00 34.83 33.91 1o7n s MET 627 CO -0.06 -0.51 1.34 0.34 -0.01 0.00 0.00 175.02 176.12 1o7n s ASP 628 N -0.66 6.43 0.26 3.03 2.15 -0.27 -4.81 116.67 122.80 1o7n s ASP 628 Ca 0.57 2.74 0.04 0.00 0.43 0.00 0.00 52.55 56.32 1o7n s ASP 628 Cb -0.39 -2.65 0.32 0.00 -0.30 0.00 0.00 42.92 39.90 1o7n s ASP 628 CO 0.51 -0.77 1.62 0.58 -0.17 0.00 0.00 175.17 176.93 1o7n h VAL 629 N 2.70 1.34 0.00 1.11 2.07 -1.93 -3.38 116.25 118.17 1o7n h VAL 629 Ca -0.50 -1.71 -0.45 0.00 0.82 0.00 0.00 66.70 64.86 1o7n h VAL 629 Cb 1.24 1.78 -0.07 0.00 -1.52 0.00 0.00 31.29 32.72 1o7n h VAL 629 CO 0.64 0.51 -2.53 0.59 0.02 0.00 0.00 177.57 176.80 1o7n n ASN 630 N -3.97 1.96 -4.35 0.57 3.02 -1.26 -4.86 115.26 106.37 1o7n n ASN 630 Ca -0.02 0.24 -0.45 0.00 -0.03 0.00 0.00 54.58 54.32 1o7n n ASN 630 Cb 0.54 -0.73 -0.07 0.00 -0.61 0.00 0.00 39.78 38.91 1o7n n ASN 630 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1o7n s ASP 631 N -7.29 6.14 0.00 6.41 -1.08 -1.26 -4.94 116.67 114.64 1o7n s ASP 631 Ca -0.38 -1.50 0.18 0.00 -0.52 0.00 0.00 52.55 50.33 1o7n s ASP 631 Cb 0.14 -2.18 1.10 0.00 -1.46 0.00 0.00 42.92 40.51 1o7n s ASP 631 CO 0.51 -0.72 1.52 0.29 0.52 0.00 0.00 175.17 177.30 1o7n n LYS 632 N 5.20 0.67 0.00 4.34 5.02 -1.26 -1.36 118.16 130.78 1o7n n LYS 632 Ca -0.13 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.29 1o7n n LYS 632 Cb 0.42 -1.43 0.47 0.00 -0.02 0.00 0.00 35.03 34.48 1o7n n LYS 632 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1o7n n GLU 633 N -0.93 0.01 -4.80 1.97 -0.58 -1.26 -4.93 120.64 110.12 1o7n n GLU 633 Ca 0.14 0.01 -0.33 0.00 -0.42 0.00 0.00 57.16 56.55 1o7n n GLU 633 Cb 0.06 -1.51 -0.13 0.00 -0.57 0.00 0.00 31.44 29.29 1o7n n GLU 633 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1o7n s LEU 634 N -3.05 2.78 -0.10 -4.62 1.43 -0.46 -0.95 118.68 113.71 1o7n s LEU 634 Ca 0.13 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1o7n s LEU 634 Cb 0.18 -1.60 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 1o7n s LEU 634 CO 0.60 0.26 -0.19 -0.22 0.23 0.00 0.00 176.35 177.02 1o7n s LEU 635 N -0.19 2.37 -0.21 1.79 2.96 0.49 -1.11 118.68 124.78 1o7n s LEU 635 Ca 0.00 -0.44 -0.20 0.00 -0.22 0.00 0.00 54.13 53.28 1o7n s LEU 635 Cb -0.13 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 45.04 1o7n s LEU 635 