#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v3s s PRO 433 N 0.00 2.31 -0.12 1.61 0.04 -1.26 -4.93 135.00 132.65 2v3s s PRO 433 Ca 0.00 1.77 0.01 0.00 0.04 0.00 0.00 61.00 62.82 2v3s s PRO 433 Cb 0.00 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 2v3s s PRO 433 CO 0.00 -1.71 -0.15 0.42 0.04 0.00 0.00 177.00 175.60 2v3s s ILE 434 N -1.91 2.85 -0.34 0.56 1.01 0.48 -4.95 121.20 118.91 2v3s s ILE 434 Ca 0.75 -0.74 -0.18 0.00 0.00 0.00 0.00 60.65 60.48 2v3s s ILE 434 Cb -0.30 -2.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.99 2v3s s ILE 434 CO 0.43 0.53 0.50 -0.44 0.00 0.00 0.00 174.94 175.96 2v3s s SER 435 N 0.29 6.32 0.29 3.58 0.01 -1.26 -1.28 113.70 121.64 2v3s s SER 435 Ca -0.11 0.04 0.10 0.00 1.31 0.00 0.00 55.95 57.29 2v3s s SER 435 Cb -0.16 -2.26 -0.05 0.00 0.21 0.00 0.00 66.02 63.76 2v3s s SER 435 CO 0.06 -0.44 -0.06 -0.76 0.41 0.00 0.00 173.24 172.46 2v3s s LEU 436 N 2.35 2.96 -0.05 2.44 1.43 0.49 -0.91 118.68 127.39 2v3s s LEU 436 Ca 0.18 -0.85 0.01 0.00 -1.03 0.00 0.00 54.13 52.44 2v3s s LEU 436 Cb -0.16 -1.44 0.02 0.00 0.03 0.00 0.00 46.19 44.65 2v3s s LEU 436 CO 0.13 -0.05 -0.04 -0.69 0.23 0.00 0.00 176.35 175.92 2v3s s VAL 437 N -2.43 0.53 -0.29 -1.59 1.01 -0.16 -1.56 120.40 115.91 2v3s s VAL 437 Ca 0.32 -0.09 -0.10 0.00 0.00 0.00 0.00 61.98 62.11 2v3s s VAL 437 Cb -0.04 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 2v3s s VAL 437 CO 0.18 0.24 0.17 -0.22 0.00 0.00 0.00 175.10 175.47 2v3s s LEU 438 N 1.11 4.00 -0.23 3.92 2.96 0.18 -1.20 118.68 129.42 2v3s s LEU 438 Ca -0.08 -0.20 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 2v3s s LEU 438 Cb -0.14 -2.06 -0.02 0.00 0.50 0.00 0.00 46.19 44.46 2v3s s LEU 438 CO -0.01 -0.10 0.03 -0.60 -1.32 0.00 0.00 176.35 174.35 2v3s s ARG 439 N 1.70 3.58 0.11 1.98 3.52 0.53 0.56 118.95 130.94 2v3s s ARG 439 Ca 0.06 -0.52 -0.25 0.00 -0.13 0.00 0.00 55.73 54.89 2v3s s ARG 439 Cb -0.16 -3.20 0.08 0.00 -1.56 0.00 0.00 34.95 30.11 2v3s s ARG 439 CO 0.09 -0.14 0.71 -0.48 -0.81 0.00 0.00 175.30 174.66 2v3s s LEU 440 N 1.44 -0.48 0.30 -0.88 -0.00 -0.79 -1.18 118.68 117.08 2v3s s LEU 440 Ca 0.05 -0.03 -0.27 0.00 -0.00 0.00 0.00 54.13 53.88 2v3s s LEU 440 Cb -0.15 2.41 -0.10 0.00 -0.00 0.00 0.00 46.19 48.36 2v3s s LEU 440 CO 0.01 -0.87 0.94 -0.13 -0.00 0.00 0.00 176.35 176.31 2v3s s ARG 441 N -3.54 4.65 0.00 1.48 0.52 -1.26 -1.92 118.95 118.87 2v3s s ARG 441 Ca 0.03 1.37 0.00 0.00 -0.52 0.00 0.00 55.73 56.61 2v3s s ARG 441 Cb -0.01 -2.92 0.00 0.00 0.52 0.00 0.00 34.95 32.54 2v3s s ARG 441 CO -0.11 0.34 0.00 0.27 0.02 0.00 0.00 175.30 175.82 2v3s n ASN 442 N 0.78 0.00 0.26 0.23 0.23 0.20 -4.85 115.26 112.11 2v3s n ASN 442 Ca 0.01 -0.91 0.16 0.00 -0.53 0.00 0.00 54.58 53.31 2v3s n ASN 442 Cb 