#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q6b s ARG 443 N 0.00 3.37 1.29 0.54 3.00 -1.26 -5.06 118.95 120.84 2q6b s ARG 443 Ca 0.00 0.85 -0.19 0.00 0.00 0.00 0.00 55.73 56.39 2q6b s ARG 443 Cb 0.00 -2.05 0.32 0.00 0.00 0.00 0.00 34.95 33.22 2q6b s ARG 443 CO 0.00 -0.75 1.00 -2.14 0.00 0.00 0.00 175.30 173.41 2q6b s PRO 444 N -5.03 -1.94 0.00 3.54 0.02 -1.26 -4.94 135.00 125.39 2q6b s PRO 444 Ca 0.57 0.25 0.22 0.00 0.02 0.00 0.00 61.00 62.06 2q6b s PRO 444 Cb -0.12 -1.48 1.07 0.00 0.02 0.00 0.00 34.50 33.98 2q6b s PRO 444 CO 0.52 -4.25 1.72 0.09 -0.33 0.00 0.00 177.00 174.76 2q6b n ASN 445 N -5.20 0.84 -0.04 2.53 3.02 -1.26 -4.01 115.26 111.14 2q6b n ASN 445 Ca 0.10 -1.49 -0.15 0.00 -0.03 0.00 0.00 54.58 53.02 2q6b n ASN 445 Cb 0.59 -0.04 -0.12 0.00 -0.61 0.00 0.00 39.78 39.59 2q6b n ASN 445 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2q6b h GLU 446 N 1.17 0.08 0.00 3.52 4.39 -2.04 -3.33 114.58 118.37 2q6b h GLU 446 Ca 0.00 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2q6b h GLU 446 Cb 0.25 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2q6b h GLU 446 CO 0.00 0.95 0.00 1.49 -1.16 0.00 0.00 179.01 180.29 2q6b h GLU 447 N -0.75 0.00 0.00 2.33 4.81 -1.97 -3.28 114.58 115.73 2q6b h GLU 447 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2q6b h GLU 447 Cb 1.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.40 2q6b h GLU 447 CO 0.03 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.31 2q6b h LEU 449 N 0.00 0.80-10.44 0.00 3.38 -1.75 -3.51 115.31 103.80 2q6b h LEU 449 Ca 0.00 -0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 2q6b h LEU 449 Cb 0.40 -0.18 0.09 0.00 0.09 0.00 0.00 40.66 41.06 2q6b h LEU 449 CO 0.00 0.54 0.38 -1.10 0.09 0.00 0.00 178.44 178.35 2q6b s GLN 450 N -5.80 2.53 0.00 1.13 1.11 -1.21 -5.12 119.66 112.29 2q6b s GLN 450 Ca -0.11 0.57 0.00 0.00 0.01 0.00 0.00 55.36 55.84 2q6b s GLN 450 Cb 0.19 -1.97 0.00 0.00 -1.01 0.00 0.00 33.01 30.22 2q6b s GLN 450 CO 0.78 -1.29 0.00 0.41 0.01 0.00 0.00 175.29 175.20 2q6b n GLY 458 N -2.54 -0.26 0.14 3.09 0.00 -1.26 -5.08 105.19 99.27 2q6b n GLY 458 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 2q6b n GLY 458 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q6b h ALA 459 N -2.00 1.00 0.00 4.61 0.00 -1.97 -3.31 119.26 117.60 2q6b h ALA 459 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2q6b h ALA 459 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2q6b h ALA 459 CO 0.00 0.00 -0.28 -0.22 0.00 0.00 0.00 179.25 178.75 2q6b h LYS 460 N 0.00 0.00 0.00 0.00 3.64 -1.98 -3.03 116.57 115.20 2q6b h LYS 460 Ca 0.00 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.23 2q6b h LYS 460 Cb 0.76 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 2q6b h LYS 460 CO 0.00 0.28 -0.72 0.74 -2.27 0.00 0.00 179.45 177.48 2q6b h PHE 461 N 0.00 0.00 -3.77 1.91 0.05 -2.00 -3.45 116.94 109.68 2q6b h PHE 461 Ca -0.00 0.00 -0.49 0.00 3.82 0.00 0.00 57.97 61.29 2q6b h PHE 461 Cb 0.70 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.64 2q6b h PHE 461 CO 0.00 0.72 0.38 -0.51 -0.18 0.00 0.00 178.31 178.72 2q6b s LEU 462 N -6.94 4.61 0.97 1.54 1.43 -1.15 -5.05 118.68 114.09 2q6b s LEU 462 Ca 0.01 2.02 -0.16 0.00 -1.03 0.00 0.00 54.13 54.98 2q6b s LEU 462 Cb 0.10 -3.63 0.19 0.00 0.03 0.00 0.00 46.19 42.89 2q6b s LEU 462 CO 0.77 0.08 1.27 -0.44 0.23 0.00 0.00 176.35 178.26 2q6b s SER 463 N -1.12 3.01 0.11 2.29 0.01 -1.26 -4.88 113.70 111.86 2q6b s SER 463 Ca 0.42 0.41 -0.16 0.00 1.31 0.00 0.00 55.95 57.93 2q6b s SER 463 Cb -0.27 -0.56 -0.04 0.00 0.21 0.00 0.00 66.02 65.36 2q6b s SER 463 CO 0.34 -2.81 1.58 0.44 0.41 0.00 0.00 173.24 173.20 2q6b h ASP 464 N -1.69 0.57 0.89 2.44 3.32 -1.97 -2.68 116.42 117.30 2q6b h ASP 464 Ca -0.45 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 56.31 2q6b h ASP 464 Cb 1.26 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 2q6b h ASP 464 CO 0.42 0.70 -0.10 0.00 -1.72 0.00 0.00 179.24 178.54 2q6b h ALA 465 N 0.89 1.04 -0.18 3.45 0.00 -1.99 -2.53 119.26 119.94 2q6b h ALA 465 Ca 0.10 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2q6b h ALA 465 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2q6b h ALA 465 CO 0.01 0.13 -0.36 0.93 0.00 0.00 0.00 179.25 179.95 2q6b h GLU 466 N 0.00 0.56 -0.08 0.00 3.07 -1.87 -2.75 114.58 113.50 2q6b h GLU 466 Ca -0.00 -0.36 -0.15 0.00 -0.50 0.00 0.00 59.36 58.34 2q6b h GLU 466 Cb 0.58 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.52 2q6b h GLU 466 CO 0.01 0.98 -0.61 0.82 -1.40 0.00 0.00 179.01 178.80 2q6b h ILE 467 N 0.21 1.38 -0.05 3.13 1.08 -1.33 -2.85 117.51 119.08 2q6b h ILE 467 Ca 0.00 -1.99 -0.14 0.00 -0.39 0.00 0.00 64.86 62.35 2q6b h ILE 467 Cb 0.96 2.00 -0.01 0.00 -3.07 0.00 0.00 36.82 36.70 2q6b h ILE 467 CO 0.08 0.59 -0.59 0.40 -0.69 0.00 0.00 178.15 177.94 2q6b h ILE 468 N 0.21 1.39 0.00 -0.67 2.04 -1.53 -2.76 117.51 116.20 2q6b h ILE 468 Ca -0.01 -1.97 -0.05 0.00 1.00 0.00 0.00 64.86 63.83 2q6b h ILE 468 Cb 1.13 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 39.21 2q6b h ILE 468 CO 0.10 0.57 -0.25 1.56 0.00 0.00 0.00 178.15 180.13 2q6b h GLN 469 N 0.12 0.00 -0.00 2.37 1.08 -1.39 -2.76 115.11 114.53 2q6b h GLN 469 Ca -0.00 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.06 2q6b h GLN 469 Cb 1.07 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.48 2q6b h GLN 469 CO 0.09 0.25 -0.63 -0.07 -0.95 0.00 0.00 178.83 177.52 2q6b h LEU 470 N 0.00 0.01 -0.11 1.46 4.07 -1.26 -2.23 115.31 117.25 2q6b h LEU 470 Ca -0.00 -0.01 -0.13 0.00 0.08 0.00 0.00 57.88 57.82 2q6b h LEU 470 Cb 0.85 -0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.59 2q6b h LEU 470 CO 0.03 0.64 -0.45 0.58 -1.08 0.00 0.00 178.44 178.16 2q6b h VAL 471 N 0.01 1.37 -0.00 1.22 2.07 -1.31 -2.41 116.25 117.20 2q6b h VAL 471 Ca -0.01 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.75 2q6b h VAL 471 Cb 1.11 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 33.03 2q6b h VAL 471 CO 0.08 0.53 -0.08 0.59 0.02 0.00 0.00 177.57 178.71 2q6b n ASN 472 N -4.27 0.09 -0.07 0.57 5.03 -1.06 -3.28 115.26 112.26 2q6b n ASN 472 Ca -0.08 0.34 0.08 0.00 0.87 0.00 0.00 54.58 55.80 2q6b n ASN 472 Cb 0.57 -0.37 -0.08 0.00 -1.02 0.00 0.00 39.78 38.88 2q6b n ASN 472 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2q6b n ALA 473 N -1.48 4.14 -2.58 5.41 0.00 -0.84 -5.01 120.51 120.15 2q6b n ALA 473 Ca 0.07 -0.51 -0.20 0.00 0.00 0.00 0.00 53.44 52.81 2q6b n ALA 473 Cb 0.33 -0.64 0.01 0.00 0.00 0.00 0.00 19.45 19.15 2q6b n ALA 473 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2q6b n LYS 474 N -1.20 -2.62 0.23 0.00 5.02 -0.93 -4.92 118.16 113.73 2q6b n LYS 474 Ca 0.04 0.89 -0.14 0.00 -2.02 0.00 0.00 58.31 57.08 2q6b n LYS 474 Cb 0.29 -5.51 -0.08 0.00 -0.02 0.00 0.00 35.03 29.72 2q6b n LYS 474 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2q6b h HIS 475 N -0.47 -0.55 -3.45 2.13 2.76 -1.81 -3.42 115.15 110.34 2q6b h HIS 475 Ca -0.47 -0.01 -0.66 0.00 -2.20 0.00 0.00 60.37 57.03 2q6b h HIS 475 Cb 1.34 0.18 -0.25 0.00 1.55 0.00 0.00 27.41 30.23 2q6b h HIS 475 CO 0.50 -0.22 -0.75 -1.50 -1.30 0.00 0.00 177.93 174.66 2q6b s ILE 476 N -4.79 3.20 0.94 6.26 2.07 -1.25 -5.13 121.20 122.51 2q6b s ILE 476 Ca -0.14 -0.62 -0.11 0.00 -1.41 0.00 0.00 60.65 58.37 2q6b s ILE 476 Cb 0.02 -2.33 0.14 0.00 0.13 0.00 0.00 42.46 40.41 2q6b s ILE 476 CO 0.52 0.54 1.00 -2.65 -1.91 0.00 0.00 174.94 172.43 2q6b n PRO 477 N 3.25 -0.56 -0.01 3.50 -0.02 -1.26 -4.65 135.00 135.25 2q6b n PRO 477 Ca -0.18 -0.10 -0.05 0.00 -2.02 0.00 0.00 63.50 61.15 2q6b n PRO 477 Cb 0.53 -2.27 0.16 0.00 -0.02 0.00 0.00 33.50 31.90 2q6b n PRO 477 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2q6b h ALA 478 N -1.89 1.00 0.00 3.55 0.00 -1.96 -2.97 119.26 116.98 2q6b h ALA 478 Ca -0.44 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.09 2q6b h ALA 478 Cb 1.28 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2q6b h ALA 478 CO 0.40 0.60 0.00 0.10 0.00 0.00 0.00 179.25 180.35 2q6b h TYR 479 N 0.47 0.00 -0.93 0.00 -0.00 -2.05 -3.05 116.97 111.42 2q6b h TYR 479 Ca 0.06 0.00 -0.45 0.00 -0.00 0.00 0.00 58.73 58.34 2q6b h TYR 479 Cb 0.74 0.00 -0.27 0.00 -0.00 0.00 0.00 36.73 37.21 2q6b h TYR 479 CO 0.03 0.00 0.57 1.63 -0.00 0.00 0.00 178.16 180.39 2q6b n LYS 480 N -2.53 2.54 0.00 0.10 5.02 -1.12 -4.27 118.16 117.90 2q6b n LYS 480 Ca 0.02 -2.96 0.03 0.00 -2.02 0.00 0.00 58.31 53.38 2q6b n LYS 480 Cb 0.28 -2.17 0.01 0.00 -0.02 0.00 0.00 35.03 33.13 2q6b n LYS 480 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2q6b n LEU 481 N -0.91 1.20 -0.05 -0.35 4.77 -1.15 -4.58 117.00 115.93 2q6b n LEU 481 Ca 0.55 -0.88 -0.14 0.00 -0.03 0.00 0.00 56.01 55.51 2q6b n LEU 481 Cb 1.60 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 42.57 2q6b n LEU 481 CO 0.56 0.25 0.45 -0.33 -1.33 0.00 0.00 177.39 177.00 2q6b h GLU 482 N 0.89 0.02 0.00 3.23 3.07 -1.80 -3.31 114.58 116.68 2q6b h GLU 482 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2q6b h GLU 482 Cb 0.22 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 2q6b h GLU 482 CO 0.00 0.86 -0.40 1.15 -1.40 0.00 0.00 179.01 179.22 2q6b h THR 483 N -0.81 0.00 -0.15 1.13 2.02 -1.89 -3.35 112.91 109.86 2q6b h THR 483 Ca -0.00 -0.81 -0.09 0.00 0.77 0.00 0.00 66.41 66.28 2q6b h THR 483 Cb 0.87 1.60 -0.00 0.00 -1.74 0.00 0.00 68.15 68.88 2q6b h THR 483 CO 0.01 0.00 -0.24 -0.07 0.37 0.00 0.00 175.52 175.59 2q6b h LEU 484 N 0.00 0.47 -9.12 2.58 4.07 -1.81 -3.41 115.31 108.09 2q6b h LEU 484 Ca 0.00 -0.53 -0.57 0.00 0.08 0.00 0.00 57.88 56.86 2q6b h LEU 484 Cb 0.91 -0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.46 2q6b h LEU 484 CO 0.00 0.91 0.80 -0.63 -1.08 0.00 0.00 178.44 178.45 2q6b s ILE 485 N -4.11 4.57 -0.09 1.22 1.01 -1.24 -4.57 121.20 117.99 2q6b s ILE 485 Ca -0.14 1.89 -0.13 0.00 0.00 0.00 0.00 60.65 62.28 2q6b s ILE 485 Cb 0.05 -4.22 -0.10 0.00 0.01 0.00 0.00 42.46 38.20 2q6b s ILE 485 CO 0.78 -0.15 0.44 -0.08 0.00 0.00 0.00 174.94 175.93 2q6b h GLU 486 N 7.61 -0.11 -6.68 2.79 4.57 -1.88 -3.46 114.58 117.42 2q6b h GLU 486 Ca -0.22 0.01 -0.52 0.00 -1.18 0.00 0.00 59.36 57.44 2q6b h GLU 486 Cb 1.08 0.03 0.03 0.00 -0.16 0.00 0.00 28.75 29.73 2q6b h GLU 486 CO 0.96 0.23 0.62 -0.08 -1.18 0.00 0.00 179.01 179.55 2q6b s THR 487 N -2.34 3.32 0.02 0.32 -1.32 -1.26 -4.96 115.64 109.43 2q6b s THR 487 Ca -0.08 1.11 -0.19 0.00 -1.21 0.00 0.00 61.69 61.31 2q6b s THR 487 Cb -0.00 -3.71 -0.19 0.00 -1.51 0.00 0.00 72.50 67.09 2q6b s THR 487 CO 0.29 0.17 1.20 0.45 -2.21 0.00 0.00 174.62 174.53 2q6b h HIS 488 N 5.23 0.58 -0.19 9.09 3.86 -1.99 -2.94 115.15 128.79 2q6b h HIS 488 Ca -0.45 -0.26 -0.04 0.00 -1.16 0.00 0.00 60.37 58.47 2q6b h HIS 488 Cb 1.21 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.58 2q6b h HIS 488 CO 0.62 1.02 -0.05 1.49 0.86 0.00 0.00 177.93 181.86 2q6b h GLU 489 N -0.02 0.29 -0.00 2.45 4.81 -1.93 -2.10 114.58 118.07 2q6b h GLU 489 Ca -0.03 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 58.97 2q6b h GLU 489 Cb 1.07 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 2q6b h GLU 489 CO 0.09 0.36 -0.82 -0.09 -0.73 0.00 0.00 179.01 177.82 2q6b h ARG 490 N 0.28 0.11 -0.19 1.92 2.43 -1.98 -2.15 114.38 114.80 2q6b h ARG 490 Ca 0.06 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 59.05 2q6b h ARG 490 Cb 0.28 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2q6b h ARG 490 CO 0.01 0.87 -0.19 0.78 -1.51 0.00 0.00 179.97 179.92 2q6b h GLY 491 N 2.07 0.35 1.37 2.80 0.00 -1.22 -1.61 103.07 106.83 2q6b h GLY 491 Ca -0.03 -0.25 -0.20 0.00 0.00 0.00 0.00 47.33 46.86 2q6b h GLY 491 CO 0.12 0.23 -0.71 -2.08 0.00 0.00 0.00 176.54 174.10 2q6b h VAL 492 N 0.30 1.32 -0.67 4.60 2.07 -1.32 -2.72 116.25 119.83 2q6b h VAL 492 Ca 0.05 -1.99 -0.05 0.00 0.82 0.00 0.00 66.70 65.54 2q6b h VAL 492 Cb 0.52 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 2q6b h VAL 492 CO 0.03 0.62 0.23 -1.28 0.02 0.00 0.00 177.57 177.20 2q6b h SER 493 N 0.44 0.96 -0.31 0.57 0.87 -1.07 -1.65 113.55 113.36 2q6b h SER 493 Ca -0.03 -0.19 -0.17 0.00 -1.23 0.00 0.00 61.79 60.16 2q6b h SER 493 Cb 1.30 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 63.01 2q6b h SER 493 CO 0.14 0.90 -0.47 0.40 -0.53 0.00 0.00 176.83 177.27 2q6b h ILE 494 N 0.97 1.27 -0.50 2.23 2.04 -1.35 -2.24 117.51 119.95 2q6b h ILE 494 Ca 0.22 -1.65 -0.04 0.00 1.00 0.00 0.00 64.86 64.39 2q6b h ILE 494 Cb 0.26 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2q6b h ILE 494 CO -0.01 0.54 0.15 -0.09 0.00 0.00 0.00 178.15 178.74 2q6b h ARG 495 N 0.70 0.74 -0.38 2.37 2.43 -1.34 -1.55 114.38 117.35 2q6b h ARG 495 Ca 0.04 -0.13 -0.14 0.00 -0.81 0.00 0.00 59.98 58.94 2q6b h ARG 495 Cb 1.07 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 2q6b h ARG 495 CO 0.11 0.64 -0.31 0.00 -1.51 0.00 0.00 179.97 178.91 2q6b h ARG 496 N 0.72 0.82 -0.33 0.20 3.08 -1.15 -1.22 114.38 116.51 2q6b h ARG 496 Ca 0.17 -0.38 -0.16 0.00 0.07 0.00 0.00 59.98 59.68 2q6b h ARG 496 Cb 0.22 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 2q6b h ARG 496 CO -0.01 1.01 -0.42 1.96 -1.07 0.00 0.00 179.97 181.45 2q6b h GLN 497 N 0.69 0.86 -0.54 0.04 4.20 -1.13 -0.72 115.11 118.52 2q6b h GLN 497 Ca 0.08 -0.49 -0.03 0.00 0.06 0.00 0.00 58.65 58.27 2q6b h GLN 497 Cb 0.85 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.64 2q6b h GLN 497 CO 0.07 1.13 0.23 -0.07 -0.67 0.00 0.00 178.83 179.52 2q6b h LEU 498 N 0.65 0.73 -1.16 1.46 3.38 -1.28 -2.96 115.31 116.12 2q6b h LEU 498 Ca 0.04 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 2q6b h LEU 498 Cb 1.01 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2q6b h LEU 498 CO 0.10 0.69 -0.08 0.25 0.09 0.00 0.00 178.44 179.49 2q6b h LEU 499 N 0.73 0.46 -1.14 1.67 5.85 -1.08 -3.16 115.31 118.64 2q6b h LEU 499 Ca 0.18 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2q6b h LEU 499 Cb 0.18 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 2q6b h LEU 499 CO -0.02 0.59 0.35 0.28 -0.34 0.00 0.00 178.44 179.31 2q6b h SER 500 N 0.46 0.85 