CO 0.03 0.19 0.57 -1.00 -1.32 0.00 0.00 176.35 174.82 1o7n s HIS 636 N 0.18 3.36 -0.10 5.38 3.76 0.57 -0.76 115.29 127.69 1o7n s HIS 636 Ca -0.11 0.83 0.02 0.00 -0.15 0.00 0.00 55.06 55.65 1o7n s HIS 636 Cb -0.16 -2.74 0.01 0.00 1.11 0.00 0.00 32.58 30.80 1o7n s HIS 636 CO 0.06 -0.16 -0.17 0.42 -0.85 0.00 0.00 174.74 174.04 1o7n s ILE 637 N 1.86 1.58 -0.04 0.60 1.01 -0.44 -0.59 121.20 125.18 1o7n s ILE 637 Ca 0.26 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 60.22 1o7n s ILE 637 Cb -0.16 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 1o7n s ILE 637 CO 0.10 0.46 -0.07 -0.60 0.00 0.00 0.00 174.94 174.82 1o7n s ARG 638 N 0.80 2.67 0.11 2.79 3.52 0.03 -0.44 118.95 128.43 1o7n s ARG 638 Ca -0.10 -0.61 -0.24 0.00 -0.13 0.00 0.00 55.73 54.65 1o7n s ARG 638 Cb -0.16 -2.55 0.06 0.00 -1.56 0.00 0.00 34.95 30.75 1o7n s ARG 638 CO 0.01 0.64 0.59 -1.54 -0.81 0.00 0.00 175.30 174.19 1o7n s SER 639 N -1.02 -0.54 0.11 -2.12 1.04 -0.88 -0.83 113.70 109.47 1o7n s SER 639 Ca 0.14 0.10 0.06 0.00 0.48 0.00 0.00 55.95 56.74 1o7n s SER 639 Cb -0.11 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 1o7n s SER 639 CO 0.04 -0.88 -0.05 0.20 0.98 0.00 0.00 173.24 173.53 1o7n s ASN 640 N -2.43 4.67 -0.02 7.02 0.01 0.02 0.00 114.94 124.21 1o7n s ASN 640 Ca -0.01 -0.33 0.01 0.00 -0.71 0.00 0.00 52.86 51.82 1o7n s ASN 640 Cb -0.01 -0.98 0.01 0.00 0.41 0.00 0.00 41.25 40.68 1o7n s ASN 640 CO -0.08 0.16 -0.01 0.54 -1.51 0.00 0.00 177.10 176.19 1o7n s VAL 641 N -1.35 0.20 -0.21 1.60 0.11 0.57 -1.24 120.40 120.08 1o7n s VAL 641 Ca 0.24 -0.02 -0.05 0.00 -2.93 0.00 0.00 61.98 59.22 1o7n s VAL 641 Cb -0.11 -0.23 -0.02 0.00 -1.53 0.00 0.00 36.38 34.49 1o7n s VAL 641 CO 0.16 0.10 0.00 -0.63 -3.33 0.00 0.00 175.10 171.41 1o7n s ILE 642 N 0.48 3.92 -0.16 7.04 1.01 -0.39 -1.53 121.20 131.57 1o7n s ILE 642 Ca -0.05 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.30 1o7n s ILE 642 Cb -0.07 -2.78 0.02 0.00 0.01 0.00 0.00 42.46 39.63 1o7n s ILE 642 CO -0.01 0.42 -0.20 -0.22 0.00 0.00 0.00 174.94 174.93 1o7n s LEU 643 N 1.11 2.06 -0.20 2.97 0.20 0.06 -0.44 118.68 124.43 1o7n s LEU 643 Ca 0.02 -0.61 -0.05 0.00 0.69 0.00 0.00 54.13 54.18 1o7n s LEU 643 Cb -0.14 -1.42 -0.03 0.00 -0.43 0.00 0.00 46.19 44.17 1o7n s LEU 643 CO 0.01 0.03 0.01 -2.28 -0.29 