0.49 0.00 0.61 0.00 -2.08 0.00 0.00 39.78 38.80 2v3s n ASN 442 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2v3s h SER 443 N 0.00 0.00 -0.33 0.53 0.02 -1.98 -0.47 113.55 111.33 2v3s h SER 443 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2v3s h SER 443 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2v3s h SER 443 CO 0.00 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 175.98 2v3s n LYS 444 N -3.00 1.87 -1.46 3.45 5.02 -1.26 -4.92 118.16 117.86 2v3s n LYS 444 Ca 0.01 -1.34 -0.14 0.00 -2.02 0.00 0.00 58.31 54.82 2v3s n LYS 444 Cb 0.33 -1.34 -0.06 0.00 -0.02 0.00 0.00 35.03 33.95 2v3s n LYS 444 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2v3s n LYS 445 N 0.58 -0.97 -3.05 1.97 5.02 -0.18 -5.01 118.16 116.51 2v3s n LYS 445 Ca 0.14 0.96 -0.40 0.00 -2.02 0.00 0.00 58.31 57.00 2v3s n LYS 445 Cb 0.34 -5.06 -0.05 0.00 -0.02 0.00 0.00 35.03 30.24 2v3s n LYS 445 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2v3s s GLU 446 N -3.27 4.40 0.11 1.97 2.02 -1.26 -4.73 118.70 117.95 2v3s s GLU 446 Ca 0.00 0.84 -0.31 0.00 0.02 0.00 0.00 54.97 55.52 2v3s s GLU 446 Cb 0.00 -3.47 -0.08 0.00 0.10 0.00 0.00 34.13 30.68 2v3s s GLU 446 CO 0.00 0.01 1.49 -1.17 0.02 0.00 0.00 175.26 175.61 2v3s s LEU 447 N 0.98 4.36 0.05 1.80 2.96 -1.26 -0.62 118.68 126.95 2v3s s LEU 447 Ca 0.36 2.42 0.04 0.00 -0.22 0.00 0.00 54.13 56.73 2v3s s LEU 447 Cb -0.17 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.91 2v3s s LEU 447 CO 0.17 -0.75 -0.12 0.20 -1.32 0.00 0.00 176.35 174.53 2v3s s ASN 448 N 1.39 1.34 -0.32 3.68 -0.87 -0.81 -4.94 114.94 114.42 2v3s s ASN 448 Ca 0.68 -0.55 -0.07 0.00 -1.57 0.00 0.00 52.86 51.35 2v3s s ASN 448 Cb -0.39 -0.03 0.03 0.00 -0.02 0.00 0.00 41.25 40.84 2v3s s ASN 448 CO 0.30 -0.10 0.10 -1.81 -2.57 0.00 0.00 177.10 173.03 2v3s s ASP 449 N -1.52 5.26 -0.35 -1.22 1.01 -1.26 -1.89 116.67 116.69 2v3s s ASP 449 Ca -0.04 -0.95 -0.16 0.00 0.71 0.00 0.00 52.55 52.12 2v3s s ASP 449 Cb -0.09 -1.88 -0.01 0.00 1.01 0.00 0.00 42.92 41.95 2v3s s ASP 449 CO 0.01 -0.27 0.38 -0.63 0.21 0.00 0.00 175.17 174.87 2v3s s ILE 450 N 1.45 5.15 0.04 0.77 1.01 0.19 -4.92 121.20 124.90 2v3s s ILE 450 Ca 0.00 -0.01 -0.20 0.00 0.00 0.00 0.00 60.65 60.44 2v3s s ILE 450 Cb -0.18 -3.86 -0.06 0.00 0.01 0.00 0.00 42.46 38.36 2v3s s ILE 450 CO 0.03 -0.15 0.58 -0.13 0.00 0.00 0.00 174.94 175.27 2v3s s ARG 451 N 2.04 4.25 -0.02 2.79 0.52 -1.26 -0.65 118.95 126.62 2v3s s ARG 451 Ca 0.12 0.74 -0.29 0.00 -0.52 0.00 0.00 55.73 55.78 2v3s s ARG 451 Cb -0.17 -3.28 0.09 0.00 0.52 0.00 0.00 34.95 32.11 2v3s s ARG 451 CO 0.12 0.52 0.78 -0.59 0.02 0.00 0.00 175.30 176.15 2v3s s PHE 452 N -0.72 -0.51 0.08 -0.53 -0.12 -0.60 -5.00 117.98 110.58 2v3s s PHE 452 Ca 0.30 0.66 -0.02 