0.48 1.25 0.02 -0.95 -1.92 113.55 113.74 2q6b h SER 500 Ca 0.09 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2q6b h SER 500 Cb 0.43 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.75 2q6b h SER 500 CO 0.02 0.70 0.00 0.29 -1.14 0.00 0.00 176.83 176.70 2q6b n LYS 501 N -4.36 0.44 0.05 3.45 4.76 -1.19 -2.71 118.16 118.60 2q6b n LYS 501 Ca 0.07 0.02 0.11 0.00 -2.87 0.00 0.00 58.31 55.64 2q6b n LYS 501 Cb 0.11 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 31.76 2q6b n LYS 501 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2q6b n LYS 502 N -1.26 0.54 -3.28 1.97 5.02 -0.73 -4.96 118.16 115.46 2q6b n LYS 502 Ca 0.14 -0.01 -0.35 0.00 -2.02 0.00 0.00 58.31 56.08 2q6b n LYS 502 Cb 0.21 -1.68 -0.06 0.00 -0.02 0.00 0.00 35.03 33.49 2q6b n LYS 502 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2q6b s LEU 503 N -4.74 4.29 0.42 -0.35 1.43 -1.10 -4.98 118.68 113.65 2q6b s LEU 503 Ca -0.02 1.16 0.12 0.00 -1.03 0.00 0.00 54.13 54.36 2q6b s LEU 503 Cb 0.12 -3.47 0.89 0.00 0.03 0.00 0.00 46.19 43.76 2q6b s LEU 503 CO 0.83 0.03 1.96 0.77 0.23 0.00 0.00 176.35 180.17 2q6b h SER 504 N 3.27 0.13 -4.03 2.29 4.64 -1.93 -3.29 113.55 114.63 2q6b h SER 504 Ca -0.48 -0.02 -0.66 0.00 -0.47 0.00 0.00 61.79 60.15 2q6b h SER 504 Cb 1.19 -0.03 -0.39 0.00 -0.31 0.00 0.00 62.40 62.85 2q6b h SER 504 CO 0.66 0.29 -0.60 -1.61 -0.87 0.00 0.00 176.83 174.70 2q6b s GLU 505 N -4.72 1.94 0.57 4.77 2.02 -1.26 -4.98 118.70 117.04 2q6b s GLU 505 Ca -0.05 -2.30 0.27 0.00 0.02 0.00 0.00 54.97 52.91 2q6b s GLU 505 Cb 0.16 -3.39 1.53 0.00 0.10 0.00 0.00 34.13 32.52 2q6b s GLU 505 CO 0.72 -1.07 2.05 -1.35 0.02 0.00 0.00 175.26 175.62 2q6b h PRO 506 N 7.10 0.00 0.00 0.39 0.11 -1.70 -2.43 132.00 135.47 2q6b h PRO 506 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2q6b h PRO 506 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2q6b h PRO 506 CO 0.65 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.31 2q6b n SER 507 N -4.01 0.00 0.21 -2.05 3.41 -1.26 -3.71 113.62 106.21 2q6b n SER 507 Ca 0.04 -0.25 0.11 0.00 -0.26 0.00 0.00 58.87 58.51 2q6b n SER 507 Cb 0.43 -0.21 0.67 0.00 -0.26 0.00 0.00 64.21 64.84 2q6b n SER 507 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2q6b h SER 508 N 0.00 0.00 1.00 4.04 4.64 -1.85 -2.55 113.55 118.84 2q6b h SER 508 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2q6b h SER 508 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2q6b h SER 508 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 2q6b n LEU 509 N -4.45 0.26 -0.28 5.97 4.32 -1.24 -4.28 117.00 117.30 2q6b n LEU 509 Ca -0.00 0.53 0.00 0.00 -0.02 0.00 0.00 56.01 56.52 2q6b n LEU 509 Cb 0.19 -0.46 0.20 0.00 -1.62 0.00 0.00 43.42 41.73 2q6b n LEU 509 CO 0.34 -0.14 1.26 1.56 -1.22 0.00 0.00 177.39 179.19 2q6b h GLN 510 N 0.00 1.10 -0.33 3.23 4.20 -1.74 -2.22 115.11 119.35 2q6b h GLN 510 Ca 0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2q6b h GLN 510 Cb 0.50 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2q6b h GLN 510 CO 0.00 0.73 0.00 0.66 -0.67 0.00 0.00 178.83 179.55 2q6b n TYR 511 N -4.42 0.42 -2.80 2.96 4.02 -1.26 -4.76 117.16 111.31 2q6b n TYR 511 Ca 0.10 -0.21 -0.43 0.00 -0.01 0.00 0.00 57.90 57.36 2q6b n TYR 511 Cb 0.05 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.34 2q6b n TYR 511 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2q6b s LEU 512 N -1.56 3.99 0.64 7.72 2.96 -0.84 -5.04 118.68 126.55 2q6b s LEU 512 Ca 0.37 -0.03 -0.13 0.00 -0.22 0.00 0.00 54.13 54.12 2q6b s LEU 512 Cb 0.22 -3.08 -0.02 0.00 0.50 0.00 0.00 46.19 43.82 2q6b s LEU 512 CO 0.31 -1.14 1.05 -2.16 -1.32 0.00 0.00 176.35 173.09 2q6b s PRO 513 N 3.92 3.15 0.00 0.98 0.04 -1.26 -4.89 135.00 136.95 2q6b s PRO 513 Ca 0.35 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.45 2q6b s PRO 513 Cb -0.11 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.42 2q6b s PRO 513 CO 0.24 -0.93 0.00 2.48 0.04 0.00 0.00 177.00 178.83 2q6b n TYR 514 N -2.59 0.00 -1.45 0.56 0.18 -1.26 -1.60 117.16 111.00 2q6b n TYR 514 Ca 0.08 0.00 -0.31 0.00 1.88 0.00 0.00 57.90 59.55 2q6b n TYR 514 Cb 0.53 0.00 0.07 0.00 -0.38 0.00 0.00 39.34 39.56 2q6b n TYR 514 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 2q6b s ARG 515 N -0.60 2.60 0.00 -3.48 0.52 -1.26 -3.86 118.95 112.88 2q6b s ARG 515 Ca 0.00 1.10 0.00 0.00 -0.52 0.00 0.00 55.73 56.31 2q6b s ARG 515 Cb 0.00 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.53 2q6b s ARG 515 CO 0.00 -1.37 0.00 -0.25 0.02 0.00 0.00 175.30 173.70 2q6b n ASP 516 N -3.24 -3.23 -4.83 0.23 8.00 -1.26 -4.97 116.55 107.26 2q6b n ASP 516 Ca 0.08 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.21 2q6b n ASP 516 Cb 0.53 -2.60 -0.06 0.00 -0.02 0.00 0.00 41.12 38.97 2q6b n ASP 516 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2q6b s TYR 517 N -1.32 3.61 -0.83 1.24 5.04 -1.25 -5.03 117.35 118.81 2q6b s TYR 517 Ca 0.00 0.69 -0.24 0.00 -2.44 0.00 0.00 57.07 55.08 2q6b s TYR 517 Cb 0.00 -2.14 0.05 0.00 0.35 0.00 0.00 41.96 40.22 2q6b s TYR 517 CO 0.00 0.59 1.26 1.21 -1.34 0.00 0.00 175.55 177.27 2q6b s ASN 518 N -0.70 6.31 0.00 4.32 3.04 -1.26 -4.85 114.94 121.81 2q6b s ASN 518 Ca 0.18 -1.01 0.31 0.00 0.04 0.00 0.00 52.86 52.38 2q6b s ASN 518 Cb -0.14 -2.52 1.70 0.00 -1.54 0.00 0.00 41.25 38.75 2q6b s ASN 518 CO 0.07 -1.59 2.13 -1.22 -3.04 0.00 0.00 177.10 173.45 2q6b n TYR 519 N 8.64 0.00 -0.33 0.43 4.02 -1.26 -4.03 117.16 124.63 2q6b n TYR 519 Ca 0.13 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.07 2q6b n TYR 519 Cb 0.49 -0.11 0.23 0.00 -0.02 0.00 0.00 39.34 39.93 2q6b n TYR 519 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2q6b h SER 520 N 0.11 0.93 1.27 7.72 4.64 -1.94 -1.67 113.55 124.62 2q6b h SER 520 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2q6b h SER 520 Cb 0.14 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2q6b h SER 520 CO 0.00 0.57 -0.47 -0.07 -0.87 0.00 0.00 176.83 175.98 2q6b h LEU 521 N 1.04 0.00 0.07 5.97 3.38 -1.98 -3.37 115.31 120.42 2q6b h LEU 521 Ca 0.43 -0.07 -0.16 0.00 0.09 0.00 0.00 57.88 58.17 2q6b h LEU 521 Cb 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2q6b h LEU 521 CO -0.19 0.04 -0.82 0.58 0.09 0.00 0.00 178.44 178.13 2q6b h VAL 522 N 0.00 1.35 -3.10 1.22 2.07 -1.61 -3.40 116.25 112.77 2q6b h VAL 522 Ca 0.00 -2.38 -0.53 0.00 0.82 0.00 0.00 66.70 64.62 2q6b h VAL 522 Cb 0.87 2.94 0.03 0.00 -1.52 0.00 0.00 31.29 33.61 2q6b h VAL 522 CO 0.00 0.61 0.72 -0.04 0.02 0.00 0.00 177.57 178.87 2q6b s MET 523 N -2.37 4.33 -0.76 1.57 -1.94 -0.69 -1.18 119.30 118.25 2q6b s MET 523 Ca -0.20 2.10 0.00 0.00 -1.71 0.00 0.00 55.69 55.88 2q6b s MET 523 Cb 0.02 -3.22 0.00 0.00 2.01 0.00 0.00 34.83 33.64 2q6b s MET 523 CO 0.73 -0.40 0.00 0.41 -0.01 0.00 0.00 175.02 175.74 2q6b n GLY 524 N 3.16 0.53 2.03 -0.03 0.00 -1.26 -4.79 105.19 104.83 2q6b n GLY 524 Ca 0.10 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2q6b n GLY 524 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q6b n ALA 525 N -0.10 0.66 -0.04 4.61 0.00 -1.07 -5.04 120.51 119.54 2q6b n ALA 525 Ca -0.09 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.31 2q6b n ALA 525 Cb 0.41 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.82 2q6b n ALA 525 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q6b s GLU 528 N -1.15 1.90 -1.40 0.00 8.01 -1.26 -4.31 118.70 120.49 2q6b s GLU 528 Ca -0.12 -1.76 -0.02 0.00 0.01 0.00 0.00 54.97 53.08 2q6b s GLU 528 Cb -0.04 -1.85 0.02 0.00 -4.31 0.00 0.00 34.13 27.95 2q6b s GLU 528 CO 0.05 0.24 0.59 0.09 0.01 0.00 0.00 175.26 176.24 2q6b n ASN 529 N -0.78 -1.19 -4.69 -0.19 3.02 -1.26 -4.87 115.26 105.29 2q6b n ASN 529 Ca -0.05 -0.92 -0.42 0.00 -0.03 0.00 0.00 54.58 53.16 2q6b n ASN 529 Cb 0.61 -3.47 -0.03 0.00 -0.61 0.00 0.00 39.78 36.29 2q6b n ASN 529 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2q6b s VAL 530 N -3.76 4.24 -0.49 2.41 1.01 -1.26 -4.91 120.40 117.64 2q6b s VAL 530 Ca 0.11 1.58 0.05 0.00 0.00 0.00 0.00 61.98 63.72 2q6b s VAL 530 Cb -0.06 -4.01 0.11 0.00 0.00 0.00 0.00 36.38 32.42 2q6b s VAL 530 CO 0.86 0.03 0.96 2.30 0.00 0.00 0.00 175.10 179.25 2q6b n ILE 531 N 4.44 0.66 -0.46 2.22 -5.35 -1.26 -4.61 119.36 115.00 2q6b n ILE 531 Ca 0.10 -0.83 0.00 0.00 -0.27 0.00 0.00 62.75 61.75 2q6b n ILE 531 Cb 0.46 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 39.07 2q6b n ILE 531 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2q6b n GLY 532 N 0.07 0.37 3.11 3.28 0.00 -1.26 -4.80 105.19 105.96 2q6b n GLY 532 Ca 0.04 -1.42 -0.09 0.00 0.00 0.00 0.00 46.02 44.56 2q6b n GLY 532 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2q6b s TYR 533 N -3.66 0.25 -0.35 1.61 -0.85 -0.63 -4.97 117.35 108.76 2q6b s TYR 533 Ca 0.00 -0.60 -0.05 0.00 -0.52 0.00 0.00 57.07 55.90 2q6b s TYR 533 Cb 0.00 -0.18 0.06 0.00 0.38 0.00 0.00 41.96 42.22 2q6b s TYR 533 CO 0.00 -0.37 0.12 1.41 -1.52 0.00 0.00 175.55 175.19 2q6b s MET 534 N -2.86 2.46 -0.06 -3.49 -2.45 -1.26 -4.10 119.30 107.55 2q6b s MET 534 Ca -0.03 -1.35 -0.30 0.00 -1.25 0.00 0.00 55.69 52.76 2q6b s MET 534 Cb 0.00 -3.46 -0.03 0.00 1.25 0.00 0.00 34.83 32.59 2q6b s MET 534 CO -0.06 -0.77 1.25 -1.25 1.05 0.00 0.00 175.02 175.24 2q6b s PRO 535 N 1.32 4.33 -0.18 4.11 0.04 -1.26 -5.02 135.00 138.33 2q6b s PRO 535 Ca -0.00 1.73 -0.02 0.00 0.04 0.00 0.00 61.00 62.74 2q6b s PRO 535 Cb -0.21 -3.58 -0.01 0.00 0.04 0.00 0.00 34.50 30.74 2q6b s PRO 535 CO 0.00 -0.50 -0.08 0.42 0.04 0.00 0.00 177.00 176.88 2q6b s ILE 536 N 2.39 3.24 0.26 0.56 -1.09 -1.26 -5.09 121.20 120.21 2q6b s ILE 536 Ca 0.57 -0.56 -0.31 0.00 -2.23 0.00 0.00 60.65 58.13 2q6b s ILE 536 Cb -0.26 -2.43 -0.13 0.00 -1.58 0.00 0.00 42.46 38.06 2q6b s ILE 536 CO 0.22 0.47 1.40 -2.65 -1.23 0.00 0.00 174.94 173.15 2q6b n PRO 537 N 4.23 2.07 -4.56 2.79 -0.02 -1.26 -4.79 135.00 133.46 2q6b n PRO 537 Ca -0.18 0.74 -0.33 0.00 -2.02 0.00 0.00 63.50 61.70 2q6b n PRO 537 Cb 0.52 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.47 2q6b n PRO 537 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2q6b s VAL 538 N -0.20 3.10 0.42 -1.45 1.01 -1.26 -1.49 120.40 120.53 2q6b s VAL 538 Ca 0.66 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 62.08 2q6b s VAL 538 Cb -0.63 -2.33 -0.07 0.00 0.00 0.00 0.00 36.38 33.35 2q6b s VAL 538 CO 0.51 0.51 0.01 -0.83 0.00 0.00 0.00 175.10 175.30 2q6b s GLY 539 N 0.60 2.54 -0.10 4.51 0.00 -0.50 -4.93 107.32 109.45 2q6b s GLY 539 Ca -0.07 -2.17 0.03 0.00 0.00 0.00 0.00 44.72 42.52 2q6b s GLY 539 CO 0.03 -2.10 -0.22 0.14 0.00 0.00 0.00 173.10 170.95 2q6b s VAL 540 N -2.72 1.90 -0.20 1.40 1.01 -1.26 -0.98 120.40 119.55 2q6b s VAL 540 Ca 0.33 -0.92 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 2q6b s VAL 540 Cb 0.09 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 2q6b s VAL 540 CO 0.17 0.52 -0.06 0.00 0.00 0.00 0.00 175.10 175.74 2q6b s ALA 541 N 0.46 2.80 0.00 5.51 0.00 -0.67 -4.95 121.76 124.91 2q6b s ALA 541 Ca -0.17 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.71 2q6b s ALA 541 Cb -0.17 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 21.34 2q6b s ALA 541 CO 0.07 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2q6b n GLY 542 N 4.46 0.20 3.73 0.00 0.00 -1.26 -1.63 105.19 110.68 2q6b n GLY 542 Ca -0.18 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.29 2q6b n GLY 542 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2q6b s PRO 543 N -2.00 4.59 -0.41 1.61 0.04 -1.26 -4.97 135.00 132.59 2q6b s PRO 543 Ca 0.00 1.70 -0.20 0.00 0.04 0.00 0.00 61.00 62.54 2q6b s PRO 543 Cb 0.00 -3.29 0.02 0.00 0.04 0.00 0.00 34.50 31.26 2q6b s PRO 543 CO 0.00 0.06 0.59 -1.17 0.04 0.00 0.00 177.00 176.51 2q6b s LEU 544 N -0.21 4.52 -0.55 -3.56 2.96 0.01 -4.69 118.68 117.16 2q6b s LEU 544 Ca 0.50 -0.31 -0.24 0.00 -0.22 0.00 0.00 54.13 53.86 2q6b s LEU 544 Cb -0.29 -2.65 0.04 0.00 0.50 0.00 0.00 46.19 43.79 2q6b s LEU 544 CO 0.34 -0.68 0.96 0.00 -1.32 0.00 0.00 176.35 175.65 2q6b s LEU 546 N 4.02 0.17 -1.25 0.00 2.96 -0.61 -1.28 118.68 122.69 2q6b s LEU 546 Ca 0.31 -0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 54.18 2q6b s LEU 546 Cb -0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 46.19 46.41 2q6b s LEU 546 CO 0.20 -0.27 0.80 0.47 -1.32 0.00 0.00 176.35 176.23 2q6b n ASP 547 N 5.30 -2.00 0.00 3.68 8.00 -0.52 -2.31 116.55 128.69 2q6b n ASP 547 Ca -0.04 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.70 2q6b n ASP 547 Cb 0.50 -4.40 0.00 0.00 -0.02 0.00 0.00 41.12 37.20 2q6b n ASP 547 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2q6b n GLU 548 N -4.15 -0.14 -4.22 -1.24 1.02 -1.26 -4.97 120.64 105.68 2q6b n GLU 548 Ca -0.27 0.04 -0.26 0.00 -0.02 0.00 0.00 57.16 56.64 2q6b n GLU 548 Cb 0.67 -3.54 -0.07 0.00 -0.02 0.00 0.00 31.44 28.48 2q6b n GLU 548 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2q6b s LYS 549 N -0.55 2.21 -0.06 3.49 1.02 -0.98 -5.14 119.74 119.72 2q6b s LYS 549 Ca 0.00 -1.97 0.02 0.00 0.02 0.00 0.00 55.97 54.04 2q6b s LYS 549 Cb 0.00 -1.91 0.02 0.00 -0.52 0.00 0.00 37.83 35.41 2q6b s LYS 549 CO 0.00 -0.22 -0.09 -1.21 -0.92 0.00 0.00 175.35 172.91 2q6b s GLU 550 N -3.94 1.35 0.01 1.68 2.02 -1.26 -1.57 118.70 116.99 2q6b s GLU 550 Ca 0.35 -0.29 0.08 0.00 0.02 0.00 0.00 54.97 55.13 2q6b s GLU 550 Cb 0.03 -1.17 -0.02 0.00 0.10 0.00 0.00 34.13 33.07 2q6b s GLU 550 CO 0.19 -0.01 -0.26 -0.06 0.02 0.00 0.00 175.26 175.14 2q6b s PHE 551 N 0.74 2.34 -0.43 1.61 0.40 -0.71 -4.90 117.98 117.03 2q6b s PHE 551 Ca -0.13 -0.42 -0.12 0.00 -0.60 0.00 0.00 56.93 55.66 2q6b s PHE 551 Cb -0.15 -1.45 0.06 0.00 0.51 0.00 0.00 43.02 41.99 2q6b s PHE 551 CO 0.02 0.05 0.30 -0.65 0.70 0.00 0.00 175.22 175.64 2q6b s GLN 552 N -0.92 2.80 -0.29 0.44 -1.52 -1.26 -0.81 119.66 118.10 2q6b s GLN 552 Ca 0.11 -1.32 -0.18 0.00 -1.95 0.00 0.00 55.36 52.02 2q6b s GLN 552 Cb -0.10 -3.91 -0.02 0.00 -0.22 0.00 0.00 33.01 28.76 2q6b s GLN 552 CO 0.01 -0.92 0.53 0.08 -0.25 0.00 0.00 175.29 174.73 2q6b s VAL 553 N 1.54 5.04 0.25 1.09 1.01 -0.65 -4.56 120.40 