0.00 0.00 176.35 173.83 1o7n s HIS 644 N 1.11 3.06 -0.15 5.38 5.65 -0.01 -0.49 115.29 129.82 1o7n s HIS 644 Ca -0.00 -0.43 0.01 0.00 0.25 0.00 0.00 55.06 54.90 1o7n s HIS 644 Cb -0.14 -2.10 0.02 0.00 -1.18 0.00 0.00 32.58 29.18 1o7n s HIS 644 CO -0.08 -0.23 -0.19 0.50 -0.65 0.00 0.00 174.74 174.09 1o7n s ARG 645 N 1.03 2.81 -0.02 2.88 3.52 -0.15 -1.25 118.95 127.75 1o7n s ARG 645 Ca 0.02 -0.77 0.07 0.00 -0.13 0.00 0.00 55.73 54.93 1o7n s ARG 645 Cb -0.14 -2.38 -0.02 0.00 -1.56 0.00 0.00 34.95 30.85 1o7n s ARG 645 CO 0.02 -0.14 -0.23 0.00 -0.81 0.00 0.00 175.30 174.14 1o7n s ALA 646 N 1.14 1.93 0.06 6.12 0.00 -0.07 -1.05 121.76 129.89 1o7n s ALA 646 Ca -0.00 -0.99 -0.25 0.00 0.00 0.00 0.00 51.96 50.72 1o7n s ALA 646 Cb -0.14 -0.51 0.06 0.00 0.00 0.00 0.00 23.12 22.53 1o7n s ALA 646 CO -0.08 0.46 0.59 -0.98 0.00 0.00 0.00 175.76 175.75 1o7n s ARG 647 N -0.49 1.12 -1.48 0.00 1.70 -0.40 -1.33 118.95 118.07 1o7n s ARG 647 Ca 0.07 -0.19 -0.11 0.00 -0.47 0.00 0.00 55.73 55.03 1o7n s ARG 647 Cb -0.09 0.52 0.06 0.00 -0.57 0.00 0.00 34.95 34.87 1o7n s ARG 647 CO -0.00 -0.42 0.96 0.54 -1.08 0.00 0.00 175.30 175.29 1o7n n ARG 648 N 0.27 -5.69 0.00 3.89 1.74 -1.26 -1.87 116.66 113.74 1o7n n ARG 648 Ca -0.18 0.63 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 1o7n n ARG 648 Cb 0.61 -5.48 0.00 0.00 -1.02 0.00 0.00 32.46 26.57 1o7n n ARG 648 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1o7n n GLY 649 N -1.70 1.92 0.18 -0.13 0.00 -1.26 -4.30 105.19 99.89 1o7n n GLY 649 Ca -0.02 -0.23 0.02 0.00 0.00 0.00 0.00 46.02 45.80 1o7n n GLY 649 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1o7n n ASN 650 N 3.67 0.93 -4.68 1.61 0.23 -1.24 -5.01 115.26 110.77 1o7n n ASN 650 Ca 0.00 -2.00 -0.38 0.00 -0.53 0.00 0.00 54.58 51.68 1o7n n ASN 650 Cb 0.00 -0.16 -0.08 0.00 -2.08 0.00 0.00 39.78 37.46 1o7n n ASN 650 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 1o7n s GLN 651 N -0.86 4.18 -0.03 -3.83 0.74 -0.78 -5.01 119.66 114.06 1o7n s GLN 651 Ca 0.07 0.12 -0.01 0.00 0.05 0.00 0.00 55.36 55.59 1o7n s GLN 651 Cb 0.07 -3.52 0.03 0.00 1.10 0.00 0.00 33.01 30.69 1o7n s GLN 651 CO 0.01 0.02 0.04 0.08 -0.55 0.00 0.00 175.29 174.89 1o7n s VAL 652 N 1.13 -0.05 -0.05 1.34 1.01 -1.26 -1.27 120.40 121.24 1o7n s VAL 652 Ca 0.17 