0.00 -0.05 0.00 0.00 56.93 57.82 2v3s s PHE 452 Cb -0.19 0.48 -0.05 0.00 -0.63 0.00 0.00 43.02 42.63 2v3s s PHE 452 CO 0.18 -0.59 0.26 -1.21 -0.05 0.00 0.00 175.22 173.81 2v3s s GLU 453 N -2.11 3.50 -0.08 1.99 2.02 -1.26 -0.38 118.70 122.37 2v3s s GLU 453 Ca -0.03 -0.31 0.01 0.00 0.02 0.00 0.00 54.97 54.66 2v3s s GLU 453 Cb -0.01 -2.99 0.02 0.00 0.10 0.00 0.00 34.13 31.25 2v3s s GLU 453 CO -0.01 0.57 -0.09 0.12 0.02 0.00 0.00 175.26 175.88 2v3s s PHE 454 N -1.53 1.35 -0.43 1.61 5.36 -0.40 -4.95 117.98 118.99 2v3s s PHE 454 Ca 0.36 -0.58 -0.09 0.00 -0.96 0.00 0.00 56.93 55.66 2v3s s PHE 454 Cb -0.13 -1.09 0.09 0.00 -0.34 0.00 0.00 43.02 41.56 2v3s s PHE 454 CO 0.26 -0.38 0.28 0.99 -1.46 0.00 0.00 175.22 174.91 2v3s s THR 455 N 1.22 4.17 0.41 0.12 2.01 -1.26 -0.39 115.64 121.92 2v3s s THR 455 Ca -0.05 -1.53 -0.26 0.00 0.31 0.00 0.00 61.69 60.17 2v3s s THR 455 Cb -0.14 -3.62 -0.10 0.00 0.01 0.00 0.00 72.50 68.65 2v3s s THR 455 CO -0.02 -0.58 1.24 -2.65 -0.69 0.00 0.00 174.62 171.91 2v3s n PRO 456 N 4.90 1.86 0.00 4.92 -0.02 -1.26 -1.06 135.00 144.34 2v3s n PRO 456 Ca -0.09 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2v3s n PRO 456 Cb 0.42 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2v3s n PRO 456 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2v3s n GLY 457 N 0.86 2.62 0.21 -1.23 0.00 -1.26 -4.74 105.19 101.65 2v3s n GLY 457 Ca 0.07 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 2v3s n GLY 457 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2v3s n ARG 458 N 0.00 0.48 -3.89 1.61 0.63 -0.53 -5.04 116.66 109.92 2v3s n ARG 458 Ca 0.00 0.15 -0.26 0.00 -0.92 0.00 0.00 57.85 56.83 2v3s n ARG 458 Cb 0.00 -1.34 -0.03 0.00 0.45 0.00 0.00 32.46 31.54 2v3s n ARG 458 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2v3s s ASP 459 N -6.40 6.35 0.25 6.15 1.01 -0.22 -5.04 116.67 118.76 2v3s s ASP 459 Ca -0.29 0.21 0.11 0.00 0.71 0.00 0.00 52.55 53.30 2v3s s ASP 459 Cb 0.09 -1.93 -0.05 0.00 1.01 0.00 0.00 42.92 42.05 2v3s s ASP 459 CO 0.43 0.02 -0.19 0.42 0.21 0.00 0.00 175.17 176.06 2v3s s THR 460 N -1.79 2.57 0.14 -1.27 -4.23 -1.26 -4.74 115.64 105.06 2v3s s THR 460 Ca 0.35 -2.23 -0.16 0.00 -1.18 0.00 0.00 61.69 58.48 2v3s s THR 460 Cb -0.11 -2.32 0.01 0.00 1.34 0.00 0.00 72.50 71.42 2v3s s THR 460 CO 0.29 -0.31 1.74 0.00 -0.54 0.00 0.00 174.62 175.80 2v3s h ALA 461 N 2.51 0.55 -0.79 3.99 0.00 -1.93 -1.33 119.26 122.26 2v3s h ALA 461 Ca -0.42 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.40 2v3s h ALA 461 Cb 1.24 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 2v3s h ALA 461 CO 0.57 0.09 0.52 1.49 0.00 0.00 0.00 179.25 181.92 2v3s h GLU 462 N 0.55 1.02 -0.09 0.00 4.57 -1.96 -1.24 114.58 117.43 2v3s h GLU 462 Ca 0.15 