124.12 2q6b s VAL 553 Ca 0.03 0.76 -0.27 0.00 0.00 0.00 0.00 61.98 62.50 2q6b s VAL 553 Cb -0.22 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.19 2q6b s VAL 553 CO 0.05 -0.01 0.89 -2.16 0.00 0.00 0.00 175.10 173.87 2q6b s PRO 554 N 2.37 4.67 -0.16 2.72 0.04 -1.26 -1.67 135.00 141.71 2q6b s PRO 554 Ca 0.21 1.32 -0.05 0.00 0.04 0.00 0.00 61.00 62.53 2q6b s PRO 554 Cb -0.15 -3.10 0.06 0.00 0.04 0.00 0.00 34.50 31.35 2q6b s PRO 554 CO 0.10 0.45 0.10 -1.64 0.04 0.00 0.00 177.00 176.06 2q6b s MET 555 N -1.51 0.06 -0.44 4.56 -1.94 -0.16 -4.33 119.30 115.54 2q6b s MET 555 Ca 0.43 0.02 -0.21 0.00 -1.71 0.00 0.00 55.69 54.21 2q6b s MET 555 Cb -0.22 -1.58 0.02 0.00 2.01 0.00 0.00 34.83 35.06 2q6b s MET 555 CO 0.27 -0.62 0.68 0.00 -0.01 0.00 0.00 175.02 175.34 2q6b s ALA 556 N 2.17 3.33 0.10 3.03 0.00 -0.31 -1.41 121.76 128.67 2q6b s ALA 556 Ca 0.03 -1.16 -0.15 0.00 0.00 0.00 0.00 51.96 50.68 2q6b s ALA 556 Cb -0.15 -3.35 0.03 0.00 0.00 0.00 0.00 23.12 19.64 2q6b s ALA 556 CO -0.09 -1.83 0.37 -0.08 0.00 0.00 0.00 175.76 174.13 2q6b s THR 557 N 2.95 0.08 -0.23 0.00 -1.32 -0.56 -4.31 115.64 112.26 2q6b s THR 557 Ca 0.25 -0.63 0.05 0.00 -1.21 0.00 0.00 61.69 60.14 2q6b s THR 557 Cb -0.14 -1.13 0.11 0.00 -1.51 0.00 0.00 72.50 69.84 2q6b s THR 557 CO 0.20 -0.35 1.08 0.35 -2.21 0.00 0.00 174.62 173.70 2q6b n THR 558 N 0.00 1.11 -3.02 5.08 -2.24 -1.26 -4.18 114.28 109.77 2q6b n THR 558 Ca -0.17 -1.13 -0.42 0.00 -2.27 0.00 0.00 64.05 60.06 2q6b n THR 558 Cb 0.62 0.42 -0.06 0.00 -2.10 0.00 0.00 70.33 69.21 2q6b n THR 558 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2q6b s GLU 559 N -1.21 3.59 0.36 -0.78 2.12 -1.26 -5.03 118.70 116.49 2q6b s GLU 559 Ca 0.09 0.06 -0.29 0.00 0.36 0.00 0.00 54.97 55.20 2q6b s GLU 559 Cb 0.06 -3.86 -0.11 0.00 0.26 0.00 0.00 34.13 30.48 2q6b s GLU 559 CO 0.04 -0.90 1.52 0.41 -0.54 0.00 0.00 175.26 175.79 2q6b n GLY 560 N 4.74 1.24 2.73 -1.50 0.00 -1.26 -2.81 105.19 108.32 2q6b n GLY 560 Ca 0.01 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2q6b n GLY 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q6b h LEU 562 N 0.00 0.13 -0.50 0.00 5.85 -1.96 0.11 115.31 118.94 2q6b h LEU 562 Ca 0.00 -0.25 -0.07 0.00 0.84 0.00 0.00 57.88 58.39 2q6b h LEU 562 Cb 0.00 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2q6b h LEU 562 CO 0.00 0.35 0.03 0.58 -0.34 0.00 0.00 178.44 179.06 2q6b h VAL 563 N -0.10 1.26 -0.48 1.05 2.07 -1.91 -1.45 116.25 116.69 2q6b h VAL 563 Ca 0.02 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.45 2q6b h VAL 563 Cb 0.27 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2q6b h VAL 563 CO 0.00 0.36 0.06 0.00 0.02 0.00 0.00 177.57 178.01 2q6b h ALA 564 N 0.95 1.19 -0.12 1.67 0.00 -1.91 -0.54 119.26 120.50 2q6b h ALA 564 Ca 0.15 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2q6b h ALA 564 Cb 0.48 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2q6b h ALA 564 CO 0.02 0.54 -0.18 1.03 0.00 0.00 0.00 179.25 180.66 2q6b h SER 565 N 0.73 0.36 -0.31 0.00 0.87 -0.79 -2.37 113.55 112.04 2q6b h SER 565 Ca 0.15 -0.53 -0.01 0.00 -1.23 0.00 0.00 61.79 60.18 2q6b h SER 565 Cb 0.36 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 2q6b h SER 565 CO 0.01 0.82 0.18 0.74 -0.53 0.00 0.00 176.83 178.04 2q6b h THR 566 N -0.08 1.11 -0.47 2.23 2.02 -1.13 -2.15 112.91 114.44 2q6b h THR 566 Ca 0.01 -0.28 -0.11 0.00 0.77 0.00 0.00 66.41 66.80 2q6b h THR 566 Cb 0.74 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 2q6b h THR 566 CO 0.04 0.12 -0.15 -1.13 0.37 0.00 0.00 175.52 174.77 2q6b h ASN 567 N 0.46 0.90 -0.32 4.18 -1.24 -0.95 -1.42 115.58 117.18 2q6b h ASN 567 Ca 0.12 -0.30 -0.03 0.00 0.71 0.00 0.00 56.30 56.79 2q6b h ASN 567 Cb 0.02 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.81 2q6b h ASN 567 CO -0.02 1.05 0.09 -0.09 -1.29 0.00 0.00 177.43 177.16 2q6b h ARG 568 N 0.79 0.51 -0.24 6.67 2.43 -0.88 -1.57 114.38 122.09 2q6b h ARG 568 Ca 0.12 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2q6b h ARG 568 Cb 0.69 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 2q6b h ARG 568 CO 0.05 0.57 0.01 0.78 -1.51 0.00 0.00 179.97 179.87 2q6b h GLY 569 N 0.36 0.37 1.05 2.80 0.00 -1.27 -1.87 103.07 104.53 2q6b h GLY 569 Ca 0.10 -0.19 -0.09 0.00 0.00 0.00 0.00 47.33 47.14 2q6b h GLY 569 CO -0.00 0.18 -0.03 0.00 0.00 0.00 0.00 176.54 176.69 2q6b h ARG 571 N 0.86 0.84 -0.39 0.00 2.43 -0.68 -1.17 114.38 116.26 2q6b h ARG 571 Ca 0.15 -0.17 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 2q6b h ARG 571 Cb 0.58 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 2q6b h ARG 571 CO 0.03 0.75 -0.25 0.00 -1.51 0.00 0.00 179.97 178.99 2q6b h ALA 572 N 1.35 0.55 -0.65 2.80 0.00 -1.25 -2.43 119.26 119.63 2q6b h ALA 572 Ca 0.18 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2q6b h ALA 572 Cb 0.28 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2q6b h ALA 572 CO -0.00 0.55 0.18 0.82 0.00 0.00 0.00 179.25 180.79 2q6b h ILE 573 N 0.66 1.25 -0.49 0.00 2.04 -1.22 -2.41 117.51 117.34 2q6b h ILE 573 Ca 0.08 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 2q6b h ILE 573 Cb 0.82 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 2q6b h ILE 573 CO 0.07 0.34 0.13 1.23 0.00 0.00 0.00 178.15 179.92 2q6b h GLY 574 N 0.95 0.83 2.00 5.37 0.00 -1.11 -0.65 103.07 110.46 2q6b h GLY 574 Ca 0.21 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2q6b h GLY 574 CO -0.00 0.48 0.00 1.04 0.00 0.00 0.00 176.54 178.06 2q6b n LEU 575 N -4.48 0.54 -1.42 3.11 4.77 -0.93 -3.19 117.00 115.40 2q6b n LEU 575 Ca 0.01 0.58 0.08 0.00 -0.03 0.00 0.00 56.01 56.64 2q6b n LEU 575 Cb 0.21 -0.43 0.31 0.00 -2.33 0.00 0.00 43.42 41.18 2q6b n LEU 575 CO 0.39 -0.24 0.75 0.61 -1.33 0.00 0.00 177.39 177.57 2q6b n GLY 576 N 0.91 2.35 0.82 -0.72 0.00 -0.91 -4.89 105.19 102.75 2q6b n GLY 576 Ca 0.05 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2q6b n GLY 576 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q6b n GLY 577 N 0.97 0.78 0.00 -0.02 0.00 -1.19 -4.59 105.19 101.15 2q6b n GLY 577 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2q6b n GLY 577 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q6b n GLY 578 N -2.00 0.87 3.77 -0.02 0.00 -0.30 -5.02 105.19 102.49 2q6b n GLY 578 Ca 0.00 -2.02 -0.23 0.00 0.00 0.00 0.00 46.02 43.77 2q6b n GLY 578 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q6b s ALA 579 N -1.62 3.46 -0.02 4.61 0.00 -0.40 -4.56 121.76 123.22 2q6b s ALA 579 Ca 0.00 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.56 2q6b s ALA 579 Cb 0.00 -1.17 -0.00 0.00 0.00 0.00 0.00 23.12 21.95 2q6b s ALA 579 CO 0.00 0.32 -0.10 -1.12 0.00 0.00 0.00 175.76 174.86 2q6b s SER 580 N -3.60 1.28 0.08 0.00 0.01 -0.48 -1.45 113.70 109.55 2q6b s SER 580 Ca 0.32 -0.20 0.01 0.00 1.31 0.00 0.00 55.95 57.39 2q6b s SER 580 Cb -0.08 -0.29 -0.04 0.00 0.21 0.00 0.00 66.02 65.82 2q6b s SER 580 CO 0.23 0.09 -0.06 -0.94 0.41 0.00 0.00 173.24 172.97 2q6b s SER 581 N 0.06 1.02 -0.02 2.44 1.04 -1.26 -1.12 113.70 115.85 2q6b s SER 581 Ca -0.01 -0.94 -0.01 0.00 0.48 0.00 0.00 55.95 55.47 2q6b s SER 581 Cb -0.07 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.16 2q6b s SER 581 CO 0.00 -0.44 0.05 -0.13 0.98 0.00 0.00 173.24 173.70 2q6b s ARG 582 N -3.52 0.02 -0.24 4.02 1.81 -0.51 -5.00 118.95 115.53 2q6b s ARG 582 Ca 0.08 0.15 -0.25 0.00 -1.72 0.00 0.00 55.73 53.99 2q6b s ARG 582 Cb 0.03 -0.10 -0.00 0.00 -0.45 0.00 0.00 34.95 34.43 2q6b s ARG 582 CO -0.05 -0.08 0.85 0.08 -0.68 0.00 0.00 175.30 175.42 2q6b s VAL 583 N 0.54 4.82 -0.11 3.52 1.01 -1.26 -1.63 120.40 127.29 2q6b s VAL 583 Ca -0.04 1.61 0.08 0.00 0.00 0.00 0.00 61.98 63.63 2q6b s VAL 583 Cb -0.06 -4.14 -0.24 0.00 0.00 0.00 0.00 36.38 31.95 2q6b s VAL 583 CO -0.02 -0.08 0.40 0.18 0.00 0.00 0.00 175.10 175.59 2q6b n LEU 584 N 6.02 1.36 -3.67 3.92 4.77 0.95 -5.00 117.00 125.35 2q6b n LEU 584 Ca 0.06 0.24 -0.11 0.00 -0.03 0.00 0.00 56.01 56.18 2q6b n LEU 584 Cb 0.47 -0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 41.31 2q6b n LEU 584 CO 0.48 0.58 0.13 0.00 -1.33 0.00 0.00 177.39 177.24 2q6b s ALA 585 N -2.56 -0.85 -0.19 -1.18 0.00 -1.18 -4.97 121.76 110.82 2q6b s ALA 585 Ca -0.13 -0.06 -0.06 0.00 0.00 0.00 0.00 51.96 51.71 2q6b s ALA 585 Cb 0.07 0.61 0.09 0.00 0.00 0.00 0.00 23.12 23.90 2q6b s ALA 585 CO 0.79 -0.60 0.37 0.34 0.00 0.00 0.00 175.76 176.67 2q6b s ASP 586 N -2.68 -0.01 0.00 0.00 2.15 -1.25 -1.33 116.67 113.56 2q6b s ASP 586 Ca 0.02 0.75 0.00 0.00 0.43 0.00 0.00 52.55 53.75 2q6b s ASP 586 Cb 0.02 1.15 0.00 0.00 -0.30 0.00 0.00 42.92 43.79 2q6b s ASP 586 CO -0.10 -0.25 0.00 0.61 -0.17 0.00 0.00 175.17 175.26 2q6b n GLY 587 N 5.38 -0.02 3.76 2.66 0.00 -0.65 -4.26 105.19 112.06 2q6b n GLY 587 Ca -0.07 0.74 -0.35 0.00 0.00 0.00 0.00 46.02 46.34 2q6b n GLY 587 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2q6b s MET 588 N 0.00 3.03 0.16 1.61 1.75 -0.63 -1.64 119.30 123.57 2q6b s MET 588 Ca 0.00 1.64 0.06 0.00 -1.25 0.00 0.00 55.69 56.14 2q6b s MET 588 Cb 0.00 -1.96 -0.04 0.00 2.84 0.00 0.00 34.83 35.67 2q6b s MET 588 CO 0.00 -1.12 -0.14 0.95 -0.65 0.00 0.00 175.02 174.07 2q6b s THR 589 N -1.86 1.49 -0.01 10.11 -4.23 -1.26 -1.84 115.64 118.02 2q6b s THR 589 Ca 0.73 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.24 2q6b s THR 589 Cb -0.25 -1.83 0.01 0.00 1.34 0.00 0.00 72.50 71.77 2q6b s THR 589 CO 0.33 -0.55 -0.02 -0.60 -0.54 0.00 0.00 174.62 173.24 2q6b s ARG 590 N -3.30 0.29 -0.56 3.99 6.06 -0.68 -4.91 118.95 119.83 2q6b s ARG 590 Ca 0.16 -0.03 0.07 0.00 -2.50 0.00 0.00 55.73 53.43 2q6b s ARG 590 Cb -0.02 -0.36 0.26 0.00 0.06 0.00 0.00 34.95 34.90 2q6b s ARG 590 CO 0.04 -0.02 0.71 0.41 -2.50 0.00 0.00 175.30 173.94 2q6b n GLY 591 N 3.49 4.35 3.70 8.12 0.00 -1.26 -1.20 105.19 122.39 2q6b n GLY 591 Ca -0.19 -2.43 -0.33 0.00 0.00 0.00 0.00 46.02 43.07 2q6b n GLY 591 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2q6b s PRO 592 N -2.24 1.58 -0.16 1.61 0.04 -1.08 -1.09 135.00 133.66 2q6b s PRO 592 Ca 0.40 1.72 -0.00 0.00 0.04 0.00 0.00 61.00 63.16 2q6b s PRO 592 Cb 0.17 -1.77 -0.00 0.00 0.04 0.00 0.00 34.50 32.94 2q6b s PRO 592 CO -0.05 -2.25 -0.15 0.54 0.04 0.00 0.00 177.00 175.13 2q6b s VAL 593 N -2.22 2.69 0.28 -0.36 0.11 -0.68 -2.03 120.40 118.18 2q6b s VAL 593 Ca 0.72 -0.76 0.11 0.00 -2.93 0.00 0.00 61.98 59.12 2q6b s VAL 593 Cb -0.28 -2.14 -0.05 0.00 -1.53 0.00 0.00 36.38 32.38 2q6b s VAL 593 CO 0.51 0.51 -0.11 0.68 -3.33 0.00 0.00 175.10 173.37 2q6b s VAL 594 N 0.88 2.91 0.01 2.04 -7.23 -0.55 -2.25 120.40 116.22 2q6b s VAL 594 Ca -0.04 -2.18 0.04 0.00 -1.81 0.00 0.00 61.98 57.99 2q6b s VAL 594 Cb -0.15 -2.56 -0.01 0.00 0.56 0.00 0.00 36.38 34.22 2q6b s VAL 594 CO -0.01 -0.38 -0.11 -0.13 -0.31 0.00 0.00 175.10 174.16 2q6b s ARG 595 N -3.59 0.80 0.36 4.82 0.52 -0.12 -0.87 118.95 120.87 2q6b s ARG 595 Ca 0.31 -0.53 0.09 0.00 -0.52 0.00 0.00 55.73 55.07 2q6b s ARG 595 Cb -0.05 -0.77 -0.07 0.00 0.52 0.00 0.00 34.95 34.58 2q6b s ARG 595 CO 0.17 0.20 -0.07 -0.51 0.02 0.00 0.00 175.30 175.12 2q6b s LEU 596 N -0.69 2.75 0.37 2.53 1.02 -0.88 -0.70 118.68 123.07 2q6b s LEU 596 Ca 0.01 -1.24 0.06 0.00 0.02 0.00 0.00 54.13 52.98 2q6b s LEU 596 Cb -0.06 -0.95 0.75 0.00 0.02 0.00 0.00 46.19 45.96 2q6b s LEU 596 CO 0.00 -0.28 1.97 -0.65 0.02 0.00 0.00 176.35 177.42 2q6b h PRO 597 N 1.98 0.71 -4.28 1.29 0.11 -1.88 -3.45 132.00 126.48 2q6b h PRO 597 Ca -0.42 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.49 2q6b h PRO 597 Cb 1.25 -0.16 -0.15 0.00 0.11 0.00 0.00 31.00 32.05 2q6b h PRO 597 CO 0.73 0.47 -0.61 1.03 -0.21 0.00 0.00 178.00 179.41 2q6b s ARG 598 N -5.65 0.84 0.48 1.05 1.81 -1.26 -5.00 118.95 111.22 2q6b s ARG 598 Ca -0.10 -1.31 0.19 0.00 -1.72 0.00 0.00 55.73 52.80 2q6b s ARG 598 Cb 0.19 0.25 1.18 0.00 -0.45 0.00 0.00 34.95 36.12 2q6b s ARG 598 CO 0.77 -0.23 2.02 0.00 -0.68 0.00 0.00 175.30 177.18 2q6b h ALA 599 N 2.92 1.54 -0.10 2.13 0.00 -1.86 -2.08 119.26 121.80 2q6b h ALA 599 Ca -0.34 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.32 2q6b h ALA 599 Cb 1.18 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2q6b h ALA 599 CO 0.60 0.20 -0.37 0.00 0.00 0.00 0.00 179.25 179.68 2q6b h ASP 601 N 0.18 0.75 -0.52 0.00 3.32 -1.80 -2.32 116.42 116.03 2q6b h ASP 601 Ca 0.02 -0.65 -0.07 0.00 0.02 0.00 0.00 57.03 56.35 2q6b h ASP 601 Cb 0.75 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 2q6b h ASP 601 CO 0.06 1.28 0.07 0.77 -1.72 0.00 0.00 179.24 179.69 2q6b h SER 602 N 0.28 0.87 -0.91 6.45 4.64 -1.33 -1.86 113.55 121.69 2q6b h SER 602 Ca -0.05 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2q6b h SER 602 Cb 1.27 -0.23 -0.04 0.00 -0.31 0.00 0.00 62.40 63.09 2q6b h SER 602 CO 0.13 0.90 0.58 0.00 -0.87 0.00 0.00 176.83 177.56 2q6b h ALA 603 N 1.21 1.29 -0.71 5.18 0.00 -1.22 -1.39 119.26 123.62 2q6b h ALA 603 Ca 0.17 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2q6b h ALA 603 Cb 0.42 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2q6b h ALA 603 CO 0.01 0.63 0.26 1.49 0.00 0.00 0.00 179.25 181.63 2q6b h GLU 604 N 1.25 1.08 -0.28 0.00 4.81 -0.81 -1.63 114.58 119.00 2q6b h GLU 604 Ca 0.33 -0.20 -0.16 0.00 -0.13 0.00 0.00 59.36 59.20 2q6b h GLU 604 Cb -0.09 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 2q6b h GLU 604 CO -0.07 0.89 -0.46 0.28 -0.73 0.00 0.00 179.01 178.93 2q6b h VAL 605 N 1.04 1.29 -0.39 0.32 2.07 -0.98 -2.09 116.25 117.52 2q6b h VAL 605 Ca 0.24 -1.