0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.51 1o7n s VAL 652 Cb -0.14 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.09 1o7n s VAL 652 CO 0.07 0.15 -0.14 -1.81 0.00 0.00 0.00 175.10 173.37 1o7n s ASP 653 N 1.73 1.91 -0.13 3.32 1.01 -0.22 -5.00 116.67 119.28 1o7n s ASP 653 Ca -0.01 -0.31 0.03 0.00 0.71 0.00 0.00 52.55 52.97 1o7n s ASP 653 Cb -0.12 -0.66 0.01 0.00 1.01 0.00 0.00 42.92 43.16 1o7n s ASP 653 CO -0.03 0.10 -0.22 -0.69 0.21 0.00 0.00 175.17 174.54 1o7n s VAL 654 N 0.28 2.03 0.05 -1.27 1.01 -1.26 -0.98 120.40 120.26 1o7n s VAL 654 Ca -0.08 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 60.97 1o7n s VAL 654 Cb -0.13 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1o7n s VAL 654 CO 0.03 0.55 -0.04 -0.36 0.00 0.00 0.00 175.10 175.27 1o7n s PHE 655 N 0.75 2.93 -0.04 5.22 0.40 0.35 -4.95 117.98 122.65 1o7n s PHE 655 Ca -0.09 -0.04 0.01 0.00 -0.60 0.00 0.00 56.93 56.22 1o7n s PHE 655 Cb -0.16 -1.56 0.02 0.00 0.51 0.00 0.00 43.02 41.83 1o7n s PHE 655 CO -0.00 0.43 -0.03 0.71 0.70 0.00 0.00 175.22 177.02 1o7n s TYR 656 N -1.16 0.67 0.06 0.36 1.51 -1.26 -0.76 117.35 116.77 1o7n s TYR 656 Ca 0.21 -0.17 -0.26 0.00 -1.01 0.00 0.00 57.07 55.84 1o7n s TYR 656 Cb -0.11 -0.62 0.08 0.00 -0.11 0.00 0.00 41.96 41.19 1o7n s TYR 656 CO 0.13 -0.19 0.71 0.00 -1.11 0.00 0.00 175.55 175.09 1o7n s ALA 657 N 0.97 -1.70 -0.13 3.71 0.00 -0.58 -4.52 121.76 119.51 1o7n s ALA 657 Ca -0.10 0.83 -0.07 0.00 0.00 0.00 0.00 51.96 52.61 1o7n s ALA 657 Cb -0.14 0.53 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 1o7n s ALA 657 CO -0.00 -0.65 0.12 0.00 0.00 0.00 0.00 175.76 175.22 1o7n s ALA 658 N -3.00 3.75 -0.13 0.00 0.00 -1.26 -0.31 121.76 120.80 1o7n s ALA 658 Ca -0.00 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.29 1o7n s ALA 658 Cb -0.01 -1.94 -0.01 0.00 0.00 0.00 0.00 23.12 21.16 1o7n s ALA 658 CO -0.07 0.51 -0.16 1.03 0.00 0.00 0.00 175.76 177.07 1o7n s ARG 659 N -0.68 3.27 -0.40 0.00 0.52 0.10 -4.42 118.95 117.33 1o7n s ARG 659 Ca 0.13 -0.74 -0.09 0.00 -0.52 0.00 0.00 55.73 54.50 1o7n s ARG 659 Cb -0.12 -2.56 0.07 0.00 0.52 0.00 0.00 34.95 32.86 1o7n s ARG 659 CO 0.03 0.15 0.23 -1.21 0.02 0.00 0.00 175.30 174.52 1o7n s GLU 660 N 0.48 2.63 0.18 3.54 2.02 -0.10 -2.06 118.70 125.39 1o7n s GLU 660 Ca -0.11 -1.38 0.08 