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 2v3s h GLU 462 Cb 0.09 -0.23 -0.00 0.00 -0.16 0.00 0.00 28.75 28.44 2v3s h GLU 462 CO -0.02 0.67 0.01 0.78 -1.18 0.00 0.00 179.01 179.27 2v3s h GLY 463 N 1.05 0.16 1.33 1.92 0.00 -1.90 -0.84 103.07 104.79 2v3s h GLY 463 Ca 0.30 -0.11 -0.10 0.00 0.00 0.00 0.00 47.33 47.41 2v3s h GLY 463 CO -0.07 0.10 -0.15 -0.39 0.00 0.00 0.00 176.54 176.03 2v3s h VAL 464 N -0.12 1.26 -0.78 4.60 -1.51 -1.18 -1.25 116.25 117.28 2v3s h VAL 464 Ca 0.02 -1.23 0.01 0.00 -1.23 0.00 0.00 66.70 64.27 2v3s h VAL 464 Cb 0.32 1.10 -0.04 0.00 -2.13 0.00 0.00 31.29 30.54 2v3s h VAL 464 CO 0.00 0.42 0.52 0.28 -1.23 0.00 0.00 177.57 177.56 2v3s h SER 465 N 0.70 0.90 -0.85 4.19 0.02 -1.03 -0.51 113.55 116.96 2v3s h SER 465 Ca 0.11 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2v3s h SER 465 Cb 0.65 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 2v3s h SER 465 CO 0.05 0.65 0.40 1.56 -1.14 0.00 0.00 176.83 178.34 2v3s h GLN 466 N 1.06 1.23 -0.74 3.45 4.20 -0.76 -1.81 115.11 121.74 2v3s h GLN 466 Ca 0.29 -0.19 0.04 0.00 0.06 0.00 0.00 58.65 58.85 2v3s h GLN 466 Cb -0.12 -0.22 -0.05 0.00 0.30 0.00 0.00 27.48 27.39 2v3s h GLN 466 CO -0.06 0.95 0.45 0.93 -0.67 0.00 0.00 178.83 180.43 2v3s h GLU 467 N 1.22 0.84 -0.75 1.46 5.08 -0.65 0.88 114.58 122.66 2v3s h GLU 467 Ca 0.29 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2v3s h GLU 467 Cb 0.13 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 2v3s h GLU 467 CO -0.03 0.55 0.46 -0.07 -1.00 0.00 0.00 179.01 178.92 2v3s h LEU 468 N 0.86 0.89 -0.04 1.33 3.38 -0.43 -1.19 115.31 120.11 2v3s h LEU 468 Ca 0.31 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 2v3s h LEU 468 Cb 0.09 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2v3s h LEU 468 CO -0.14 0.68 -0.02 0.40 0.09 0.00 0.00 178.44 179.45 2v3s h ILE 469 N 1.02 1.31 0.00 1.22 2.04 -0.93 -1.12 117.51 121.05 2v3s h ILE 469 Ca 0.27 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 2v3s h ILE 469 Cb -0.05 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.91 2v3s h ILE 469 CO -0.05 0.26 -0.02 0.77 0.00 0.00 0.00 178.15 179.11 2v3s h SER 470 N -0.29 0.00 0.48 1.72 4.64 -0.76 0.00 113.55 119.34 2v3s h SER 470 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2v3s h SER 470 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2v3s h SER 470 CO 0.01 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 2v3s n ALA 471 N -2.49 2.36 -1.53 5.18 0.00 -0.46 -4.90 120.51 118.67 2v3s n ALA 471 Ca -0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 53.44 53.19 2v3s n ALA 471 Cb 0.11 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.09 2v3s n ALA 471 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2v3s n GLY 472 N 0.99 0.79 