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.09 2q6b h VAL 605 Cb 0.24 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 2q6b h VAL 605 CO -0.01 0.53 0.17 0.50 0.02 0.00 0.00 177.57 178.77 2q6b h LYS 606 N 0.57 0.57 -0.43 1.57 3.64 -0.99 -1.91 116.57 119.60 2q6b h LYS 606 Ca 0.03 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 59.25 2q6b h LYS 606 Cb 1.01 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 2q6b h LYS 606 CO 0.10 0.53 -0.03 0.00 -2.27 0.00 0.00 179.45 177.77 2q6b h ALA 607 N 1.02 1.15 -0.50 5.00 0.00 -1.27 -2.69 119.26 121.97 2q6b h ALA 607 Ca 0.13 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2q6b h ALA 607 Cb 0.16 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2q6b h ALA 607 CO -0.01 0.54 -0.02 2.35 0.00 0.00 0.00 179.25 182.11 2q6b h TRP 608 N 0.66 0.99 0.00 0.00 7.01 -1.15 -2.81 115.95 120.66 2q6b h TRP 608 Ca 0.13 -0.18 -0.03 0.00 2.11 0.00 0.00 58.89 60.92 2q6b h TRP 608 Cb 0.45 -0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 27.26 2q6b h TRP 608 CO 0.02 0.93 -0.14 -0.07 -2.79 0.00 0.00 178.44 176.39 2q6b h LEU 609 N 0.76 0.00 0.00 0.65 3.38 -1.22 -2.92 115.31 115.96 2q6b h LEU 609 Ca 0.14 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2q6b h LEU 609 Cb 0.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2q6b h LEU 609 CO 0.03 0.14 -0.42 -0.33 0.09 0.00 0.00 178.44 177.95 2q6b h GLU 610 N 0.00 0.00 -7.16 1.13 5.08 -1.23 -3.33 114.58 109.08 2q6b h GLU 610 Ca -0.00 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.86 2q6b h GLU 610 Cb 0.55 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.89 2q6b h GLU 610 CO 0.02 0.11 0.39 0.95 -1.00 0.00 0.00 179.01 179.49 2q6b s THR 611 N -3.18 3.29 0.27 1.13 -4.23 -1.10 -4.92 115.64 106.91 2q6b s THR 611 Ca 0.04 0.67 0.02 0.00 -1.18 0.00 0.00 61.69 61.24 2q6b s THR 611 Cb 0.07 -3.20 0.06 0.00 1.34 0.00 0.00 72.50 70.77 2q6b s THR 611 CO 0.72 -0.30 1.71 0.77 -0.54 0.00 0.00 174.62 176.98 2q6b h SER 612 N 0.50 0.50 -0.04 3.99 4.64 -1.88 -1.87 113.55 119.38 2q6b h SER 612 Ca -0.48 -0.17 -0.22 0.00 -0.47 0.00 0.00 61.79 60.45 2q6b h SER 612 Cb 1.25 -0.14 0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2q6b h SER 612 CO 0.55 0.75 -0.78 1.05 -0.87 0.00 0.00 176.83 177.53 2q6b h GLU 613 N 0.43 0.69 -0.21 4.77 9.09 -1.93 -1.86 114.58 125.57 2q6b h GLU 613 Ca 0.06 -0.58 -0.05 0.00 0.05 0.00 0.00 59.36 58.85 2q6b h GLU 613 Cb 0.69 0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 27.90 2q6b h GLU 613 CO 0.05 1.19 -0.05 0.78 0.05 0.00 0.00 179.01 181.03 2q6b h GLY 614 N 0.74 0.44 1.71 1.06 0.00 -1.68 -2.75 103.07 102.60 2q6b h GLY 614 Ca -0.05 -0.36 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 2q6b h GLY 614 CO 0.15 0.33 -0.17 -2.75 0.00 0.00 0.00 176.54 174.11 2q6b h PHE 615 N 0.14 0.38 -0.26 5.60 3.57 -1.40 -2.76 116.94 122.20 2q6b h PHE 615 Ca 0.06 -0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.40 2q6b h PHE 615 Cb 0.49 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2q6b h PHE 615 CO 0.05 0.51 -0.24 0.00 -2.23 0.00 0.00 178.31 176.40 2q6b h ALA 616 N 1.51 1.10 -0.37 2.41 0.00 -1.27 0.68 119.26 123.33 2q6b h ALA 616 Ca 0.06 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 2q6b h ALA 616 Cb 0.49 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2q6b h ALA 616 CO 0.03 0.56 -0.15 0.28 0.00 0.00 0.00 179.25 179.97 2q6b h VAL 617 N 0.44 1.28 -0.06 0.00 2.07 -1.25 -2.21 116.25 116.51 2q6b h VAL 617 Ca 0.07 -1.25 -0.16 0.00 0.82 0.00 0.00 66.70 66.17 2q6b h VAL 617 Cb 0.66 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 2q6b h VAL 617 CO 0.05 0.41 -0.68 0.40 0.02 0.00 0.00 177.57 177.77 2q6b h ILE 618 N 0.54 1.40 -0.23 4.57 1.08 -1.27 -2.82 117.51 120.79 2q6b h ILE 618 Ca 0.09 -2.12 -0.14 0.00 -0.39 0.00 0.00 64.86 62.29 2q6b h ILE 618 Cb 0.68 2.10 -0.01 0.00 -3.07 0.00 0.00 36.82 36.52 2q6b h ILE 618 CO 0.05 0.63 -0.46 0.50 -0.69 0.00 0.00 178.15 178.18 2q6b h LYS 619 N 0.20 0.58 -0.61 2.37 3.64 -0.87 -1.79 116.57 120.08 2q6b h LYS 619 Ca -0.02 -0.32 -0.05 0.00 -1.27 0.00 0.00 60.65 58.99 2q6b h LYS 619 Cb 1.22 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 2q6b h LYS 619 CO 0.11 0.92 0.19 1.49 -2.27 0.00 0.00 179.45 179.88 2q6b h GLU 620 N 0.47 0.96 -0.31 1.90 4.81 -1.32 -1.09 114.58 119.99 2q6b h GLU 620 Ca 0.03 -0.21 -0.07 0.00 -0.13 0.00 0.00 59.36 58.98 2q6b h GLU 620 Cb 0.98 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 2q6b h GLU 620 CO 0.09 0.85 -0.08 0.00 -0.73 0.00 0.00 179.01 179.14 2q6b h ALA 621 N 1.06 0.42 -0.12 2.92 0.00 -1.40 -2.64 119.26 119.51 2q6b h ALA 621 Ca 0.20 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2q6b h ALA 621 Cb 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2q6b h ALA 621 CO -0.01 0.26 0.07 0.35 0.00 0.00 0.00 179.25 179.92 2q6b h PHE 622 N 0.36 0.17 0.00 0.00 3.57 -1.26 -3.11 116.94 116.67 2q6b h PHE 622 Ca 0.08 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2q6b h PHE 622 Cb 0.57 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2q6b h PHE 622 CO 0.05 0.19 0.00 -0.44 -2.23 0.00 0.00 178.31 175.88 2q6b h ASP 623 N 0.10 0.00 1.13 0.41 5.19 -1.21 -3.00 116.42 119.03 2q6b h ASP 623 Ca 0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 2q6b h ASP 623 Cb 0.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.59 2q6b h ASP 623 CO -0.01 0.00 0.00 -1.54 -3.12 0.00 0.00 179.24 174.57 2q6b n SER 624 N -2.65 0.78 0.19 6.45 3.41 -1.00 -3.47 113.62 117.33 2q6b n SER 624 Ca 0.02 0.63 0.09 0.00 -0.26 0.00 0.00 58.87 59.35 2q6b n SER 624 Cb 0.32 -0.82 0.11 0.00 -0.26 0.00 0.00 64.21 63.57 2q6b n SER 624 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2q6b h THR 625 N 0.00 0.29 -2.66 6.66 1.35 -1.65 -3.48 112.91 113.42 2q6b h THR 625 Ca 0.00 -1.42 -0.04 0.00 -0.55 0.00 0.00 66.41 64.40 2q6b h THR 625 Cb 0.56 2.12 -0.15 0.00 -1.73 0.00 0.00 68.15 68.95 2q6b h THR 625 CO 0.00 0.17 0.16 -0.55 -0.25 0.00 0.00 175.52 175.04 2q6b s SER 626 N -6.26 -0.56 0.26 5.36 0.15 -1.23 -4.99 113.70 106.45 2q6b s SER 626 Ca 0.06 0.25 0.04 0.00 0.70 0.00 0.00 55.95 56.99 2q6b s SER 626 Cb 0.06 0.55 0.35 0.00 -1.71 0.00 0.00 66.02 65.27 2q6b s SER 626 CO 0.70 -0.80 1.64 0.03 1.20 0.00 0.00 173.24 176.01 2q6b h ARG 627 N 2.49 0.31 -0.00 5.44 -0.00 -1.92 -3.08 114.38 117.62 2q6b h ARG 627 Ca -0.31 -0.16 0.00 0.00 -0.50 0.00 0.00 59.98 59.00 2q6b h ARG 627 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 29.97 31.21 2q6b h ARG 627 CO 0.39 0.71 -0.44 1.19 0.00 0.00 0.00 179.97 181.82 2q6b n PHE 628 N -3.99 0.00 -2.18 3.04 3.01 -1.26 -4.84 117.46 111.24 2q6b n PHE 628 Ca -0.02 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.02 2q6b n PHE 628 Cb 0.52 -0.26 -0.03 0.00 -0.01 0.00 0.00 39.48 39.71 2q6b n PHE 628 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2q6b s ALA 629 N -2.97 2.84 -0.31 4.37 0.00 -1.17 -4.35 121.76 120.18 2q6b s ALA 629 Ca 0.12 -0.11 -0.00 0.00 0.00 0.00 0.00 51.96 51.97 2q6b s ALA 629 Cb 0.18 -4.03 0.10 0.00 0.00 0.00 0.00 23.12 19.36 2q6b s ALA 629 CO 0.68 -2.73 0.08 1.03 0.00 0.00 0.00 175.76 174.82 2q6b s ARG 630 N 5.54 0.83 0.06 0.00 0.52 -1.26 -4.48 118.95 120.16 2q6b s ARG 630 Ca 0.68 -1.13 -0.31 0.00 -0.52 0.00 0.00 55.73 54.46 2q6b s ARG 630 Cb -0.17 -2.15 -0.06 0.00 0.52 0.00 0.00 34.95 33.09 2q6b s ARG 630 CO 0.31 -0.95 1.29 -1.17 0.02 0.00 0.00 175.30 174.80 2q6b s LEU 631 N 1.54 4.36 0.00 2.53 2.96 -1.26 -4.13 118.68 124.68 2q6b s LEU 631 Ca 0.09 2.12 -0.02 0.00 -0.22 0.00 0.00 54.13 56.10 2q6b s LEU 631 Cb -0.17 -3.58 0.15 0.00 0.50 0.00 0.00 46.19 43.09 2q6b s LEU 631 CO -0.22 -0.57 1.02 0.00 -1.32 0.00 0.00 176.35 175.25 2q6b n GLN 632 N 4.23 -0.22 -1.68 1.98 6.02 -0.45 -5.02 117.38 122.23 2q6b n GLN 632 Ca 0.11 -2.60 -0.45 0.00 -0.01 0.00 0.00 57.00 54.05 2q6b n GLN 632 Cb 0.45 -0.73 -0.03 0.00 1.02 0.00 0.00 30.24 30.95 2q6b n GLN 632 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2q6b n LYS 633 N -2.91 2.10 -2.62 -1.09 4.81 -1.26 -4.72 118.16 112.47 2q6b n LYS 633 Ca 0.16 0.75 -0.41 0.00 -0.87 0.00 0.00 58.31 57.94 2q6b n LYS 633 Cb 0.58 -2.43 -0.04 0.00 0.02 0.00 0.00 35.03 33.16 2q6b n LYS 633 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2q6b s LEU 634 N 0.15 4.48 -0.22 3.14 1.43 -1.26 -4.77 118.68 121.63 2q6b s LEU 634 Ca 0.69 1.92 -0.09 0.00 -1.03 0.00 0.00 54.13 55.63 2q6b s LEU 634 Cb -0.64 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.94 2q6b s LEU 634 CO 0.48 -0.17 0.11 -2.28 0.23 0.00 0.00 176.35 174.72 2q6b s HIS 635 N 0.04 3.28 0.16 0.29 5.65 -1.19 -4.99 115.29 118.53 2q6b s HIS 635 Ca 0.49 0.11 0.09 0.00 0.25 0.00 0.00 55.06 56.00 2q6b s HIS 635 Cb -0.26 -2.19 -0.04 0.00 -1.18 0.00 0.00 32.58 28.91 2q6b s HIS 635 CO 0.32 0.07 -0.20 0.95 -0.65 0.00 0.00 174.74 175.23 2q6b s THR 636 N 0.81 1.94 -0.16 0.89 -4.23 -1.26 -0.61 115.64 113.03 2q6b s THR 636 Ca 0.06 -1.90 -0.08 0.00 -1.18 0.00 0.00 61.69 58.59 2q6b s THR 636 Cb -0.13 -1.88 0.06 0.00 1.34 0.00 0.00 72.50 71.89 2q6b s THR 636 CO 0.02 -0.23 0.38 -0.44 -0.54 0.00 0.00 174.62 173.81 2q6b s SER 637 N -2.58 -0.36 0.09 3.99 0.01 -0.63 -5.01 113.70 109.21 2q6b s SER 637 Ca 0.16 0.84 -0.07 0.00 1.31 0.00 0.00 55.95 58.19 2q6b s SER 637 Cb -0.07 0.83 -0.05 0.00 0.21 0.00 0.00 66.02 66.93 2q6b s SER 637 CO 0.07 -0.20 0.36 -0.63 0.41 0.00 0.00 173.24 173.25 2q6b s ILE 638 N 1.70 5.17 -0.39 1.44 1.01 -1.26 -1.19 121.20 127.67 2q6b s ILE 638 Ca -0.07 0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.81 2q6b s ILE 638 Cb -0.10 -3.62 0.15 0.00 0.01 0.00 0.00 42.46 38.91 2q6b s ILE 638 CO -0.12 0.20 0.27 0.00 0.00 0.00 0.00 174.94 175.29 2q6b s ALA 639 N -1.49 1.22 0.00 9.38 0.00 -0.91 -4.99 121.76 124.97 2q6b s ALA 639 Ca 0.35 -2.18 0.00 0.00 0.00 0.00 0.00 51.96 50.13 2q6b s ALA 639 Cb -0.13 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.37 2q6b s ALA 639 CO 0.20 -2.05 0.00 0.41 0.00 0.00 0.00 175.76 174.33 2q6b n GLY 640 N 3.46 2.89 0.02 0.00 0.00 -1.26 -2.00 105.19 108.29 2q6b n GLY 640 Ca 0.20 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 46.14 2q6b n GLY 640 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2q6b n ARG 641 N 13.14 0.22 -2.73 1.61 1.85 -1.26 -4.32 116.66 125.16 2q6b n ARG 641 Ca 0.00 -0.04 -0.34 0.00 -1.00 0.00 0.00 57.85 56.48 2q6b n ARG 641 Cb 0.00 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 29.85 2q6b n ARG 641 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 2q6b s ASN 642 N -2.81 6.79 -0.10 2.89 -0.87 -0.85 -2.07 114.94 117.93 2q6b s ASN 642 Ca 0.20 1.77 -0.02 0.00 -1.57 0.00 0.00 52.86 53.24 2q6b s ASN 642 Cb 0.19 -2.55 0.04 0.00 -0.02 0.00 0.00 41.25 38.91 2q6b s ASN 642 CO 0.53 -0.47 0.04 -0.22 -2.57 0.00 0.00 177.10 174.41 2q6b s LEU 643 N -3.19 0.52 -0.26 0.60 2.96 -0.05 -2.13 118.68 117.13 2q6b s LEU 643 Ca 0.63 -0.24 -0.11 0.00 -0.22 0.00 0.00 54.13 54.19 2q6b s LEU 643 Cb -0.12 -0.35 -0.05 0.00 0.50 0.00 0.00 46.19 46.17 2q6b s LEU 643 CO 0.16 -0.25 0.17 -0.31 -1.32 0.00 0.00 176.35 174.80 2q6b s TYR 644 N 2.04 3.26 -0.21 5.38 1.51 -0.34 -1.48 117.35 127.52 2q6b s TYR 644 Ca 0.04 0.16 0.00 0.00 -1.01 0.00 0.00 57.07 56.26 2q6b s TYR 644 Cb -0.14 -2.32 0.02 0.00 -0.11 0.00 0.00 41.96 39.41 2q6b s TYR 644 CO -0.06 -0.05 -0.14 0.42 -1.11 0.00 0.00 175.55 174.60 2q6b s ILE 645 N 1.42 2.40 -0.55 2.71 1.01 -0.86 -1.61 121.20 125.72 2q6b s ILE 645 Ca 0.07 -0.96 -0.18 0.00 0.00 0.00 0.00 60.65 59.59 2q6b s ILE 645 Cb -0.15 -2.10 0.10 0.00 0.01 0.00 0.00 42.46 40.32 2q6b s ILE 645 CO 0.08 0.41 0.60 -0.60 0.00 0.00 0.00 174.94 175.42 2q6b s ARG 646 N 1.30 3.03 0.10 2.79 3.52 0.22 -2.94 118.95 126.98 2q6b s ARG 646 Ca 0.03 -1.36 -0.28 0.00 -0.13 0.00 0.00 55.73 53.99 2q6b s ARG 646 Cb -0.14 -4.23 -0.06 0.00 -1.56 0.00 0.00 34.95 28.95 2q6b s ARG 646 CO -0.09 -1.37 0.89 -0.06 -0.81 0.00 0.00 175.30 173.86 2q6b s PHE 647 N 2.25 3.80 -0.03 5.12 0.40 -0.34 -3.14 117.98 126.04 2q6b s PHE 647 Ca 0.09 1.69 0.00 0.00 -0.60 0.00 0.00 56.93 58.11 2q6b s PHE 647 Cb -0.25 -2.96 0.03 0.00 0.51 0.00 0.00 43.02 40.35 2q6b s PHE 647 CO 0.06 0.26 -0.00 -1.14 0.70 0.00 0.00 175.22 175.10 2q6b s GLN 648 N -0.15 0.32 0.03 0.44 0.74 -1.26 -1.69 119.66 118.09 2q6b s GLN 648 Ca 0.43 0.07 -0.17 0.00 0.05 0.00 0.00 55.36 55.74 2q6b s GLN 648 Cb -0.23 -0.50 0.03 0.00 1.10 0.00 0.00 33.01 33.42 2q6b s GLN 648 CO 0.27 -0.13 0.39 0.45 -0.55 0.00 0.00 175.29 175.72 2q6b s SER 649 N 1.03 -0.25 0.85 6.67 0.15 -0.77 -1.34 113.70 120.03 2q6b s SER 649 Ca -0.10 -0.00 -0.11 0.00 0.70 0.00 0.00 55.95 56.44 2q6b s SER 649 Cb -0.14 0.40 0.10 0.00 -1.71 0.00 0.00 66.02 64.68 2q6b s SER 649 CO -0.02 -0.63 1.10 -0.13 1.20 0.00 0.00 173.24 174.77 2q6b s ARG 650 N -2.30 1.60 -0.16 5.44 0.52 -1.26 -1.61 118.95 121.18 2q6b s ARG 650 Ca -0.06 1.11 0.20 0.00 -0.52 0.00 0.00 55.73 56.45 2q6b s ARG 650 Cb -0.01 -1.83 0.41 0.00 0.52 0.00 0.00 34.95 34.04 2q6b s ARG 650 CO -0.01 -2.09 1.18 -1.13 0.02 0.00 0.00 175.30 173.28 2q6b n SER 651 N -3.81 0.60 0.00 0.23 3.41 -1.26 -4.39 113.62 108.39 2q6b n SER 651 Ca 0.09 -2.04 0.00 0.00 -0.26 0.00 0.00 58.87 56.65 2q6b n SER 651 Cb 0.54 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 2q6b n SER 651 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q6b n GLY 652 N -0.32 3.41 0.46 5.00 0.00 -1.26 -2.11 105.19 110.36 2q6b n GLY 652 Ca -0.02 -0.13 0.12 0.00 0.00 0.00 0.00 46.02 45.99 2q6b n GLY 652 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q6b n ASP 653 N 3.96 1.72 -4.80 1.61 8.00 -1.26 -3.73 116.55 122.05 2q6b n ASP 653 Ca 0.00 -1.35 -0.34 0.00 0.71 0.00 0.00 54.79 53.82 2q6b n ASP 653 Cb 0.00 0.23 -0.02 0.00 -0.02 0.00 0.00 41.12 41.31 2q6b n ASP 653 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2q6b s ALA 654 N -2.37 2.83 0.31 2.24 0.00 -0.90 -0.65 121.76 123.22 2q6b s ALA 654 Ca 0.24 0.56 0.02 0.00 0.00 0.00 0.00 51.96 52.78 2q6b s ALA 654 Cb 0.19 -3.25 0.58 0.00 0.00 0.00 0.00 23.12 20.64 2q6b s ALA 654 CO 0.49 -0.46 1.90 1.98 0.00 0.00 0.00 175.76 179.67 2q6b h MET 655 N 1.24 0.94 0.00 0.00 4.05 -1.76 -3.43 114.93 115.97 2q6b h MET 655 Ca -0.49 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 58.88 2q6b h MET 655 Cb 1.22 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 31.81 2q6b h MET 655 CO 0.59 0.62 0.00 0.41 0.23 0.00 0.00 176.91 178.75 2q6b n GLY 656 N -1.40 0.63 0.09 1.39 0.00 -1.26 -4.67 105.19 99.97 2q6b n GLY 656 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 2q6b n GLY 656 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2q6b h MET 657 N 3.20 0.02 -0.22 1.61 4.05 -1.95 0.01 114.93 121.66 2q6b h MET 657 Ca 0.00 -0.00 -0.15 0.00 -0.28 0.00 0.00 59.70 59.27 2q6b h MET 657 Cb 0.00 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2q6b h MET 657 CO 0.00 0.01 -0.47 -0.91 0.23 0.00 0.00 176.91 175.78 2q6b h ASN 658 N 0.02 0.62 -0.46 1.39 2.35 -1.99 -1.88 115.58 115.64 2q6b h ASN 658 Ca 0.08 -0.30 -0.13 0.00 -0.55 0.00 0.00 56.30 55.40 2q6b h ASN 658 Cb 0.12 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 2q6b h ASN 658 CO -0.16 1.00 -0.21 -0.03 -1.65 0.00 0.00 177.43 176.37 2q6b h MET 659 N 0.46 0.96 -0.10 0.81 4.05 -1.91 -2.14 114.93 117.05 2q6b h MET 659 Ca 0.03 -0.41 -0.15 0.00 -0.28 0.00 0.00 59.70 58.88 2q6b h MET 659 Cb 0.99 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.75 2q6b h MET 659 CO 0.09 1.08 -0.60 0.82 0.23 0.00 0.00 176.91 178.53 2q6b h ILE 660 N 0.80 1.37 -0.09 1.77 1.08 -0.97 -2.39 117.51 119.07 2q6b h ILE 660 Ca 0.10 -1.95 -0.13 0.00 -0.39 0.00 0.00 64.86 62.49 2q6b h ILE 660 Cb 0.79 1.96 -0.01 0.00 -3.07 0.00 0.00 36.82 36.48 2q6b h ILE 660 CO 0.07 0.58 -0.52 0.28 -0.69 0.00 0.00 178.15 177.87 2q6b h SER 661 N 0.25 0.28 -0.11 1.72 0.02 -1.24 -0.21 113.55 114.27 2q6b h SER 661 Ca -0.01 -0.14 -0.18 0.00 -0.84 0.00 0.00 61.79 60.62 2q6b h SER 661 Cb 1.13 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 63.60 2q6b h SER 661 CO 0.10 0.75 -0.65 0.50 -1.14 0.00 0.00 176.83 176.39 2q6b h LYS 662 N 0.20 0.63 -0.12 3.45 3.64 -1.32 -2.27 116.57 120.78 2q6b h LYS 662 Ca 0.01 -0.53 -0.09 0.00 -1.27 0.00 0.00 60.65 58.76 2q6b h LYS 662 Cb 0.98 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 2q6b h LYS 662 CO 0.08 1.15 -0.34 0.78 -2.27 0.00 0.00 179.45 178.85 2q6b h GLY 663 N 0.27 0.26 1.36 5.01 0.00 -1.37 -2.74 103.07 105.86 2q6b h GLY 663 Ca -0.05 -0.22 -0.16 0.00 0.00 0.00 0.00 47.33 46.90 2q6b h GLY 663 CO 0.13 0.20 -0.49 -0.84 0.00 0.00 0.00 176.54 175.54 2q6b h THR 664 N 0.21 1.30 -0.29 4.70 2.02 -1.01 -1.89 112.91 117.95 2q6b h THR 664 Ca 0.03 -1.70 -0.14 0.00 0.77 0.00 0.00 66.41 65.37 2q6b h THR 664 Cb 0.70 1.63 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 2q6b h THR 664 CO 0.05 0.54 -0.38 -0.08 0.37 0.00 0.00 175.52 176.03 2q6b h GLU 665 N 0.54 0.68 -0.14 6.66 4.81 -1.28 -1.68 114.58 124.16 2q6b h GLU 665 Ca 0.02 -0.34 -0.15 0.00 -0.13 0.00 0.00 59.36 58.77 2q6b h GLU 665 Cb 1.05 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 2q6b h GLU 665 CO 0.10 0.94 -0.55 -0.22 -0.73 0.00 0.00 179.01 178.55 2q6b h LYS 666 N 0.56 0.43 -0.32 1.92 1.63 -1.46 -2.56 116.57 116.76 2q6b h LYS 666 Ca 0.05 -0.27 -0.11 0.00 -0.85 0.00 0.00 60.65 59.48 2q6b h LYS 666 Cb 0.90 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.55 2q6b h LYS 666 CO 0.08 0.87 -0.22 0.00 -3.45 0.00 0.00 179.45 176.73 2q6b h ALA 667 N 1.08 0.46 -0.00 5.00 0.00 -1.15 -2.43 119.26 122.22 2q6b h ALA 667 Ca 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 2q6b h ALA 667 Cb 1.07 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2q6b h ALA 667 CO 0.10 0.43 -0.53 -0.07 0.00 0.00 0.00 179.25 179.18 2q6b h LEU 668 N 0.49 0.00 -0.57 0.00 3.38 -1.33 -0.76 115.31 116.51 2q6b h LEU 668 Ca 0.06 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 2q6b h LEU 668 Cb 0.77 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 2q6b h LEU 668 CO 0.06 0.53 -0.08 -1.28 0.09 0.00 0.00 178.44 177.76 2q6b h SER 669 N 0.00 1.05 -0.06 -0.43 0.87 -1.40 -1.64 113.55 111.94 2q6b h SER 669 Ca -0.01 -0.34 -0.13 0.00 -1.23 0.00 0.00 61.79 60.08 2q6b h SER 669 Cb 0.94 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.60 2q6b h SER 669 CO 0.07 1.14 -0.40 0.50 -0.53 0.00 0.00 176.83 177.61 2q6b h LYS 670 N 0.94 0.58 -0.05 2.24 1.63 -1.12 -2.84 116.57 117.95 2q6b h LYS 670 Ca 0.15 -0.29 -0.08 0.00 -0.85 0.00 0.00 60.65 59.58 2q6b h LYS 670 Cb 0.65 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.28 2q6b h LYS 670 CO 0.05 0.88 -0.33 1.25 -3.45 0.00 0.00 179.45 177.84 2q6b h LEU 671 N 0.48 0.10 -1.19 5.20 5.85 -1.02 -2.65 115.31 122.08 2q6b h LEU 671 Ca 0.04 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2q6b h LEU 671 Cb 0.91 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 2q6b h LEU 671 CO 0.08 0.43 -0.16 -0.74 -0.34 0.00 0.00 178.44 177.71 2q6b h HIS 672 N 0.09 0.00 -0.41 1.25 2.76 -1.06 -1.42 115.15 116.35 2q6b h HIS 672 Ca 0.01 0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 58.05 2q6b h HIS 672 Cb 0.64 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.58 2q6b h HIS 672 CO 0.00 0.16 -0.25 0.93 -1.30 0.00 0.00 177.93 177.47 2q6b h GLU 673 N 0.00 0.86 0.00 5.26 5.08 -1.34 -2.53 114.58 121.91 2q6b h GLU 673 Ca -0.00 -0.37 -0.12 0.00 -1.00 0.00 0.00 59.36 57.87 2q6b h GLU 673 Cb 0.69 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2q6b h GLU 673 CO 0.02 1.02 -0.77 1.88 -1.00 0.00 0.00 179.01 180.16 2q6b h TYR 674 N 0.74 0.00 -2.59 4.33 -1.99 -1.56 -3.40 116.97 112.50 2q6b h TYR 674 Ca 0.09 0.00 -0.60 0.00 2.00 0.00 0.00 58.73 60.22 2q6b h TYR 674 Cb 0.80 0.00 -0.39 0.00 2.00 0.00 0.00 36.73 39.14 2q6b h TYR 674 CO 0.05 0.49 -0.86 -0.06 -0.00 0.00 0.00 178.16 177.78 2q6b s PHE 675 N -2.97 1.70 -0.72 4.88 0.40 -0.55 -4.99 117.98 115.73 2q6b s PHE 675 Ca 0.02 -2.52 0.19 0.00 -0.60 0.00 0.00 56.93 54.02 2q6b s PHE 675 Cb 0.08 -1.40 0.81 0.00 0.51 0.00 0.00 43.02 43.01 2q6b s PHE 675 CO 0.76 -0.76 1.59 -0.35 0.70 0.00 0.00 175.22 177.17 2q6b n PRO 676 N 2.77 0.10 0.00 0.24 -0.04 -0.96 -2.22 135.00 134.89 2q6b n PRO 676 Ca 0.25 0.35 0.14 0.00 -0.04 0.00 0.00 63.50 64.19 2q6b n PRO 676 Cb 0.43 -1.70 0.60 0.00 -0.04 0.00 0.00 33.50 32.80 2q6b n PRO 676 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2q6b n GLU 677 N -1.89 0.27 -2.40 0.54 -0.58 -1.26 -4.87 120.64 110.44 2q6b n GLU 677 Ca 0.03 -0.05 -0.42 0.00 -0.42 0.00 0.00 57.16 56.29 2q6b n GLU 677 Cb 0.20 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.54 2q6b n GLU 677 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 2q6b s MET 678 N -2.77 4.35 -0.17 3.49 1.75 -0.94 -4.55 119.30 120.46 2q6b s MET 678 Ca 0.21 1.75 -0.14 0.00 -1.25 0.00 0.00 55.69 56.26 2q6b s MET 678 Cb 0.19 -3.52 -0.05 0.00 2.84 0.00 0.00 34.83 34.30 2q6b s MET 678 CO 0.52 -0.44 0.31 -1.14 -0.65 0.00 0.00 175.02 173.62 2q6b s GLN 679 N 2.05 4.25 -0.72 4.11 0.74 0.12 -4.95 119.66 125.26 2q6b s GLN 679 Ca 0.58 0.11 -0.22 0.00 0.05 0.00 0.00 55.36 55.88 2q6b s GLN 679 Cb -0.27 -3.44 0.07 0.00 1.10 0.00 0.00 33.01 30.47 2q6b s GLN 679 CO 0.24 0.19 1.03 0.42 -0.55 0.00 0.00 175.29 176.62 2q6b s ILE 680 N 0.61 4.32 0.06 -2.34 1.01 -1.26 -0.95 121.20 122.64 2q6b s ILE 680 Ca 0.17 -0.49 -0.17 0.00 0.00 0.00 0.00 60.65 60.16 2q6b s ILE 680 Cb -0.13 -4.73 -0.17 0.00 0.01 0.00 0.00 42.46 37.44 2q6b s ILE 680 CO 0.05 -1.51 1.25 0.25 0.00 0.00 0.00 174.94 174.98 2q6b h LEU 681 N 11.40 0.68 -7.00 2.97 5.85 -1.80 -3.46 115.31 123.95 2q6b h LEU 681 Ca -0.21 -0.63 -0.01 0.00 0.84 0.00 0.00 57.88 57.87 2q6b h LEU 681 Cb 1.06 -0.20 -0.21 0.00 0.37 0.00 0.00 40.66 41.67 2q6b h LEU 681 CO 1.19 1.20 0.12 0.00 -0.34 0.00 0.00 178.44 180.61 2q6b s ALA 682 N -3.73 -1.84 0.41 1.25 0.00 -1.09 -5.03 121.76 111.74 2q6b s ALA 682 Ca -0.12 2.17 0.20 0.00 0.00 0.00 0.00 51.96 54.20 2q6b s ALA 682 Cb 0.06 -1.30 1.14 0.00 0.00 0.00 0.00 23.12 23.02 2q6b s ALA 682 CO 0.84 -0.35 1.99 -0.24 0.00 0.00 0.00 175.76 178.00 2q6b h VAL 683 N 4.36 0.91 -3.64 0.00 3.04 -1.90 -1.82 116.25 117.20 2q6b h VAL 683 Ca -0.29 -0.71 -0.67 0.00 -1.01 0.00 0.00 66.70 64.02 2q6b h VAL 683 Cb 1.19 1.41 -0.37 0.00 -2.01 0.00 0.00 31.29 31.51 2q6b h VAL 683 CO 0.10 0.19 -0.82 -0.55 -1.01 0.00 0.00 177.57 175.48 2q6b s SER 684 N -6.62 4.06 -0.36 3.17 0.15 -1.26 -2.63 113.70 110.21 2q6b s SER 684 Ca -0.03 -1.18 0.08 0.00 0.70 0.00 0.00 55.95 55.52 2q6b s SER 684 Cb 0.14 -1.51 0.70 0.00 -1.71 0.00 0.00 66.02 63.64 2q6b s SER 684 CO 0.65 -0.14 1.81 0.61 1.20 0.00 0.00 173.24 177.37 2q6b n GLY 685 N 4.49 4.06 2.58 9.45 0.00 -0.25 -4.77 105.19 120.75 2q6b n GLY 685 Ca -0.16 -1.05 -0.08 0.00 0.00 0.00 0.00 46.02 44.73 2q6b n GLY 685 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2q6b n ASN 686 N -0.58 -5.00 -0.96 1.61 4.13 -1.25 -4.84 115.26 108.36 2q6b n ASN 686 Ca 0.46 0.20 0.11 0.00 1.68 0.00 0.00 54.58 57.04 2q6b n ASN 686 Cb 1.45 -3.23 0.27 0.00 -1.54 0.00 0.00 39.78 36.73 2q6b n ASN 686 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2q6b n TYR 687 N -2.42 0.45 0.23 3.10 9.36 -1.22 -4.57 117.16 122.08 2q6b n TYR 687 Ca -0.08 -0.22 -0.14 0.00 3.32 0.00 0.00 57.90 60.78 2q6b n TYR 687 Cb 0.44 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.07 2q6b n TYR 687 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2q6b s THR 689 N -4.62 4.39 -0.23 0.00 2.01 -1.26 -4.77 115.64 111.16 2q6b s THR 689 Ca -0.14 -0.20 -0.07 0.00 0.31 0.00 0.00 61.69 61.59 2q6b s THR 689 Cb 0.02 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.62 2q6b s THR 689 CO 0.49 0.57 0.06 -0.62 -0.69 0.00 0.00 174.62 174.42 2q6b s ASP 690 N -0.53 5.13 -1.73 3.53 2.15 -1.26 -4.61 116.67 119.36 2q6b s ASP 690 Ca 0.09 -0.17 0.00 0.00 0.43 0.00 0.00 52.55 52.90 2q6b s ASP 690 Cb -0.12 -1.91 0.00 0.00 -0.30 0.00 0.00 42.92 40.59 2q6b s ASP 690 CO 0.02 0.01 0.00 0.29 -0.17 0.00 0.00 175.17 175.32 2q6b n LYS 691 N 4.65 -1.15 -4.15 4.34 5.02 -1.26 -4.99 118.16 120.61 2q6b n LYS 691 Ca -0.16 1.07 -0.16 0.00 -2.02 0.00 0.00 58.31 57.03 2q6b n LYS 691 Cb 0.52 -5.27 -0.12 0.00 -0.02 0.00 0.00 35.03 30.14 2q6b n LYS 691 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2q6b s LYS 692 N -3.45 0.78 0.09 1.97 3.01 -1.26 -4.95 119.74 115.93 2q6b s LYS 692 Ca 0.00 -0.98 -0.31 0.00 -1.01 0.00 0.00 55.97 53.67 2q6b s LYS 692 Cb 0.00 -0.65 -0.08 0.00 -1.01 0.00 0.00 37.83 36.08 2q6b s LYS 692 CO 0.00 0.13 1.54 -1.25 0.51 0.00 0.00 175.35 176.28 2q6b s PRO 693 N -2.01 4.24 -0.12 -1.68 0.04 -1.26 -4.72 135.00 129.49 2q6b s PRO 693 Ca -0.01 2.22 -0.07 0.00 0.04 0.00 0.00 61.00 63.18 2q6b s PRO 693 Cb -0.08 -3.41 0.05 0.00 0.04 0.00 0.00 34.50 31.10 2q6b s PRO 693 CO 0.01 -0.61 0.30 0.00 0.04 0.00 0.00 177.00 176.74 2q6b s ALA 694 N 1.91 -0.72 0.46 8.56 0.00 -1.26 -5.03 121.76 125.67 2q6b s ALA 694 Ca 0.69 1.10 0.18 0.00 0.00 0.00 0.00 51.96 53.94 2q6b s ALA 694 Cb -0.39 -0.68 1.20 0.00 0.00 0.00 0.00 23.12 23.25 2q6b s ALA 694 CO 0.31 -0.20 2.05 0.00 0.00 0.00 0.00 175.76 177.91 2q6b h ALA 695 N 6.87 1.64 -0.36 0.00 0.00 -1.94 -2.74 119.26 122.73 2q6b h ALA 695 Ca -0.37 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2q6b h ALA 695 Cb 1.17 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2q6b h ALA 695 CO 0.34 0.17 0.00 0.97 0.00 0.00 0.00 179.25 180.73 2q6b h ILE 696 N 0.00 1.21 -0.51 0.00 2.10 -1.97 -1.14 117.51 117.20 2q6b h ILE 696 Ca -0.00 -0.82 -0.12 0.00 1.08 0.00 0.00 64.86 65.00 2q6b h ILE 696 Cb 0.26 0.93 -0.02 0.00 -1.09 0.00 0.00 36.82 36.90 2q6b h ILE 696 CO 0.02 0.28 -0.13 0.78 -1.08 0.00 0.00 178.15 178.02 2q6b h ASN 697 N 0.54 1.00 -0.44 2.19 2.35 -1.76 -0.67 115.58 118.78 2q6b h ASN 697 Ca 0.12 -0.36 -0.04 0.00 -0.55 0.00 0.00 56.30 55.46 2q6b h ASN 697 Cb 0.35 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 2q6b h ASN 697 CO 0.01 1.13 0.14 -0.25 -1.65 0.00 0.00 177.43 176.81 2q6b h TRP 698 N 0.85 0.77 0.05 1.19 2.91 -1.39 -1.01 115.95 119.32 2q6b h TRP 698 Ca 0.13 -0.06 -0.36 0.00 1.13 0.00 0.00 58.89 59.72 2q6b h TRP 698 Cb 0.70 -0.23 -0.04 0.00 -0.51 0.00 0.00 29.16 29.08 2q6b h TRP 698 CO 0.05 0.64 -2.08 -0.89 -1.03 0.00 0.00 178.44 175.14 2q6b n ILE 699 N -4.30 1.61 0.54 2.65 5.41 -0.48 -4.44 119.36 120.36 2q6b n ILE 699 Ca 0.04 -0.46 0.11 0.00 1.00 0.00 0.00 62.75 63.43 2q6b n ILE 699 Cb 0.20 -1.73 0.01 0.00 -0.71 0.00 0.00 39.64 37.41 2q6b n ILE 699 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2q6b n GLU 700 N -3.74 0.30 0.00 0.38 -0.58 -0.26 -5.09 120.64 111.65 2q6b n GLU 700 Ca -0.40 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.33 2q6b n GLU 700 Cb 0.93 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 30.21 2q6b n GLU 700 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2q6b n GLY 701 N 1.36 -2.34 3.57 0.62 0.00 -0.38 -5.02 105.19 103.00 2q6b n GLY 701 Ca 0.02 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.48 2q6b n GLY 701 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2q6b s ARG 702 N -2.79 0.67 7.01 1.61 3.52 -1.13 -4.69 118.95 123.14 2q6b s ARG 702 Ca 0.00 1.11 0.00 0.00 -0.13 0.00 0.00 55.73 56.71 2q6b s ARG 702 Cb 0.00 0.15 0.00 0.00 -1.56 0.00 0.00 34.95 33.54 2q6b s ARG 702 CO 0.00 -0.14 0.00 0.41 -0.81 0.00 0.00 175.30 174.76 2q6b n GLY 703 N 4.06 2.25 3.67 8.12 0.00 -0.65 -3.25 105.19 119.39 2q6b n GLY 703 Ca -0.20 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 2q6b n GLY 703 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q6b s LYS 704 N 0.00 4.19 -0.19 1.61 -0.14 -0.29 -1.64 119.74 123.28 2q6b s LYS 704 Ca 0.00 0.34 -0.13 0.00 -1.36 0.00 0.00 55.97 54.82 2q6b s LYS 704 Cb 0.00 -3.55 -0.05 0.00 -1.68 0.00 0.00 37.83 32.56 2q6b s LYS 704 CO 0.00 -0.09 0.26 -1.12 -0.76 0.00 0.00 175.35 173.64 2q6b s SER 705 N 1.08 6.33 0.03 2.83 0.01 -0.44 -1.07 113.70 122.47 2q6b s SER 705 Ca 0.22 0.38 0.01 0.00 1.31 0.00 0.00 55.95 57.87 2q6b s SER 705 Cb -0.15 -2.16 -0.02 0.00 0.21 0.00 0.00 66.02 63.90 2q6b s SER 705 CO 0.09 0.06 -0.06 -0.69 0.41 0.00 0.00 173.24 173.06 2q6b s VAL 706 N 0.78 0.36 0.03 3.43 1.01 -0.14 -0.04 120.40 125.84 2q6b s VAL 706 Ca 0.14 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.34 2q6b s VAL 706 Cb -0.13 -0.43 -0.02 0.00 0.00 0.00 0.00 36.38 35.80 2q6b s VAL 706 CO 0.04 -0.31 -0.14 0.54 0.00 0.00 0.00 175.10 175.23 2q6b s VAL 707 N -1.11 1.08 0.02 2.92 0.11 -0.65 -0.95 120.40 121.83 2q6b s VAL 707 Ca -0.09 -0.92 -0.00 0.00 -2.93 0.00 0.00 61.98 58.04 2q6b s VAL 707 Cb -0.08 -0.97 -0.02 0.00 -1.53 0.00 0.00 36.38 33.78 2q6b s VAL 707 CO -0.00 0.04 -0.02 0.00 -3.33 0.00 0.00 175.10 171.79 2q6b s GLU 709 N -1.82 1.22 -0.03 0.00 -1.05 -0.28 -1.33 118.70 115.40 2q6b s GLU 709 Ca -0.13 -0.88 -0.29 0.00 -0.15 0.00 0.00 54.97 53.52 2q6b s GLU 709 Cb -0.07 0.47 0.10 0.00 -0.44 0.00 0.00 34.13 34.19 2q6b s GLU 709 CO -0.02 -0.49 0.88 0.00 0.95 0.00 0.00 175.26 176.57 2q6b s ALA 710 N -3.87 -1.83 -0.17 -0.84 0.00 -0.70 -1.38 121.76 112.96 2q6b s ALA 710 Ca 0.09 1.14 -0.00 0.00 0.00 0.00 0.00 51.96 53.19 2q6b s ALA 710 Cb 0.01 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.28 2q6b s ALA 710 CO -0.05 -0.58 -0.15 0.08 0.00 0.00 0.00 175.76 175.06 2q6b s VAL 711 N -2.54 2.58 -0.33 0.00 1.01 -1.26 -1.31 120.40 118.56 2q6b s VAL 711 Ca 0.02 -0.78 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 2q6b s VAL 711 Cb -0.01 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 2q6b s VAL 711 CO -0.05 0.51 0.21 -0.63 0.00 0.00 0.00 175.10 175.14 2q6b s ILE 712 N 1.02 5.09 0.60 2.22 -1.09 -0.09 -4.65 121.20 124.30 2q6b s ILE 712 Ca -0.01 -0.26 -0.18 0.00 -2.23 0.00 0.00 60.65 57.96 2q6b s ILE 712 Cb -0.15 -3.60 -0.05 0.00 -1.58 0.00 0.00 42.46 37.08 2q6b s ILE 712 CO -0.04 0.02 0.92 -2.65 -1.23 0.00 0.00 174.94 171.97 2q6b n PRO 713 N 5.07 0.86 -0.34 2.79 -0.02 -1.26 -1.13 135.00 140.97 2q6b n PRO 713 Ca -0.13 0.34 0.07 0.00 -2.02 0.00 0.00 63.50 61.75 2q6b n PRO 713 Cb 0.50 -2.12 0.25 0.00 -0.02 0.00 0.00 33.50 32.11 2q6b n PRO 713 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2q6b h ALA 714 N 0.48 1.55 -0.74 3.55 0.00 -1.93 -1.45 119.26 120.72 2q6b h ALA 714 Ca -0.48 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2q6b h ALA 714 Cb 1.37 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2q6b h ALA 714 CO 0.51 0.24 0.45 -0.22 0.00 0.00 0.00 179.25 180.22 2q6b h LYS 715 N 0.98 1.00 -0.22 0.00 3.64 -1.90 -2.27 116.57 117.81 2q6b h LYS 715 Ca 0.46 -0.09 -0.10 0.00 -1.27 0.00 0.00 60.65 59.65 2q6b h LYS 715 Cb 0.42 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 2q6b h LYS 715 CO -0.22 0.70 -0.31 0.28 -2.27 0.00 0.00 179.45 177.62 2q6b h VAL 716 N 1.01 1.28 -0.50 2.00 2.07 -1.64 -1.29 116.25 119.18 2q6b h VAL 716 Ca 0.27 -1.37 -0.09 0.00 0.82 0.00 0.00 66.70 66.32 2q6b h VAL 716 Cb -0.05 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2q6b h VAL 716 CO -0.05 0.43 -0.05 0.58 0.02 0.00 0.00 177.57 178.50 2q6b h VAL 717 N 0.38 1.26 -0.12 2.57 2.07 -1.07 -1.25 116.25 120.09 2q6b h VAL 717 Ca 0.05 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.36 2q6b h VAL 717 Cb 0.74 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2q6b h VAL 717 CO 0.06 0.39 -0.26 0.03 0.02 0.00 0.00 177.57 177.82 2q6b h ARG 718 N 0.80 0.38 0.12 1.57 3.08 -1.18 -1.15 114.38 118.00 2q6b h ARG 718 Ca 0.14 -0.25 -0.36 0.00 0.07 0.00 0.00 59.98 59.58 2q6b h ARG 718 Cb 0.54 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 2q6b h ARG 718 CO 0.03 0.86 -1.98 0.39 -1.07 0.00 0.00 179.97 178.20 2q6b n GLU 719 N -4.46 0.75 -0.09 0.04 1.02 -0.51 -2.36 120.64 115.04 2q6b n GLU 719 Ca -0.07 0.26 -0.16 0.00 -0.02 0.00 0.00 57.16 57.18 2q6b n GLU 719 Cb 0.45 -1.72 -0.09 0.00 -0.02 0.00 0.00 31.44 30.06 2q6b n GLU 719 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2q6b h VAL 720 N 0.07 0.89 -0.00 2.62 2.07 -1.43 -3.40 116.25 117.06 2q6b h VAL 720 Ca -0.41 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.17 2q6b h VAL 720 Cb 2.03 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 33.75 2q6b h VAL 720 CO 0.09 0.30 -0.37 0.18 0.02 0.00 0.00 177.57 177.79 2q6b n LEU 721 N -4.52 0.64 -3.26 2.57 4.77 -1.12 -4.97 117.00 111.11 2q6b n LEU 721 Ca -0.21 -0.05 -0.24 0.00 -0.03 0.00 0.00 56.01 55.48 2q6b n LEU 721 Cb 0.52 -0.22 0.04 0.00 -2.33 0.00 0.00 43.42 41.43 2q6b n LEU 721 CO 0.19 0.14 0.06 0.29 -1.33 0.00 0.00 177.39 176.74 2q6b n LYS 722 N -1.20 -5.49 -0.84 3.23 4.76 -0.48 -4.68 118.16 113.46 2q6b n LYS 722 Ca 0.08 0.82 0.00 0.00 -2.87 0.00 0.00 58.31 56.34 2q6b n LYS 722 Cb 0.34 -5.72 0.00 0.00 -1.84 0.00 0.00 35.03 27.81 2q6b n LYS 722 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 2q6b n THR 723 N -4.58 0.00 -4.43 -0.18 5.66 -0.91 -4.81 114.28 105.03 2q6b n THR 723 Ca -0.06 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.72 2q6b n THR 723 Cb 0.59 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.27 2q6b n THR 723 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2q6b s THR 724 N -2.12 2.07 0.29 1.09 -4.23 -1.26 -3.29 115.64 108.19 2q6b s THR 724 Ca 0.00 -2.28 -0.02 0.00 -1.18 0.00 0.00 61.69 58.22 2q6b s THR 724 Cb 0.00 -2.26 0.21 0.00 1.34 0.00 0.00 72.50 71.79 2q6b s THR 724 CO 0.00 -0.44 1.90 0.74 -0.54 0.00 0.00 174.62 176.28 2q6b h THR 725 N 2.35 1.21 -0.51 3.99 2.02 -1.91 -2.33 112.91 117.74 2q6b h THR 725 Ca -0.39 -0.58 -0.11 0.00 0.77 0.00 0.00 66.41 66.09 2q6b h THR 725 Cb 1.24 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 2q6b h THR 725 CO 0.63 0.25 -0.12 -0.08 0.37 0.00 0.00 175.52 176.57 2q6b h GLU 726 N 0.96 0.96 -0.40 6.66 4.81 -1.94 -2.34 114.58 123.30 2q6b h GLU 726 Ca 0.24 -0.35 -0.12 0.00 -0.13 0.00 0.00 59.36 59.00 2q6b h GLU 726 Cb 0.07 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2q6b h GLU 726 CO -0.03 1.01 -0.24 0.00 -0.73 0.00 0.00 179.01 179.02 2q6b h ALA 727 N 1.00 0.83 -0.20 2.92 0.00 -1.92 -2.37 119.26 119.52 2q6b h ALA 727 Ca 0.13 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2q6b h ALA 727 Cb 0.66 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2q6b h ALA 727 CO 0.05 0.64 0.07 0.52 0.00 0.00 0.00 179.25 180.53 2q6b h MET 728 N 0.70 0.30 -0.50 0.00 2.86 -1.28 -2.39 114.93 114.62 2q6b h MET 728 Ca 0.09 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 2q6b h MET 728 Cb 0.77 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.36 2q6b h MET 728 CO 0.06 0.38 0.07 0.82 1.06 0.00 0.00 176.91 179.30 2q6b h ILE 729 N 0.15 1.25 -0.76 -1.22 2.04 -1.39 -0.78 117.51 116.80 2q6b h ILE 729 Ca 0.06 -0.95 0.06 0.00 1.00 0.00 0.00 64.86 65.03 2q6b h ILE 729 Cb 0.20 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.13 2q6b h ILE 729 CO -0.00 0.34 0.46 -0.08 0.00 0.00 0.00 178.15 178.86 2q6b h GLU 730 N 0.70 0.82 -0.11 2.37 4.81 -1.39 -0.74 114.58 121.05 2q6b h GLU 730 Ca 0.15 -0.05 -0.22 0.00 -0.13 0.00 0.00 59.36 59.11 2q6b h GLU 730 Cb 0.41 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 29.61 2q6b h GLU 730 CO 0.01 0.55 -0.81 0.28 -0.73 0.00 0.00 179.01 178.31 2q6b h VAL 731 N 0.85 1.31 -0.58 0.32 2.07 -1.23 -2.67 116.25 116.33 2q6b h VAL 731 Ca 0.33 -2.08 -0.07 0.00 0.82 0.00 0.00 66.70 65.70 2q6b h VAL 731 Cb 0.15 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 2q6b h VAL 731 CO -0.17 0.65 0.09 -1.13 0.02 0.00 0.00 177.57 177.03 2q6b h ASN 732 N 0.44 0.92 -0.28 0.57 -1.24 -0.66 0.10 115.58 115.44 2q6b h ASN 732 Ca -0.06 -0.26 -0.03 0.00 0.71 0.00 0.00 56.30 56.66 2q6b h ASN 732 Cb 1.43 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 40.22 2q6b h ASN 732 CO 0.16 0.95 0.06 0.40 -1.29 0.00 0.00 177.43 177.71 2q6b h ILE 733 N 0.86 1.22 0.00 2.57 2.04 -1.21 -2.00 117.51 120.98 2q6b h ILE 733 Ca 0.17 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.31 2q6b h ILE 733 Cb 0.43 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 2q6b h ILE 733 CO 0.01 0.24 -0.66 0.78 0.00 0.00 0.00 178.15 178.52 2q6b h ASN 734 N 0.28 0.00 0.00 1.72 2.35 -1.25 -0.39 115.58 118.29 2q6b h ASN 734 Ca 0.09 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2q6b h ASN 734 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2q6b h ASN 734 CO 0.00 0.10 -0.51 1.17 -1.65 0.00 0.00 177.43 176.55 2q6b n LYS 735 N -2.16 0.27 0.23 0.81 4.81 0.34 -2.27 118.16 120.20 2q6b n LYS 735 Ca 0.03 0.11 0.13 0.00 -0.87 0.00 0.00 58.31 57.70 2q6b n LYS 735 Cb 0.45 -0.93 0.42 0.00 0.02 0.00 0.00 35.03 34.98 2q6b n LYS 735 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 2q6b h ASN 736 N -0.51 0.00 0.00 3.14 2.35 -1.48 -1.97 115.58 117.11 2q6b h ASN 736 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2q6b h ASN 736 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2q6b h ASN 736 CO 0.00 0.10 -0.42 0.18 -1.65 0.00 0.00 177.43 175.64 2q6b n LEU 737 N -3.18 1.01 -0.08 1.61 4.77 -1.03 -4.09 117.00 116.01 2q6b n LEU 737 Ca 0.02 0.16 -0.14 0.00 -0.03 0.00 0.00 56.01 56.02 2q6b n LEU 737 Cb 0.44 -0.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.96 2q6b n LEU 737 CO 0.32 -0.45 0.51 0.58 -1.33 0.00 0.00 177.39 177.02 2q6b h VAL 738 N -0.42 1.31 -0.30 4.08 2.07 -1.25 -1.92 116.25 119.82 2q6b h VAL 738 Ca 0.00 -1.56 -0.02 0.00 0.82 0.00 0.00 66.70 65.93 2q6b h VAL 738 Cb 0.42 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 2q6b h VAL 738 CO 0.00 0.49 0.10 1.23 0.02 0.00 0.00 177.57 179.41 2q6b h GLY 739 N 0.40 0.50 1.83 2.17 0.00 -1.07 -0.08 103.07 106.83 2q6b h GLY 739 Ca 0.02 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 47.01 2q6b h GLY 739 CO 0.08 0.28 -0.14 1.76 0.00 0.00 0.00 176.54 178.53 2q6b h SER 740 N 0.33 0.20 -0.33 0.19 0.02 -1.40 -1.92 113.55 110.63 2q6b h SER 740 Ca 0.10 -0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 60.87 2q6b h SER 740 Cb 0.24 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2q6b h SER 740 CO -0.00 0.36 -0.32 0.00 -1.14 0.00 0.00 176.83 175.73 2q6b h ALA 741 N 1.67 0.49 0.00 3.77 0.00 -0.85 -1.58 119.26 122.76 2q6b h ALA 741 Ca 0.04 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 2q6b h ALA 741 Cb 0.37 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2q6b h ALA 741 CO 0.02 0.53 -0.30 0.52 0.00 0.00 0.00 179.25 180.02 2q6b h MET 742 N 0.58 0.00 -0.00 0.00 2.86 -0.73 -2.54 114.93 115.11 2q6b h MET 742 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2q6b h MET 742 Cb 0.89 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.55 2q6b h MET 742 CO 0.08 0.30 -0.06 0.00 1.06 0.00 0.00 176.91 178.29 2q6b n ALA 743 N -2.43 2.52 -2.54 6.32 0.00 -0.75 -4.94 120.51 118.70 2q6b n ALA 743 Ca -0.02 -0.14 -0.05 0.00 0.00 0.00 0.00 53.44 53.23 2q6b n ALA 743 Cb 0.36 -1.43 0.02 0.00 0.00 0.00 0.00 19.45 18.41 2q6b n ALA 743 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q6b n GLY 744 N 1.46 0.38 3.83 0.00 0.00 -0.96 -5.03 105.19 104.88 2q6b n GLY 744 Ca 0.08 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 2q6b n GLY 744 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2q6b s SER 745 N -3.23 6.93 -0.29 1.61 0.15 -0.62 -5.05 113.70 113.21 2q6b s SER 745 Ca 0.06 1.15 0.01 0.00 0.70 0.00 0.00 55.95 57.87 2q6b s SER 745 Cb -0.03 -2.32 0.06 0.00 -1.71 0.00 0.00 66.02 62.02 2q6b s SER 745 CO 0.18 0.21 -0.05 -0.63 1.20 0.00 0.00 173.24 174.16 2q6b s ILE 746 N -1.25 2.56 0.00 6.45 -1.09 -1.26 -4.71 121.20 121.89 2q6b s ILE 746 Ca 0.32 -1.57 0.00 0.00 -2.23 0.00 0.00 60.65 57.17 2q6b s ILE 746 Cb -0.17 -2.51 0.00 0.00 -1.58 0.00 0.00 42.46 38.19 2q6b s ILE 746 CO 0.18 -0.11 0.00 0.61 -1.23 0.00 0.00 174.94 174.40 2q6b n GLY 747 N 4.51 0.81 2.71 6.18 0.00 -1.26 -4.95 105.19 113.19 2q6b n GLY 747 Ca -0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 2q6b n GLY 747 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q6b n GLY 748 N -2.04 5.71 2.64 -0.02 0.00 -1.26 -1.57 105.19 108.65 2q6b n GLY 748 Ca 0.00 -2.53 -0.37 0.00 0.00 0.00 0.00 46.02 43.12 2q6b n GLY 748 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2q6b n TYR 749 N -0.58 2.46 -3.99 1.61 4.02 -0.86 -4.82 117.16 115.01 2q6b n TYR 749 Ca 0.51 -2.37 -0.09 0.00 -0.01 0.00 0.00 57.90 55.94 2q6b n TYR 749 Cb 0.41 -1.38 -0.05 0.00 -0.02 0.00 0.00 39.34 38.30 2q6b n TYR 749 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2q6b s ASN 750 N -0.43 -0.11 -0.09 7.72 2.20 -1.24 -1.40 114.94 121.60 2q6b s ASN 750 Ca 0.51 -0.90 -0.01 0.00 -0.94 0.00 0.00 52.86 51.52 2q6b s ASN 750 Cb 0.31 0.60 -0.00 0.00 -2.00 0.00 0.00 41.25 40.16 2q6b s ASN 750 CO -0.23 -1.16 -0.02 0.00 -2.94 0.00 0.00 177.10 172.75 2q6b h ALA 751 N 2.23 0.00 -0.23 3.54 0.00 -1.94 -3.46 119.26 119.40 2q6b h ALA 751 Ca -0.25 -0.08 -0.23 0.00 0.00 0.00 0.00 54.91 54.35 2q6b h ALA 751 Cb 1.25 0.07 -0.23 0.00 0.00 0.00 0.00 17.79 18.88 2q6b h ALA 751 CO 0.34 0.07 -0.57 -2.39 0.00 0.00 0.00 179.25 176.70 2q6b n HIS 752 N -4.27 -1.24 -0.33 0.00 1.44 -1.26 -4.95 115.22 104.61 2q6b n HIS 752 Ca -0.01 -2.04 0.17 0.00 -2.01 0.00 0.00 57.72 53.83 2q6b n HIS 752 Cb 0.04 1.01 0.37 0.00 0.12 0.00 0.00 29.99 31.53 2q6b n HIS 752 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2q6b h ALA 753 N 1.96 1.70 -0.42 1.59 0.00 -1.88 -1.47 119.26 120.73 2q6b h ALA 753 Ca -0.28 0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2q6b h ALA 753 Cb 1.28 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 2q6b h ALA 753 CO 0.03 -0.33 0.28 0.00 0.00 0.00 0.00 179.25 179.23 2q6b h ALA 754 N 1.74 1.86 -0.27 0.00 0.00 -1.93 -1.03 119.26 119.63 2q6b h ALA 754 Ca 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.52 2q6b h ALA 754 Cb 1.