0.00 0.02 0.00 0.00 54.97 53.58 1o7n s GLU 660 Cb -0.16 -3.74 -0.04 0.00 0.10 0.00 0.00 34.13 30.29 1o7n s GLU 660 CO 0.05 -0.89 -0.04 -0.51 0.02 0.00 0.00 175.26 173.89 1o7n s ASP 661 N 1.96 4.56 -0.09 -0.19 1.01 0.42 -0.74 116.67 123.60 1o7n s ASP 661 Ca 0.02 -0.49 0.03 0.00 0.71 0.00 0.00 52.55 52.83 1o7n s ASP 661 Cb -0.22 -0.89 0.01 0.00 1.01 0.00 0.00 42.92 42.82 1o7n s ASP 661 CO 0.03 0.09 -0.19 -0.54 0.21 0.00 0.00 175.17 174.76 1o7n s LYS 662 N -2.97 2.47 -0.03 8.23 1.02 0.22 -1.32 119.74 127.36 1o7n s LYS 662 Ca 0.27 -0.68 0.07 0.00 0.02 0.00 0.00 55.97 55.65 1o7n s LYS 662 Cb -0.09 -1.93 -0.02 0.00 -0.52 0.00 0.00 37.83 35.28 1o7n s LYS 662 CO 0.17 0.10 -0.24 -1.58 -0.92 0.00 0.00 175.35 172.89 1o7n s TRP 663 N 0.51 2.20 0.13 3.18 0.52 0.06 -0.60 118.94 124.94 1o7n s TRP 663 Ca -0.16 -0.49 -0.01 0.00 0.02 0.00 0.00 56.10 55.45 1o7n s TRP 663 Cb -0.17 -1.43 -0.04 0.00 -1.15 0.00 0.00 33.47 30.68 1o7n s TRP 663 CO 0.06 -0.09 0.31 -1.59 0.02 0.00 0.00 176.95 175.66 1o7n s LYS 664 N -0.43 3.51 0.36 4.98 -2.85 0.68 -0.38 119.74 125.62 1o7n s LYS 664 Ca 0.05 -0.34 0.07 0.00 -1.00 0.00 0.00 55.97 54.76 1o7n s LYS 664 Cb -0.11 -2.93 0.77 0.00 -2.06 0.00 0.00 37.83 33.50 1o7n s LYS 664 CO 0.00 0.51 1.92 0.00 0.10 0.00 0.00 175.35 177.89 1o7n h ARG 665 N 2.63 0.72 0.00 1.78 3.08 -1.36 -2.03 114.38 119.20 1o7n h ARG 665 Ca -0.46 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.54 1o7n h ARG 665 Cb 1.17 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.06 1o7n h ARG 665 CO 0.72 0.47 0.00 0.41 -1.07 0.00 0.00 179.97 180.51 1o7n n GLY 666 N -1.44 0.18 3.29 0.04 0.00 -1.26 -3.77 105.19 102.23 1o7n n GLY 666 Ca 0.13 -0.91 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 1o7n n GLY 666 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o7n s GLU 667 N 0.00 1.20 -2.02 1.61 2.02 -1.26 -4.76 118.70 115.50 1o7n s GLU 667 Ca 0.00 -1.15 0.00 0.00 0.02 0.00 0.00 54.97 53.84 1o7n s GLU 667 Cb 0.00 -1.47 0.00 0.00 0.10 0.00 0.00 34.13 32.76 1o7n s GLU 667 CO 0.00 0.35 0.00 0.41 0.02 0.00 0.00 175.26 176.04 1o7n n GLY 668 N 1.19 1.67 2.05 -1.39 0.00 -1.26 -1.67 105.19 105.78 1o7n n GLY 668 Ca -0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 46.02 45.74 1o7n n GLY 668 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o7n