0.08 0.00 0.00 -0.01 -4.92 105.19 102.12 2v3s n GLY 472 Ca 0.13 -0.57 -0.01 0.00 0.00 0.00 0.00 46.02 45.57 2v3s n GLY 472 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2v3s n LEU 473 N -1.16 0.47 -4.10 0.99 4.77 -0.44 -4.91 117.00 112.61 2v3s n LEU 473 Ca -0.10 0.21 -0.21 0.00 -0.03 0.00 0.00 56.01 55.88 2v3s n LEU 473 Cb 0.39 0.18 -0.15 0.00 -2.33 0.00 0.00 43.42 41.51 2v3s n LEU 473 CO 0.14 0.22 -0.46 -0.69 -1.33 0.00 0.00 177.39 175.26 2v3s s VAL 474 N -2.91 1.05 0.27 4.08 1.01 -1.12 -4.98 120.40 117.80 2v3s s VAL 474 Ca -0.06 -0.68 -0.29 0.00 0.00 0.00 0.00 61.98 60.95 2v3s s VAL 474 Cb 0.09 -0.90 -0.10 0.00 0.00 0.00 0.00 36.38 35.47 2v3s s VAL 474 CO 0.83 0.21 1.29 -0.62 0.00 0.00 0.00 175.10 176.82 2v3s s ASP 475 N -0.54 6.88 0.57 3.32 -1.08 -1.26 -4.20 116.67 120.36 2v3s s ASP 475 Ca 0.04 2.52 0.27 0.00 -0.52 0.00 0.00 52.55 54.87 2v3s s ASP 475 Cb -0.06 -2.63 1.52 0.00 -1.46 0.00 0.00 42.92 40.30 2v3s s ASP 475 CO -0.00 -0.49 2.03 1.23 0.52 0.00 0.00 175.17 178.46 2v3s h GLY 476 N 4.31 0.00 2.00 2.66 0.00 -1.99 -0.40 103.07 109.66 2v3s h GLY 476 Ca -0.47 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2v3s h GLY 476 CO 0.71 0.00 -0.01 3.21 0.00 0.00 0.00 176.54 180.45 2v3s h ARG 477 N 0.00 0.00 -0.23 4.80 3.08 -1.99 -2.93 114.38 117.12 2v3s h ARG 477 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2v3s h ARG 477 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.81 2v3s h ARG 477 CO -0.00 0.01 0.00 -0.25 -1.07 0.00 0.00 179.97 178.66 2v3s n ASP 478 N -3.13 2.23 -0.10 7.04 8.00 -0.16 -4.55 116.55 125.89 2v3s n ASP 478 Ca -0.01 -1.81 -0.09 0.00 0.71 0.00 0.00 54.79 53.60 2v3s n ASP 478 Cb 0.20 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.13 2v3s n ASP 478 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2v3s h LEU 479 N 2.94 -1.16 -0.15 0.64 5.85 -1.64 -0.76 115.31 121.02 2v3s h LEU 479 Ca 0.00 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 2v3s h LEU 479 Cb 0.65 0.53 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 2v3s h LEU 479 CO 0.00 -0.34 0.08 0.58 -0.34 0.00 0.00 178.44 178.41 2v3s h VAL 480 N -0.30 1.12 -0.34 1.05 2.07 -1.87 -0.13 116.25 117.84 2v3s h VAL 480 Ca 0.15 -0.33 -0.15 0.00 0.82 0.00 0.00 66.70 67.19 2v3s h VAL 480 Cb 0.56 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2v3s h VAL 480 CO -0.52 0.11 -0.38 -0.29 0.02 0.00 0.00 177.57 176.51 2v3s h ILE 481 N 0.13 1.28 -0.29 4.57 6.09 -1.84 -1.05 117.51 126.41 2v3s h ILE 481 Ca 0.05 -1.55 -0.07 0.00 -1.37 0.00 0.00 64.86 61.92 2v3s h ILE 481 Cb 0.10 1.41 -0.01 0.00 0.47 0.00 0.00 36.82 38.80 2v3s h ILE 481 CO -0.01 0.51 -0.11 0.58 -3.07 0.00 0.00 178.15 176.06 2v3s h VAL 482 N 0.67 1.29 -0.63 2.19 2.07 -1.05 -1.75 116.25 119.04 2v3s h VAL 482 