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2q6b h ALA 754 CO -0.51 0.08 0.18 -0.91 0.00 0.00 0.00 179.25 178.09 2q6b h ASN 755 N 0.43 0.32 -0.05 0.00 2.35 -1.67 -1.82 115.58 115.13 2q6b h ASN 755 Ca 0.18 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.78 2q6b h ASN 755 Cb 0.16 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 38.46 2q6b h ASN 755 CO -0.04 0.23 -0.50 0.40 -1.65 0.00 0.00 177.43 175.87 2q6b h ILE 756 N 0.37 1.41 -0.32 2.81 5.03 -1.48 -2.43 117.51 122.90 2q6b h ILE 756 Ca 0.10 -1.91 0.05 0.00 -0.12 0.00 0.00 64.86 62.97 2q6b h ILE 756 Cb -0.04 2.40 -0.04 0.00 -3.03 0.00 0.00 36.82 36.11 2q6b h ILE 756 CO -0.02 0.56 0.06 0.58 -0.68 0.00 0.00 178.15 178.65 2q6b h VAL 757 N -0.05 0.85 -0.45 1.67 2.07 -1.26 -1.66 116.25 117.41 2q6b h VAL 757 Ca -0.05 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 2q6b h VAL 757 Cb 1.17 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 2q6b h VAL 757 CO 0.10 0.03 0.18 0.74 0.02 0.00 0.00 177.57 178.64 2q6b h THR 758 N 0.18 1.20 -0.34 2.57 2.02 -1.36 -0.28 112.91 116.90 2q6b h THR 758 Ca 0.15 -0.63 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 2q6b h THR 758 Cb 0.16 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 2q6b h THR 758 CO -0.20 0.23 0.05 0.00 0.37 0.00 0.00 175.52 175.98 2q6b h ALA 759 N 1.03 0.46 -0.68 6.16 0.00 -1.24 -1.58 119.26 123.40 2q6b h ALA 759 Ca 0.15 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2q6b h ALA 759 Cb 0.19 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2q6b h ALA 759 CO -0.01 0.16 0.12 0.82 0.00 0.00 0.00 179.25 180.33 2q6b h ILE 760 N 0.40 1.26 -0.48 0.00 2.04 -1.22 -0.72 117.51 118.80 2q6b h ILE 760 Ca 0.10 -1.04 -0.05 0.00 1.00 0.00 0.00 64.86 64.88 2q6b h ILE 760 Cb 0.36 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 2q6b h ILE 760 CO 0.01 0.39 0.11 1.88 0.00 0.00 0.00 178.15 180.54 2q6b h TYR 761 N 1.05 0.82 -0.46 1.37 -1.99 -0.78 -1.02 116.97 115.96 2q6b h TYR 761 Ca 0.21 -0.10 -0.13 0.00 2.00 0.00 0.00 58.73 60.70 2q6b h TYR 761 Cb 0.44 -0.23 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 2q6b h TYR 761 CO 0.03 0.75 -0.23 0.82 -0.00 0.00 0.00 178.16 179.53 2q6b h ILE 762 N 0.66 1.27 -0.21 -2.88 2.04 -1.28 -0.42 117.51 116.68 2q6b h ILE 762 Ca 0.15 -1.39 -0.09 0.00 1.00 0.00 0.00 64.86 64.54 2q6b h ILE 762 Cb 0.35 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2q6b h ILE 762 CO 0.00 0.48 -0.24 0.00 0.00 0.00 0.00 178.15 178.39 2q6b h ALA 763 N 0.91 1.20 -0.53 1.87 0.00 -1.25 -3.26 119.26 118.20 2q6b h ALA 763 Ca 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2q6b h ALA 763 Cb 0.80 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2q6b h ALA 763 CO 0.07 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.84 2q6b n GLY 765 N 0.81 0.67 3.89 0.00 0.00 -0.93 -4.50 105.19 105.12 2q6b n GLY 765 Ca 0.21 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 2q6b n GLY 765 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2q6b s GLN 766 N -3.20 2.47 -0.62 1.61 -1.52 -0.21 -2.68 119.66 115.50 2q6b s GLN 766 Ca 0.00 0.29 -0.28 0.00 -1.95 0.00 0.00 55.36 53.42 2q6b s GLN 766 Cb 0.00 -2.00 0.02 0.00 -0.22 0.00 0.00 33.01 30.81 2q6b s GLN 766 CO 0.00 -1.27 1.38 0.34 -0.25 0.00 0.00 175.29 175.49 2q6b s ASP 767 N -4.45 6.11 0.56 5.90 -1.08 -1.26 -4.69 116.67 117.75 2q6b s ASP 767 Ca 0.60 0.03 0.34 0.00 -0.52 0.00 0.00 52.55 53.00 2q6b s ASP 767 Cb -0.11 -2.55 1.46 0.00 -1.46 0.00 0.00 42.92 40.26 2q6b s ASP 767 CO 0.50 -1.78 2.02 0.00 0.52 0.00 0.00 175.17 176.44 2q6b h ALA 768 N 10.87 1.02 0.00 3.66 0.00 -1.94 -1.86 119.26 131.01 2q6b h ALA 768 Ca -0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 2q6b h ALA 768 Cb 1.08 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2q6b h ALA 768 CO 1.21 0.03 -0.09 0.00 0.00 0.00 0.00 179.25 180.40 2q6b h ALA 769 N 1.97 1.43 0.00 0.00 0.00 -2.01 -2.33 119.26 118.32 2q6b h ALA 769 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2q6b h ALA 769 Cb 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2q6b h ALA 769 CO 0.00 0.12 0.00 1.04 0.00 0.00 0.00 179.25 180.41 2q6b n GLN 770 N -3.82 0.81 -0.06 0.00 6.02 -0.70 -2.99 117.38 116.64 2q6b n GLN 770 Ca -0.02 0.00 0.19 0.00 -0.01 0.00 0.00 57.00 57.16 2q6b n GLN 770 Cb 0.19 -1.47 0.64 0.00 1.02 0.00 0.00 30.24 30.62 2q6b n GLN 770 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 177.06 175.08 2q6b h ASN 771 N 0.00 0.11 -0.46 1.08 -1.24 -1.58 -0.96 115.58 112.54 2q6b h ASN 771 Ca 0.00 0.01 0.09 0.00 0.71 0.00 0.00 56.30 57.11 2q6b h ASN 771 Cb 0.00 -0.02 -0.10 0.00 0.73 0.00 0.00 38.32 38.94 2q6b h ASN 771 CO 0.00 0.06 -0.28 0.58 -1.29 0.00 0.00 177.43 176.50 2q6b h VAL 772 N 0.12 0.28 0.00 2.57 2.07 -1.79 -1.84 116.25 117.66 2q6b h VAL 772 Ca 0.30 0.00 -0.31 0.00 0.82 0.00 0.00 66.70 67.51 2q6b h VAL 772 Cb 1.02 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 2q6b h VAL 772 CO -0.04 0.00 -2.19 0.61 0.02 0.00 0.00 177.57 175.97 2q6b n GLY 773 N -1.42 -1.01 0.28 2.17 0.00 -1.17 -4.31 105.19 99.74 2q6b n GLY 773 Ca 0.03 -0.29 0.16 0.00 0.00 0.00 0.00 46.02 45.92 2q6b n GLY 773 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2q6b h SER 774 N 0.00 0.00 0.82 1.61 0.02 -1.10 -2.63 113.55 112.28 2q6b h SER 774 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2q6b h SER 774 Cb 2.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.60 2q6b h SER 774 CO 0.04 0.06 -0.14 -1.20 -1.14 0.00 0.00 176.83 174.45 2q6b n SER 775 N -3.32 0.15 -4.64 3.07 7.64 -0.70 -4.49 113.62 111.34 2q6b n SER 775 Ca -0.01 0.23 -0.51 0.00 1.01 0.00 0.00 58.87 59.59 2q6b n SER 775 Cb 0.24 -0.27 -0.06 0.00 -1.01 0.00 0.00 64.21 63.11 2q6b n SER 775 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2q6b n ASN 776 N -1.47 2.32 -3.63 6.43 3.02 -0.99 -4.56 115.26 116.37 2q6b n ASN 776 Ca 0.07 1.09 -0.12 0.00 -0.03 0.00 0.00 54.58 55.59 2q6b n ASN 776 Cb 0.33 -1.26 -0.07 0.00 -0.61 0.00 0.00 39.78 38.17 2q6b n ASN 776 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2q6b s ILE 778 N 0.42 2.39 -0.26 0.00 2.07 -0.73 -2.02 121.20 123.06 2q6b s ILE 778 Ca 0.00 -0.84 -0.10 0.00 -1.41 0.00 0.00 60.65 58.30 2q6b s ILE 778 Cb -0.05 -2.01 -0.05 0.00 0.13 0.00 0.00 42.46 40.48 2q6b s ILE 778 CO -0.03 0.52 0.15 -0.89 -1.91 0.00 0.00 174.94 172.78 2q6b s THR 779 N 1.16 5.09 0.01 4.00 2.01 -0.49 -1.86 115.64 125.55 2q6b s THR 779 Ca 0.01 0.09 0.07 0.00 0.31 0.00 0.00 61.69 62.17 2q6b s THR 779 Cb -0.14 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 2q6b s THR 779 CO -0.07 0.31 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.21 2q6b s LEU 780 N 1.45 2.50 -0.01 4.42 1.43 -0.35 -4.90 118.68 123.23 2q6b s LEU 780 Ca 0.07 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 2q6b s LEU 780 Cb -0.15 -1.47 -0.00 0.00 0.03 0.00 0.00 46.19 44.59 2q6b s LEU 780 CO 0.07 0.29 -0.06 -0.04 0.23 0.00 0.00 176.35 176.84 2q6b s MET 781 N -1.10 0.55 0.04 1.70 -1.94 -1.26 -1.50 119.30 115.79 2q6b s MET 781 Ca 0.13 -0.21 -0.03 0.00 -1.71 0.00 0.00 55.69 53.87 2q6b s MET 781 Cb -0.10 -0.54 -0.02 0.00 2.01 0.00 0.00 34.83 36.18 2q6b s MET 781 CO 0.03 0.11 0.03 -1.21 -0.01 0.00 0.00 175.02 173.96 2q6b s GLU 782 N -0.02 0.56 0.32 2.03 2.02 -0.37 -4.90 118.70 118.35 2q6b s GLU 782 Ca 0.01 -0.93 -0.28 0.00 0.02 0.00 0.00 54.97 53.79 2q6b s GLU 782 Cb -0.04 0.21 -0.09 0.00 0.10 0.00 0.00 34.13 34.30 2q6b s GLU 782 CO -0.00 -0.12 1.09 0.00 0.02 0.00 0.00 175.26 176.25 2q6b s ALA 783 N -3.01 3.31 0.16 5.21 0.00 -1.26 -1.14 121.76 125.02 2q6b s ALA 783 Ca -0.01 0.85 -0.05 0.00 0.00 0.00 0.00 51.96 52.75 2q6b s ALA 783 Cb 0.01 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 2q6b s ALA 783 CO -0.07 -0.20 0.20 0.45 0.00 0.00 0.00 175.76 176.14 2q6b s SER 784 N -1.06 0.14 0.01 0.00 0.15 -0.09 -4.78 113.70 108.08 2q6b s SER 784 Ca 0.48 -1.06 0.00 0.00 0.70 0.00 0.00 55.95 56.07 2q6b s SER 784 Cb -0.29 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 2q6b s SER 784 CO 0.38 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.58 2q6b n GLY 785 N -0.19 -1.75 0.13 9.45 0.00 -1.26 -2.57 105.19 109.01 2q6b n GLY 785 Ca -0.05 -1.50 -0.01 0.00 0.00 0.00 0.00 46.02 44.46 2q6b n GLY 785 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2q6b h PRO 786 N -0.04 0.00 0.00 1.61 0.13 -2.00 -2.73 132.00 128.97 2q6b h PRO 786 Ca -0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.01 2q6b h PRO 786 Cb 0.04 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.16 2q6b h PRO 786 CO 0.00 0.64 -0.55 1.15 -0.23 0.00 0.00 178.00 179.01 2q6b h THR 787 N 0.00 1.37 -0.38 1.56 2.02 -2.01 -3.47 112.91 112.00 2q6b h THR 787 Ca -0.01 -1.89 -0.16 0.00 0.77 0.00 0.00 66.41 65.12 2q6b h THR 787 Cb 1.18 2.02 -0.07 0.00 -1.74 0.00 0.00 68.15 69.54 2q6b h THR 787 CO 0.08 0.54 -0.15 -3.20 0.37 0.00 0.00 175.52 173.16 2q6b n ASN 788 N -3.86 -4.04 -0.33 4.18 5.15 -1.03 -4.89 115.26 110.45 2q6b n ASN 788 Ca -0.01 0.20 0.06 0.00 -0.60 0.00 0.00 54.58 54.22 2q6b n ASN 788 Cb 0.56 -2.25 0.01 0.00 -0.53 0.00 0.00 39.78 37.58 2q6b n ASN 788 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2q6b n GLU 789 N -2.68 1.63 -2.87 1.20 1.02 -1.21 -4.36 120.64 113.37 2q6b n GLU 789 Ca -0.08 -0.82 -0.31 0.00 -0.02 0.00 0.00 57.16 55.94 2q6b n GLU 789 Cb 0.28 -1.16 -0.04 0.00 -0.02 0.00 0.00 31.44 30.50 2q6b n GLU 789 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2q6b s ASP 790 N -1.37 6.58 -0.38 1.62 1.01 -1.06 -3.90 116.67 119.18 2q6b s ASP 790 Ca 0.11 1.20 -0.07 0.00 0.71 0.00 0.00 52.55 54.50 2q6b s ASP 790 Cb 0.10 -2.35 0.06 0.00 1.01 0.00 0.00 42.92 41.74 2q6b s ASP 790 CO 0.25 -0.38 0.17 -0.22 0.21 0.00 0.00 175.17 175.21 2q6b s LEU 791 N -3.69 4.74 -0.08 1.23 2.96 -0.28 -0.91 118.68 122.64 2q6b s LEU 791 Ca 0.52 -1.41 -0.29 0.00 -0.22 0.00 0.00 54.13 52.74 2q6b s LEU 791 Cb -0.10 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.67 2q6b s LEU 791 CO 0.28 -0.43 0.95 -0.47 -1.32 0.00 0.00 176.35 175.36 2q6b s TYR 792 N 1.37 3.55 0.03 5.38 5.04 -0.30 -0.92 117.35 131.50 2q6b s TYR 792 Ca 0.01 1.55 0.06 0.00 -2.44 0.00 0.00 57.07 56.26 2q6b s TYR 792 Cb -0.21 -3.12 -0.02 0.00 0.35 0.00 0.00 41.96 38.96 2q6b s TYR 792 CO 0.01 -0.14 -0.18 -1.50 -1.34 0.00 0.00 175.55 172.40 2q6b s ILE 793 N 1.65 1.47 -0.01 3.14 2.07 -0.43 -1.23 121.20 127.87 2q6b s ILE 793 Ca 0.47 -1.07 -0.03 0.00 -1.41 0.00 0.00 60.65 58.62 2q6b s ILE 793 Cb -0.19 -1.28 -0.00 0.00 0.13 0.00 0.00 42.46 41.12 2q6b s ILE 793 CO 0.20 0.19 0.06 -0.94 -1.91 0.00 0.00 174.94 172.54 2q6b s SER 794 N -1.03 0.04 -0.07 4.50 1.04 -0.56 -1.73 113.70 115.89 2q6b s SER 794 Ca 0.06 -0.12 0.03 0.00 0.48 0.00 0.00 55.95 56.40 2q6b s SER 794 Cb -0.08 0.15 0.01 0.00 0.10 0.00 0.00 66.02 66.19 2q6b s SER 794 CO 0.01 -0.18 -0.17 0.00 0.98 0.00 0.00 173.24 173.88 2q6b s THR 796 N 0.43 1.90 -0.34 0.00 2.01 -0.78 -1.25 115.64 117.61 2q6b s THR 796 Ca -0.14 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.01 2q6b s THR 796 Cb -0.16 -1.72 0.10 0.00 0.01 0.00 0.00 72.50 70.74 2q6b s THR 796 CO 0.05 0.52 0.10 -0.04 -0.69 0.00 0.00 174.62 174.56 2q6b s MET 797 N 1.13 1.07 0.13 4.92 -1.94 -0.12 -1.78 119.30 122.72 2q6b s MET 797 Ca -0.00 -1.49 0.25 0.00 -1.71 0.00 0.00 55.69 52.74 2q6b s MET 797 Cb -0.14 -2.49 0.95 0.00 2.01 0.00 0.00 34.83 35.15 2q6b s MET 797 CO -0.08 -0.99 1.78 -0.35 -0.01 0.00 0.00 175.02 175.37 2q6b n PRO 798 N 4.46 0.14 -2.95 2.03 -0.04 -1.26 -0.96 135.00 136.42 2q6b n PRO 798 Ca 0.01 0.19 -0.14 0.00 -0.04 0.00 0.00 63.50 63.52 2q6b n PRO 798 Cb 0.41 -1.69 -0.00 0.00 -0.04 0.00 0.00 33.50 32.18 2q6b n PRO 798 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2q6b n SER 799 N -1.94 1.10 -4.59 3.54 3.41 -1.24 -2.83 113.62 111.08 2q6b n SER 799 Ca 0.05 -2.88 -0.43 0.00 -0.26 0.00 0.00 58.87 55.36 2q6b n SER 799 Cb 0.34 -0.58 -0.02 0.00 -0.26 0.00 0.00 64.21 63.69 2q6b n SER 799 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2q6b s ILE 800 N -2.74 4.09 -0.43 -1.33 1.01 -0.23 -3.17 121.20 118.40 2q6b s ILE 800 Ca 0.34 1.04 -0.20 0.00 0.00 0.00 0.00 60.65 61.84 2q6b s ILE 800 Cb 0.40 -4.65 0.02 0.00 0.01 0.00 0.00 42.46 38.24 2q6b s ILE 800 CO -0.03 -1.18 0.61 -1.61 0.00 0.00 0.00 174.94 172.74 2q6b s GLU 801 N 4.75 3.29 0.05 2.79 2.02 -1.26 -1.13 118.70 129.20 2q6b s GLU 801 Ca 0.46 -0.39 -0.23 0.00 0.02 0.00 0.00 54.97 54.83 2q6b s GLU 801 Cb -0.07 -3.94 0.05 0.00 0.10 0.00 0.00 34.13 30.27 2q6b s GLU 801 CO 0.29 -0.96 0.53 -1.50 0.02 0.00 0.00 175.26 173.63 2q6b s ILE 802 N 2.71 0.03 -0.01 -1.63 2.07 -1.26 -4.90 121.20 118.20 2q6b s ILE 802 Ca 0.21 -0.23 -0.28 0.00 -1.41 0.00 0.00 60.65 58.93 2q6b s ILE 802 Cb -0.15 -0.97 0.09 0.00 0.13 0.00 0.00 42.46 41.56 2q6b s ILE 802 CO 0.18 -0.13 0.77 -0.83 -1.91 0.00 0.00 174.94 173.01 2q6b s GLY 803 N -1.96 -0.50 0.00 1.50 0.00 -1.26 -3.69 107.32 101.40 2q6b s GLY 803 Ca -0.05 1.21 0.08 0.00 0.00 0.00 0.00 44.72 45.96 2q6b s GLY 803 CO -0.02 0.67 0.87 -1.30 0.00 0.00 0.00 173.10 173.33 2q6b n THR 804 N 0.35 0.25 -4.25 0.90 -2.24 0.17 -4.81 114.28 104.65 2q6b n THR 804 Ca -0.15 -0.63 -0.18 0.00 -2.27 0.00 0.00 64.05 60.82 2q6b n THR 804 Cb 0.60 1.01 -0.11 0.00 -2.10 0.00 0.00 70.33 69.72 2q6b n THR 804 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2q6b s VAL 805 N -0.78 1.38 0.01 2.28 -7.23 -1.23 -2.14 120.40 112.69 2q6b s VAL 805 Ca 0.12 -1.72 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 2q6b s VAL 805 Cb 0.08 -1.55 0.00 0.00 0.56 0.00 0.00 36.38 35.46 2q6b s VAL 805 CO 0.11 -0.40 0.00 0.61 -0.31 0.00 0.00 175.10 175.11 2q6b n GLY 806 N 0.54 -2.38 7.00 2.32 0.00 -1.26 -4.37 105.19 107.04 2q6b n GLY 806 Ca -0.15 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.40 2q6b n GLY 806 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q6b n GLY 807 N -2.22 3.08 0.31 -0.02 0.00 -1.26 -2.32 105.19 102.75 2q6b n GLY 807 Ca -0.00 -0.30 0.19 0.00 0.00 0.00 0.00 46.02 45.91 2q6b n GLY 807 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2q6b h GLY 808 N 0.00 0.00 1.52 -0.02 0.00 -1.86 -2.80 103.07 99.91 2q6b h GLY 808 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2q6b h GLY 808 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 2q6b n THR 809 N -3.17 0.43 0.19 4.70 -2.24 -0.98 -2.23 114.28 110.97 2q6b n THR 809 Ca -0.02 0.11 0.09 0.00 -2.27 0.00 0.00 64.05 61.96 2q6b n THR 809 Cb 0.18 -0.81 0.12 0.00 -2.10 0.00 0.00 70.33 67.71 2q6b n THR 809 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2q6b h ASN 810 N 0.00 0.00 -3.93 3.42 2.35 -1.63 -3.41 115.58 112.38 2q6b h ASN 810 Ca 0.00 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.27 2q6b h ASN 810 Cb 0.15 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.53 2q6b h ASN 810 CO 0.00 0.16 0.40 -0.76 -1.65 0.00 0.00 177.43 175.59 2q6b s LEU 811 N -6.27 4.23 0.11 1.61 1.43 -0.95 -4.94 118.68 113.89 2q6b s LEU 811 Ca 0.06 2.02 -0.14 0.00 -1.03 0.00 0.00 54.13 55.04 2q6b s LEU 811 Cb 0.06 -4.08 -0.10 0.00 0.03 0.00 0.00 46.19 42.10 2q6b s LEU 811 CO 0.70 -0.36 1.39 -0.07 0.23 0.00 0.00 176.35 178.24 2q6b h LEU 812 N 2.80 0.85 -0.83 1.79 3.38 -1.89 -1.30 115.31 120.09 2q6b h LEU 812 Ca -0.48 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 56.97 2q6b h LEU 812 Cb 1.21 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.68 2q6b h LEU 812 CO 0.63 1.21 0.51 -0.65 0.09 0.00 0.00 178.44 180.23 2q6b