n GLY 669 N -0.64 0.47 3.38 -0.02 0.00 -1.26 -4.99 105.19 102.13 1o7n n GLY 669 Ca -0.20 -0.09 -0.45 0.00 0.00 0.00 0.00 46.02 45.28 1o7n n GLY 669 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o7n s VAL 670 N -1.96 4.92 0.34 1.61 1.01 -0.67 -5.03 120.40 120.63 1o7n s VAL 670 Ca 0.00 -1.30 -0.27 0.00 0.00 0.00 0.00 61.98 60.41 1o7n s VAL 670 Cb 0.00 -4.53 -0.09 0.00 0.00 0.00 0.00 36.38 31.76 1o7n s VAL 670 CO 0.00 -1.17 1.08 -0.13 0.00 0.00 0.00 175.10 174.88 1o7n s ARG 671 N 2.32 4.37 0.01 2.72 3.00 -1.25 -3.98 118.95 126.14 1o7n s ARG 671 Ca 0.16 1.67 0.03 0.00 0.00 0.00 0.00 55.73 57.58 1o7n s ARG 671 Cb -0.19 -2.85 -0.01 0.00 0.00 0.00 0.00 34.95 31.90 1o7n s ARG 671 CO 0.02 0.01 -0.09 0.15 0.00 0.00 0.00 175.30 175.38 1o7n s LYS 672 N -2.00 0.69 -0.00 3.54 1.02 -0.76 -4.60 119.74 117.63 1o7n s LYS 672 Ca 0.52 -0.47 -0.30 0.00 0.02 0.00 0.00 55.97 55.73 1o7n s LYS 672 Cb -0.27 -0.64 -0.05 0.00 -0.52 0.00 0.00 37.83 36.34 1o7n s LYS 672 CO 0.35 0.16 1.38 -1.17 -0.92 0.00 0.00 175.35 175.15 1o7n s LEU 673 N -0.64 4.31 -0.01 3.17 2.96 0.58 -0.23 118.68 128.82 1o7n s LEU 673 Ca 0.00 2.09 0.11 0.00 -0.22 0.00 0.00 54.13 56.12 1o7n s LEU 673 Cb -0.05 -3.56 -0.17 0.00 0.50 0.00 0.00 46.19 42.91 1o7n s LEU 673 CO 0.00 -0.71 0.29 1.33 -1.32 0.00 0.00 176.35 175.95 1o7n n VAL 674 N 4.65 0.00 -3.68 1.68 0.24 0.23 -0.55 118.33 120.90 1o7n n VAL 674 Ca 0.13 -0.26 -0.11 0.00 -2.04 0.00 0.00 64.34 62.06 1o7n n VAL 674 Cb 0.44 0.38 -0.09 0.00 -1.47 0.00 0.00 33.84 33.10 1o7n n VAL 674 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1o7n s GLN 675 N -2.66 0.59 -0.07 7.34 0.74 -0.81 -1.53 119.66 123.26 1o7n s GLN 675 Ca -0.03 0.87 0.03 0.00 0.05 0.00 0.00 55.36 56.28 1o7n s GLN 675 Cb 0.08 0.19 0.01 0.00 1.10 0.00 0.00 33.01 34.38 1o7n s GLN 675 CO 0.47 -0.11 -0.14 0.50 -0.55 0.00 0.00 175.29 175.46 1o7n s ARG 676 N 0.87 1.87 -0.09 1.67 3.52 -0.37 -0.61 118.95 125.81 1o7n s ARG 676 Ca -0.05 -0.48 0.02 0.00 -0.13 0.00 0.00 55.73 55.10 1o7n s ARG 676 Cb -0.05 -1.52 0.01 0.00 -1.56 0.00 0.00 34.95 31.83 1o7n s ARG 676 CO -0.07 0.05 -0.14 0.12 -0.81 0.00 0.00 175.30 174.45 1o7n s PHE 677 N 0.61 1.81 -0.05 5.12 5.36 0.08 -0.67 117.98 130.24 1o7n s PHE 677 Ca -0.15 -0.79 0.02 0.00 -0.96 0.00 0.00 56.93 55.05 1o7n s PHE 677 Cb -0.16 -1.31 0.01 0.00 -0.34 0.00 0.00 43.02 41.22 1o7n s PHE 677 CO 0.04 -0.41 -0.10 0.08 -1.46 0.00 0.00 175.22 173.37 1o7n s VAL 678 N 0.89 0.97 -0.54 3.12 1.01 -0.28 -0.92 120.40 124.65 1o7n s VAL 678 Ca -0.09 -0.40 -0.13 0.00 0.00 0.00 0.00 61.98 61.35 1o7n s VAL 678 Cb -0.15 -0.89 0.13 0.00 0.00 0.00 0.00 36.38 35.47 1o7n s VAL 678 CO 0.00 0.31 0.46 -0.62 0.00 0.00 0.00 175.10 175.26 1o7n s ASP 679 N 0.55 6.04 0.18 3.32 -1.08 -1.26 -0.39 116.67 124.03 1o7n s ASP 679 Ca -0.11 -1.91 -0.31 0.00 -0.52 0.00 0.00 52.55 49.70 1o7n s ASP 679 Cb -0.14 -2.13 -0.10 0.00 -1.46 0.00 0.00 42.92 39.09 1o7n s ASP 679 CO 0.02 -0.78 1.58 -0.47 0.52 0.00 0.00 175.17 176.05 1o7n s TYR 680 N 1.39 3.03 -0.06 -5.34 5.04 -0.25 -4.83 117.35 116.34 1o7n s TYR 680 Ca 0.05 0.62 0.24 0.00 -2.44 0.00 0.00 57.07 55.54 1o7n s TYR 680 Cb -0.27 -3.95 0.72 0.00 0.35 0.00 0.00 41.96 38.81 1o7n s TYR 680 CO 0.01 -3.49 1.74 -1.00 -1.34 0.00 0.00 175.55 171.46 1o7n h PRO 681 N 6.65 0.00 -5.16 4.97 0.13 -1.90 -3.43 132.00 133.26 1o7n h PRO 681 Ca -0.43 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.08 1o7n h PRO 681 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 1o7n h PRO 681 CO 0.91 0.18 -0.38 -1.21 -0.23 0.00 0.00 178.00 177.27 1o7n s GLU 682 N -3.43 4.07 0.08 0.86 2.02 -1.26 -4.98 118.70 116.06 1o7n s GLU 682 Ca 0.03 -0.10 -0.16 0.00 0.02 0.00 0.00 54.97 54.75 1o7n s GLU 682 Cb 0.08 -3.57 -0.13 0.00 0.10 0.00 0.00 34.13 30.61 1o7n s GLU 682 CO 0.65 -0.05 1.34 -0.09 0.02 0.00 0.00 175.26 177.12 1o7n h ARG 683 N 7.71 0.63 -4.75 1.61 9.65 -1.92 -3.40 114.38 123.91 1o7n h ARG 683 Ca -0.36 -0.40 -0.68 0.00 -1.10 0.00 0.00 59.98 57.43 1o7n h ARG 683 Cb 1.17 0.05 -0.25 0.00 -1.39 0.00 0.00 29.97 29.55 1o7n h ARG 683 CO 0.65 1.02 -0.58 0.42 2.80 0.00 0.00 179.97 184.28 1o7n s ILE 684 N -4.07 4.22 0.32 1.20 1.01 -1.26 -5.02 121.20 117.60 1o7n s ILE 684 Ca -0.12 -0.69 -0.29 0.00 0.00 0.00 0.00 60.65 59.55 1o7n s ILE 684 Cb 0.07 -3.22 -0.10 0.00 0.01 0.00 0.00 42.46 39.22 1o7n s ILE 684 CO 0.83 -0.00 1.24 -0.76 0.00 0.00 0.00 174.94 176.25 1o7n s LEU 685 N 1.53 4.45 -0.18 2.97 1.43 -1.26 -4.93 118.68 122.68 1o7n s LEU 685 Ca 0.03 2.55 0.13 0.00 -1.03 0.00 0.00 54.13 55.80 1o7n s LEU 685 Cb -0.18 -3.66 0.42 0.00 0.03 0.00 0.00 46.19 42.80 1o7n s LEU 685 CO 