Ca 0.06 -1.17 0.05 0.00 0.82 0.00 0.00 66.70 66.46 2v3s h VAL 482 Cb 0.94 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.11 2v3s h VAL 482 CO 0.09 0.37 0.36 0.00 0.02 0.00 0.00 177.57 178.40 2v3s h ALA 483 N 0.76 0.84 -0.43 1.67 0.00 -0.96 0.22 119.26 121.36 2v3s h ALA 483 Ca 0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2v3s h ALA 483 Cb 0.61 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2v3s h ALA 483 CO 0.04 0.04 0.26 0.00 0.00 0.00 0.00 179.25 179.58 2v3s h ALA 484 N 1.32 0.55 -0.06 0.00 0.00 -1.05 -0.75 119.26 119.27 2v3s h ALA 484 Ca 0.28 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 2v3s h ALA 484 Cb 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2v3s h ALA 484 CO -0.16 0.05 -0.66 -0.91 0.00 0.00 0.00 179.25 177.57 2v3s h ASN 485 N 0.57 0.31 -0.49 0.00 4.21 -1.04 -1.86 115.58 117.28 2v3s h ASN 485 Ca 0.15 -0.19 -0.03 0.00 1.21 0.00 0.00 56.30 57.45 2v3s h ASN 485 Cb 0.01 -0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 37.10 2v3s h ASN 485 CO -0.03 0.88 0.18 0.25 -1.29 0.00 0.00 177.43 177.42 2v3s h LEU 486 N 0.19 0.68 -0.68 1.61 6.46 -0.40 -1.93 115.31 121.25 2v3s h LEU 486 Ca -0.01 -0.18 0.03 0.00 -0.12 0.00 0.00 57.88 57.60 2v3s h LEU 486 Cb 1.19 -0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 40.90 2v3s h LEU 486 CO 0.10 0.67 0.42 -0.61 -0.62 0.00 0.00 178.44 178.40 2v3s h GLN 487 N 0.65 0.79 -0.22 1.25 5.75 -0.96 -0.75 115.11 121.61 2v3s h GLN 487 Ca 0.16 -0.05 0.02 0.00 -0.15 0.00 0.00 58.65 58.64 2v3s h GLN 487 Cb 0.21 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 2v3s h GLN 487 CO -0.01 0.52 0.07 -0.22 -2.65 0.00 0.00 178.83 176.54 2v3s h LYS 488 N 0.81 0.16 -0.14 1.69 3.64 -1.02 -1.78 116.57 119.95 2v3s h LYS 488 Ca 0.27 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.47 2v3s h LYS 488 Cb 0.04 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2v3s h LYS 488 CO -0.11 0.11 -0.65 0.97 -2.27 0.00 0.00 179.45 177.49 2v3s h ILE 489 N 0.17 1.34 0.00 2.00 2.10 -1.10 -3.28 117.51 118.74 2v3s h ILE 489 Ca 0.10 -1.96 -0.15 0.00 1.08 0.00 0.00 64.86 63.93 2v3s h ILE 489 Cb 0.07 1.94 -0.02 0.00 -1.09 0.00 0.00 36.82 37.72 2v3s h ILE 489 CO -0.11 0.60 -0.70 1.62 -1.08 0.00 0.00 178.15 178.49 2v3s h VAL 490 N 0.38 1.43 -0.07 2.19 3.04 -0.97 -2.60 116.25 119.65 2v3s h VAL 490 Ca -0.02 -2.44 -0.19 0.00 -1.01 0.00 0.00 66.70 63.05 2v3s h VAL 490 Cb 1.22 2.34 -0.00 0.00 -2.01 0.00 0.00 31.29 32.83 2v3s h VAL 490 CO 0.12 0.68 -0.75 1.05 -1.01 0.00 0.00 177.57 177.66 2v3s h GLU 491 N 0.00 0.40 -2.49 4.17 4.11 -1.38 -3.36 114.58 116.03 2v3s h GLU 491 Ca -0.01 -0.34 -0.59 0.00 0.07 0.00 0.00 59.36 58.49 2v3s h GLU 491 Cb 1.28 0.07 -0.39 0.00 0.50 0.00 0.00 28.75 30.21 2v3s h GLU 491 CO 0.09 0.98 -0.87 