h PRO 813 N 0.52 1.13 -0.58 1.13 0.11 -1.95 -1.51 132.00 130.84 2q6b h PRO 813 Ca 0.02 -0.10 -0.05 0.00 0.11 0.00 0.00 66.00 65.98 2q6b h PRO 813 Cb 1.03 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 31.88 2q6b h PRO 813 CO 0.10 0.78 0.15 1.96 -0.21 0.00 0.00 178.00 180.78 2q6b h GLN 814 N 1.14 0.89 0.00 1.05 7.50 -1.77 -2.40 115.11 121.52 2q6b h GLN 814 Ca 0.30 -0.18 -0.05 0.00 0.50 0.00 0.00 58.65 59.21 2q6b h GLN 814 Cb -0.06 -0.13 -0.01 0.00 0.05 0.00 0.00 27.48 27.33 2q6b h GLN 814 CO -0.06 0.79 -0.26 1.96 -1.50 0.00 0.00 178.83 179.76 2q6b h GLN 815 N 0.85 0.00 -0.43 1.46 4.20 -0.78 -2.74 115.11 117.68 2q6b h GLN 815 Ca 0.19 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.82 2q6b h GLN 815 Cb 0.30 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 2q6b h GLN 815 CO -0.00 0.26 -0.04 0.00 -0.67 0.00 0.00 178.83 178.38 2q6b h ALA 816 N 1.74 0.58 -0.33 3.87 0.00 -0.76 -0.41 119.26 123.96 2q6b h ALA 816 Ca -0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 2q6b h ALA 816 Cb 0.67 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2q6b h ALA 816 CO 0.03 0.40 -0.22 0.00 0.00 0.00 0.00 179.25 179.46 2q6b h LEU 818 N 0.56 0.54 -0.96 0.00 3.38 -1.35 -2.97 115.31 114.50 2q6b h LEU 818 Ca 0.08 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 2q6b h LEU 818 Cb 0.68 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2q6b h LEU 818 CO 0.05 0.73 -0.47 1.56 0.09 0.00 0.00 178.44 180.40 2q6b h GLN 819 N 0.49 0.10 -0.80 1.13 4.20 -0.64 -2.16 115.11 117.44 2q6b h GLN 819 Ca 0.08 -0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.80 2q6b h GLN 819 Cb 0.59 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.31 2q6b h GLN 819 CO 0.04 0.56 0.48 0.52 -0.67 0.00 0.00 178.83 179.76 2q6b h MET 820 N 0.08 0.85 0.00 1.46 2.86 -1.20 -2.61 114.93 116.38 2q6b h MET 820 Ca 0.00 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2q6b h MET 820 Cb 0.87 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.34 2q6b h MET 820 CO 0.07 0.56 -0.26 1.28 1.06 0.00 0.00 176.91 179.61 2q6b n LEU 821 N -4.68 0.34 -0.18 1.22 4.77 -1.02 -4.66 117.00 112.79 2q6b n LEU 821 Ca 0.11 0.28 -0.02 0.00 -0.03 0.00 0.00 56.01 56.36 2q6b n LEU 821 Cb 0.19 -0.35 -0.00 0.00 -2.33 0.00 0.00 43.42 40.92 2q6b n LEU 821 CO 0.30 0.03 -0.02 0.61 -1.33 0.00 0.00 177.39 176.98 2q6b n GLY 822 N 1.47 0.39 0.08 -0.72 0.00 -0.86 -4.95 105.19 100.59 2q6b n GLY 822 Ca 0.06 -0.89 0.03 0.00 0.00 0.00 0.00 46.02 45.22 2q6b n GLY 822 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2q6b n VAL 823 N -3.57 1.02 -2.11 1.61 0.24 -0.90 -5.02 118.33 109.60 2q6b n VAL 823 Ca -0.02 -1.14 -0.42 0.00 -2.04 0.00 0.00 64.34 60.72 2q6b n VAL 823 Cb 0.33 0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 33.01 2q6b n VAL 823 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2q6b s GLN 824 N -1.33 4.30 1.28 7.34 -0.44 -1.20 -4.74 119.66 124.86 2q6b s GLN 824 Ca 0.10 2.15 0.00 0.00 -2.50 0.00 0.00 55.36 55.11 2q6b s GLN 824 Cb 0.09 -3.21 0.00 0.00 -1.64 0.00 0.00 33.01 28.24 2q6b s GLN 824 CO 0.01 -0.46 0.00 0.41 0.50 0.00 0.00 175.29 175.75 2q6b n GLY 825 N 3.38 -1.79 3.74 2.59 0.00 -0.91 -4.84 105.19 107.36 2q6b n GLY 825 Ca 0.11 -1.32 -0.40 0.00 0.00 0.00 0.00 46.02 44.41 2q6b n GLY 825 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q6b s ALA 826 N -1.23 3.33 -0.52 4.61 0.00 -1.26 -4.64 121.76 122.04 2q6b s ALA 826 Ca 0.00 0.67 -0.29 0.00 0.00 0.00 0.00 51.96 52.35 2q6b s ALA 826 Cb 0.00 -3.26 0.03 0.00 0.00 0.00 0.00 23.12 19.88 2q6b s ALA 826 CO 0.00 0.05 1.23 0.00 0.00 0.00 0.00 175.76 177.04 2q6b h LYS 828 N 9.80 -0.34 -0.07 0.00 6.56 -1.99 -3.06 116.57 127.47 2q6b h LYS 828 Ca -0.25 0.02 -0.08 0.00 -1.06 0.00 0.00 60.65 59.28 2q6b h LYS 828 Cb 1.07 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.79 2q6b h LYS 828 CO 1.15 -0.19 -0.34 -0.44 -2.06 0.00 0.00 179.45 177.57 2q6b h ASP 829 N -0.40 0.13 -2.29 0.86 3.32 -2.05 -3.39 116.42 112.60 2q6b h ASP 829 Ca -0.04 -0.04 -0.49 0.00 0.02 0.00 0.00 57.03 56.48 2q6b h ASP 829 Cb 0.31 -0.04 -0.35 0.00 0.22 0.00 0.00 39.33 39.47 2q6b h ASP 829 CO 0.06 0.47 -0.78 0.21 -1.72 0.00 0.00 179.24 177.48 2q6b s ASN 830 N -6.90 2.10 0.06 6.45 2.47 -1.21 -5.12 114.94 112.79 2q6b s ASN 830 Ca -0.04 -1.95 -0.37 0.00 0.42 0.00 0.00 52.86 50.92 2q6b s ASN 830 Cb 0.14 0.04 -0.16 0.00 -1.45 0.00 0.00 41.25 39.82 2q6b s ASN 830 CO 0.74 -0.28 1.41 -2.65 -3.72 0.00 0.00 177.10 172.60 2q6b n PRO 831 N 4.08 1.27 0.00 0.43 -0.02 -1.16 -2.33 135.00 137.27 2q6b n PRO 831 Ca 0.12 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2q6b n PRO 831 Cb 0.41 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2q6b n PRO 831 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q6b n GLY 832 N 2.78 0.58 0.15 -1.23 0.00 -1.24 -4.83 105.19 101.40 2q6b n GLY 832 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.23 2q6b n GLY 832 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2q6b h GLU 833 N 3.67 0.00 -0.20 1.61 4.57 -1.78 -0.70 114.58 121.75 2q6b h GLU 833 Ca 0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 2q6b h GLU 833 Cb 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2q6b h GLU 833 CO 0.00 0.52 -0.26 -0.91 -1.18 0.00 0.00 179.01 177.18 2q6b h ASN 834 N 0.00 0.59 0.10 1.04 2.35 -1.88 -1.90 115.58 115.88 2q6b h ASN 834 Ca -0.01 -0.50 -0.09 0.00 -0.55 0.00 0.00 56.30 55.15 2q6b h ASN 834 Cb 1.14 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.33 2q6b h ASN 834 CO 0.07 0.97 -0.29 0.00 -1.65 0.00 0.00 177.43 176.53 2q6b h ALA 835 N 0.63 1.21 -0.34 -0.83 0.00 -1.79 -1.59 119.26 116.56 2q6b h ALA 835 Ca 0.03 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 2q6b h ALA 835 Cb 0.83 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2q6b h ALA 835 CO 0.06 0.52 -0.48 0.00 0.00 0.00 0.00 179.25 179.35 2q6b h ARG 836 N 0.27 0.92 -0.67 0.00 3.08 -1.15 -2.44 114.38 114.38 2q6b h ARG 836 Ca 0.04 -0.54 -0.07 0.00 0.07 0.00 0.00 59.98 59.48 2q6b h ARG 836 Cb 0.66 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.73 2q6b h ARG 836 CO 0.05 1.18 0.13 0.37 -1.07 0.00 0.00 179.97 180.63 2q6b h GLN 837 N 0.72 1.10 -0.69 0.04 5.75 -1.10 -1.63 115.11 119.30 2q6b h GLN 837 Ca 0.04 -0.28 -0.07 0.00 -0.15 0.00 0.00 58.65 58.18 2q6b h GLN 837 Cb 1.08 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 29.47 2q6b h GLN 837 CO 0.11 1.00 0.17 1.25 -2.65 0.00 0.00 178.83 178.70 2q6b h LEU 838 N 1.03 1.04 -0.87 -2.39 5.85 -1.25 -1.14 115.31 117.58 2q6b h LEU 838 Ca 0.21 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 2q6b h LEU 838 Cb 0.42 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 2q6b h LEU 838 CO 0.01 1.00 0.16 0.00 -0.34 0.00 0.00 178.44 179.26 2q6b h ALA 839 N 1.13 1.07 -0.42 1.25 0.00 -1.19 -0.85 119.26 120.25 2q6b h ALA 839 Ca 0.22 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2q6b h ALA 839 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2q6b h ALA 839 CO 0.00 0.61 -0.12 0.00 0.00 0.00 0.00 179.25 179.74 2q6b h ARG 840 N 0.95 0.76 -0.55 0.00 3.08 -0.92 -1.76 114.38 115.94 2q6b h ARG 840 Ca 0.20 -0.25 -0.11 0.00 0.07 0.00 0.00 59.98 59.89 2q6b h ARG 840 Cb 0.33 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 2q6b h ARG 840 CO -0.00 0.85 -0.08 0.82 -1.07 0.00 0.00 179.97 180.49 2q6b h ILE 841 N 0.68 1.27 -0.28 2.04 2.04 -0.80 -1.56 117.51 120.90 2q6b h ILE 841 Ca 0.11 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 64.72 2q6b h ILE 841 Cb 0.60 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 2q6b h ILE 841 CO 0.04 0.44 0.10 0.58 0.00 0.00 0.00 178.15 179.31 2q6b h VAL 842 N 0.91 1.18 -0.75 1.67 2.07 -0.95 0.06 116.25 120.45 2q6b h VAL 842 Ca 0.15 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 2q6b h VAL 842 Cb 0.65 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 2q6b h VAL 842 CO 0.04 0.19 0.33 0.00 0.02 0.00 0.00 177.57 178.16 2q6b h GLY 844 N 1.12 0.74 1.52 0.00 0.00 -1.04 -2.10 103.07 103.32 2q6b h GLY 844 Ca 0.26 -0.72 -0.21 0.00 0.00 0.00 0.00 47.33 46.66 2q6b h GLY 844 CO -0.03 0.65 -0.85 -0.84 0.00 0.00 0.00 176.54 175.47 2q6b h THR 845 N 0.57 1.38 -0.55 4.70 2.02 -0.67 -2.16 112.91 118.19 2q6b h THR 845 Ca 0.06 -2.30 0.02 0.00 0.77 0.00 0.00 66.41 64.96 2q6b h THR 845 Cb 0.88 2.27 -0.03 0.00 -1.74 0.00 0.00 68.15 69.53 2q6b h THR 845 CO 0.08 0.69 0.34 0.58 0.37 0.00 0.00 175.52 177.58 2q6b h VAL 846 N 0.28 1.08 -0.89 3.16 2.07 -1.00 -0.56 116.25 120.38 2q6b h VAL 846 Ca -0.06 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 2q6b h VAL 846 Cb 1.47 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 2q6b h VAL 846 CO 0.15 0.12 0.47 -0.03 0.02 0.00 0.00 177.57 178.31 2q6b h MET 847 N 0.68 1.25 -0.69 1.57 -1.53 -1.23 0.19 114.93 115.17 2q6b h MET 847 Ca 0.22 -0.16 -0.03 0.00 -3.44 0.00 0.00 59.70 56.29 2q6b h MET 847 Cb 0.00 -0.24 -0.03 0.00 -0.55 0.00 0.00 31.60 30.78 2q6b h MET 847 CO -0.09 0.92 0.30 0.00 0.14 0.00 0.00 176.91 178.18 2q6b h ALA 848 N 1.26 0.89 -0.20 0.39 0.00 -0.99 -1.64 119.26 118.96 2q6b h ALA 848 Ca 0.31 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2q6b h ALA 848 Cb 0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2q6b h ALA 848 CO -0.05 0.49 -0.35 0.78 0.00 0.00 0.00 179.25 180.13 2q6b h GLY 849 N 0.97 0.47 1.00 0.00 0.00 -0.48 -2.77 103.07 102.26 2q6b h GLY 849 Ca 0.23 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 2q6b h GLY 849 CO -0.02 0.39 0.01 0.83 0.00 0.00 0.00 176.54 177.74 2q6b h GLU 850 N 0.37 0.85 -0.26 4.80 4.39 -0.40 -2.51 114.58 121.82 2q6b h GLU 850 Ca 0.04 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.48 2q6b h GLU 850 Cb 0.78 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.34 2q6b h GLU 850 CO 0.06 0.88 0.17 -0.07 -1.16 0.00 0.00 179.01 178.90 2q6b h LEU 851 N 0.71 0.30 -0.05 1.33 3.38 -1.15 -1.92 115.31 117.91 2q6b h LEU 851 Ca 0.14 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 2q6b h LEU 851 Cb 0.50 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2q6b h LEU 851 CO 0.02 0.23 -0.31 -1.28 0.09 0.00 0.00 178.44 177.20 2q6b h SER 852 N 0.35 0.35 -0.51 -0.43 0.87 -1.48 -2.36 113.55 110.33 2q6b h SER 852 Ca 0.10 -0.68 -0.06 0.00 -1.23 0.00 0.00 61.79 59.91 2q6b h SER 852 Cb -0.03 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 2q6b h SER 852 CO -0.02 0.98 0.07 0.25 -0.53 0.00 0.00 176.83 177.57 2q6b h LEU 853 N -0.25 0.83 -1.36 2.23 5.85 -1.51 -1.81 115.31 119.29 2q6b h LEU 853 Ca -0.03 -0.27 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 2q6b h LEU 853 Cb 0.98 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 2q6b h LEU 853 CO 0.06 0.89 -0.32 0.24 -0.34 0.00 0.00 178.44 178.97 2q6b h MET 854 N 0.73 0.00 -0.21 1.25 2.86 -1.40 -0.05 114.93 118.11 2q6b h MET 854 Ca 0.15 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.62 2q6b h MET 854 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 2q6b h MET 854 CO 0.01 0.32 -0.56 0.00 1.06 0.00 0.00 176.91 177.74 2q6b h ALA 855 N 1.68 0.36 -0.82 6.32 0.00 -1.26 -1.32 119.26 124.22 2q6b h ALA 855 Ca -0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 2q6b h ALA 855 Cb 0.57 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2q6b h ALA 855 CO 0.04 0.58 0.37 0.00 0.00 0.00 0.00 179.25 180.23 2q6b h ALA 856 N 0.60 1.09 -0.20 0.00 0.00 -0.77 -0.93 119.26 119.05 2q6b h ALA 856 Ca -0.01 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 2q6b h ALA 856 Cb 1.17 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2q6b h ALA 856 CO 0.12 0.67 -0.64 -0.07 0.00 0.00 0.00 179.25 179.33 2q6b h LEU 857 N 1.19 0.84 -0.19 0.00 3.38 -1.02 0.52 115.31 120.03 2q6b h LEU 857 Ca 0.28 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2q6b h LEU 857 Cb 0.16 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2q6b h LEU 857 CO -0.03 1.27 -0.00 0.00 0.09 0.00 0.00 178.44 179.76 2q6b h ALA 858 N 0.73 0.25 0.00 1.53 0.00 -1.04 -3.14 119.26 117.60 2q6b h ALA 858 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2q6b h ALA 858 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2q6b h ALA 858 CO 0.13 -0.03 -0.09 0.00 0.00 0.00 0.00 179.25 179.26 2q6b h ALA 859 N 0.78 0.94 -1.40 0.00 0.00 -1.23 -3.48 119.26 114.87 2q6b h ALA 859 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2q6b h ALA 859 Cb 0.40 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.20 2q6b h ALA 859 CO 0.01 0.00 -0.15 0.41 0.00 0.00 0.00 179.25 179.52 2q6b n GLY 860 N 1.24 0.36 3.40 0.00 0.00 -0.53 -5.00 105.19 104.65 2q6b n GLY 860 Ca 0.05 -0.57 -0.45 0.00 0.00 0.00 0.00 46.02 45.05 2q6b n GLY 860 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2q6b s HIS 861 N -2.64 3.88 -0.78 1.61 3.76 0.06 -4.83 115.29 116.36 2q6b s HIS 861 Ca 0.07 -2.38 0.12 0.00 -0.15 0.00 0.00 55.06 52.72 2q6b s HIS 861 Cb -0.03 -4.06 0.37 0.00 1.11 0.00 0.00 32.58 29.97 2q6b s HIS 861 CO 0.08 -1.16 1.30 1.28 -0.85 0.00 0.00 174.74 175.39 2q6b n LEU 862 N 4.15 3.19 -4.57 0.89 4.77 -1.26 -4.75 117.00 119.42 2q6b n LEU 862 Ca 0.29 -2.23 -0.42 0.00 -0.03 0.00 0.00 56.01 53.61 2q6b n LEU 862 Cb 0.41 -0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 2q6b n LEU 862 CO 0.53 0.72 0.49 -0.69 -1.33 0.00 0.00 177.39 177.12 2q6b s VAL 863 N -1.42 4.79 0.03 4.08 1.01 -1.26 -4.95 120.40 122.68 2q6b s VAL 863 Ca 0.28 0.68 -0.20 0.00 0.00 0.00 0.00 61.98 62.74 2q6b s VAL 863 Cb 0.18 -4.17 -0.17 0.00 0.00 0.00 0.00 36.38 32.21 2q6b s VAL 863 CO 0.15 -0.43 1.24 0.11 0.00 0.00 0.00 175.10 176.17 2q6b h LYS 864 N 8.55 0.41 -0.89 2.72 1.79 -2.00 -3.28 116.57 123.87 2q6b h LYS 864 Ca -0.25 -0.30 0.24 0.00 -2.18 0.00 0.00 60.65 58.16 2q6b h LYS 864 Cb 1.10 0.05 -0.05 0.00 -1.58 0.00 0.00 32.23 31.75 2q6b h LYS 864 CO 0.89 0.92 0.62 0.66 -1.08 0.00 0.00 179.45 181.46 2q6b h SER 865 N -0.02 0.15 0.00 0.86 4.64 -2.02 -3.49 113.55 113.66 2q6b h SER 865 Ca -0.01 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2q6b h SER 865 Cb 0.95 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2q6b h SER 865 CO 0.07 0.05 0.00 1.41 -0.87 0.00 0.00 176.83 177.49