0.04 -0.43 1.21 0.00 0.23 0.00 0.00 176.35 177.40 1o7n n GLN 686 N 0.87 1.45 -0.14 1.70 6.02 -1.26 -4.66 117.38 121.36 1o7n n GLN 686 Ca -0.00 -3.16 0.09 0.00 -0.01 0.00 0.00 57.00 53.93 1o7n n GLN 686 Cb 0.43 -1.41 0.16 0.00 1.02 0.00 0.00 30.24 30.44 1o7n n GLN 686 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1o7n n THR 687 N -0.86 1.92 0.00 5.09 -2.24 -1.26 -4.98 114.28 111.96 1o7n n THR 687 Ca 0.18 -2.14 0.00 0.00 -2.27 0.00 0.00 64.05 59.82 1o7n n THR 687 Cb 0.77 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 1o7n n THR 687 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1o7n n HIS 688 N -1.22 0.00 -3.86 4.78 8.25 -1.26 -4.76 115.22 117.16 1o7n n HIS 688 Ca 0.16 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.59 1o7n n HIS 688 Cb 0.67 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.79 1o7n n HIS 688 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1o7n s ASN 689 N 0.00 -0.02 -0.29 0.41 2.20 -1.26 -5.04 114.94 110.94 1o7n s ASN 689 Ca 0.00 -0.62 0.08 0.00 -0.94 0.00 0.00 52.86 51.38 1o7n s ASN 689 Cb 0.00 0.49 0.46 0.00 -2.00 0.00 0.00 41.25 40.20 1o7n s ASN 689 CO 0.00 -0.97 1.34 -0.11 -2.94 0.00 0.00 177.10 174.42 1o7n n LEU 690 N -0.66 4.24 -2.13 3.54 0.00 -1.26 -4.89 117.00 115.84 1o7n n LEU 690 Ca -0.04 -4.20 -0.07 0.00 0.00 0.00 0.00 56.01 51.70 1o7n n LEU 690 Cb 0.60 -0.53 -0.10 0.00 0.00 0.00 0.00 43.42 43.39 1o7n n LEU 690 CO 0.20 1.62 1.18 0.23 0.00 0.00 0.00 177.39 180.62 1o7n n MET 691 N -0.97 1.25 -4.07 1.96 2.81 -1.26 -4.78 117.12 112.06 1o7n n MET 691 Ca 0.35 -0.60 -0.13 0.00 -1.81 0.00 0.00 57.70 55.51 1o7n n MET 691 Cb 0.88 -1.77 -0.12 0.00 -0.71 0.00 0.00 33.22 31.51 1o7n n MET 691 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1o7n s VAL 692 N 1.60 0.54 -0.57 2.03 -7.23 -1.26 -5.10 120.40 110.40 1o7n s VAL 692 Ca 0.40 -1.00 -0.24 0.00 -1.81 0.00 0.00 61.98 59.33 1o7n s VAL 692 Cb 0.19 -0.59 0.04 0.00 0.56 0.00 0.00 36.38 36.58 1o7n s VAL 692 CO 0.00 -0.33 0.97 -0.36 -0.31 0.00 0.00 175.10 175.07 1o7n s PHE 693 N -1.25 2.75 -2.00 2.82 2.99 -1.26 -5.16 117.98 116.87 1o7n s PHE 693 Ca -0.09 -0.04 0.23 0.00 0.00 0.00 0.00 56.93 57.04 1o7n s PHE 693 Cb -0.09 -4.14 1.38 0.00 0.00 0.00 0.00 43.02 40.16 1o7n s PHE 693 CO 0.00 -1.42 1.75 1.28 -0.00 0.00 0.00 175.22 176.83