0.39 0.07 0.00 0.00 179.01 179.67 2v3s n GLU 492 N -3.82 0.78 0.00 1.06 4.71 -1.24 -4.94 120.64 117.18 2v3s n GLU 492 Ca -0.04 -3.58 0.09 0.00 -0.01 0.00 0.00 57.16 53.61 2v3s n GLU 492 Cb 0.72 -1.80 0.41 0.00 -1.01 0.00 0.00 31.44 29.76 2v3s n GLU 492 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2v3s n PRO 493 N 2.35 0.04 0.09 3.49 -0.04 -0.98 -1.00 135.00 138.94 2v3s n PRO 493 Ca 0.26 0.17 -0.22 0.00 -0.04 0.00 0.00 63.50 63.67 2v3s n PRO 493 Cb 0.45 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.26 2v3s n PRO 493 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2v3s h GLN 494 N 0.00 0.40 0.00 0.54 -0.00 -1.92 -3.41 115.11 110.72 2v3s h GLN 494 Ca 0.00 -0.68 0.00 0.00 -0.00 0.00 0.00 58.65 57.97 2v3s h GLN 494 Cb 0.30 0.25 0.00 0.00 -0.00 0.00 0.00 27.48 28.03 2v3s h GLN 494 CO 0.00 1.32 0.00 0.43 -0.00 0.00 0.00 178.83 180.58 2v3s n SER 495 N -3.92 0.00 -4.56 0.06 7.64 -1.08 -4.71 113.62 107.05 2v3s n SER 495 Ca -0.17 0.59 -0.30 0.00 1.01 0.00 0.00 58.87 60.01 2v3s n SER 495 Cb 0.95 -0.47 -0.05 0.00 -1.01 0.00 0.00 64.21 63.64 2v3s n SER 495 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2v3s s ASN 496 N -2.66 5.42 0.25 6.43 0.01 -0.17 -4.79 114.94 119.43 2v3s s ASN 496 Ca 0.00 -0.93 0.13 0.00 -0.71 0.00 0.00 52.86 51.36 2v3s s ASN 496 Cb 0.00 -2.56 0.03 0.00 0.41 0.00 0.00 41.25 39.13 2v3s s ASN 496 CO 0.00 -2.51 1.42 0.03 -1.51 0.00 0.00 177.10 174.53 2v3s h ARG 497 N 10.83 0.00 -2.52 -0.60 2.47 -1.84 -3.43 114.38 119.29 2v3s h ARG 497 Ca 0.13 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.76 2v3s h ARG 497 Cb 1.00 0.00 -0.24 0.00 -1.65 0.00 0.00 29.97 29.08 2v3s h ARG 497 CO 1.26 0.61 -0.16 0.45 0.56 0.00 0.00 179.97 182.68 2v3s s SER 498 N -6.52 -0.55 -0.05 7.04 0.15 -1.26 -1.19 113.70 111.32 2v3s s SER 498 Ca 0.03 1.02 0.02 0.00 0.70 0.00 0.00 55.95 57.72 2v3s s SER 498 Cb 0.08 0.99 0.01 0.00 -1.71 0.00 0.00 66.02 65.39 2v3s s SER 498 CO 0.76 -0.18 -0.11 0.54 1.20 0.00 0.00 173.24 175.45 2v3s s VAL 499 N 0.66 1.02 -0.09 4.45 0.11 0.55 -5.00 120.40 122.10 2v3s s VAL 499 Ca -0.03 -0.42 0.02 0.00 -2.93 0.00 0.00 61.98 58.62 2v3s s VAL 499 Cb -0.05 -0.93 -0.02 0.00 -1.53 0.00 0.00 36.38 33.85 2v3s s VAL 499 CO -0.04 0.32 -0.16 -0.89 -3.33 0.00 0.00 175.10 171.00 2v3s s THR 500 N 0.59 2.84 0.01 5.04 2.01 -1.26 -0.85 115.64 124.02 2v3s s THR 500 Ca -0.12 -0.77 -0.10 0.00 0.31 0.00 0.00 61.69 61.01 2v3s s THR 500 Cb -0.14 -2.13 0.01 0.00 0.01 0.00 0.00 72.50 70.24 2v3s s THR 500 CO 0.03 0.56 0.21 0.72 -0.69 0.00 0.00 174.62 175.44 2v3s s PHE 501 N -0.12 -0.02 0.54 4.92 -0.71 -0.34 -4.99 117.98 117.25 2v3s s PHE 501 Ca -0.02 -0.06 -0.21 0.00 -1.04 0.00 0.00 56.93 55.60 2v3s s PHE 501 Cb -0.14 0.00 -0.05 0.00 -1.21 0.00 0.00 43.02 41.62 2v3s s PHE 501 CO 0.04 -0.36 1.29 0.15 -1.34 0.00 0.00 175.22 175.00 2v3s s LYS 502 N -1.71 3.23 -0.26 1.99 1.02 -1.26 -0.97 119.74 121.78 2v3s s LYS 502 Ca -0.12 2.07 -0.12 0.00 0.02 0.00 0.00 55.97 57.83 2v3s s LYS 502 Cb -0.05 -2.23 -0.05 0.00 -0.52 0.00 0.00 37.83 34.98 2v3s s LYS 502 CO 0.01 -1.07 0.24 -0.51 -0.92 0.00 0.00 175.35 173.10 2v3s s LEU 503 N -3.52 4.06 0.29 3.17 1.43 0.36 -4.80 118.68 119.67 2v3s s LEU 503 Ca 0.71 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.98 2v3s s LEU 503 Cb -0.36 -2.21 0.69 0.00 0.03 0.00 0.00 46.19 44.34 2v3s s LEU 503 CO 0.43 -0.05 1.76 0.00 0.23 0.00 0.00 176.35 178.72 2v3s h ALA 504 N 8.00 1.55 0.00 4.21 0.00 -1.87 -1.70 119.26 129.46 2v3s h ALA 504 Ca -0.35 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2v3s h ALA 504 Cb 1.18 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2v3s h ALA 504 CO 0.61 -0.10 -0.04 0.66 0.00 0.00 0.00 179.25 180.38 2v3s h SER 505 N 0.68 0.00 -0.18 0.00 4.64 -1.94 -2.93 113.55 113.81 2v3s h SER 505 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 2v3s h SER 505 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2v3s h SER 505 CO -0.40 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.22 2v3s n GLY 506 N -0.97 1.13 0.28 -0.77 0.00 -0.64 -4.52 105.19 99.70 2v3s n GLY 506 Ca -0.02 -0.66 0.03 0.00 0.00 0.00 0.00 46.02 45.36 2v3s n GLY 506 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2v3s h VAL 507 N 4.18 0.82 0.00 1.61 2.07 -1.48 -3.25 116.25 120.20 2v3s h VAL 507 Ca 0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2v3s h VAL 507 Cb 0.90 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2v3s h VAL 507 CO 0.00 0.11 0.00 1.21 0.02 0.00 0.00 177.57 178.91 2v3s n GLU 508 N -4.85 1.61 -1.18 1.57 4.07 -1.26 -4.77 120.64 115.82 2v3s n GLU 508 Ca 0.13 -1.05 -0.35 0.00 -0.06 0.00 0.00 57.16 55.83 2v3s n GLU 508 Cb 0.31 -0.85 -0.03 0.00 -0.06 0.00 0.00 31.44 30.81 2v3s n GLU 508 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2v3s n GLY 509 N -0.29 3.97 3.68 8.31 0.00 -1.23 -4.66 105.19 114.98 2v3s n GLY 509 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 2v3s n GLY 509 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2v3s n SER 510 N 3.66 0.00 -4.50 1.61 7.64 -1.26 -4.90 113.62 115.86 2v3s n SER 510 Ca 0.71 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 60.25 2v3s n SER 510 Cb 0.24 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.31 2v3s n SER 510 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2v3s s ASP 511 N 0.04 4.52 0.17 6.43 1.01 -1.26 -5.10 116.67 122.47 2v3s s ASP 511 Ca 0.00 -0.13 -0.30 0.00 0.71 0.00 0.00 52.55 52.82 2v3s s ASP 511 Cb 0.00 -1.44 -0.08 0.00 1.01 0.00 0.00 42.92 42.41 2v3s s ASP 511 CO 0.00 0.26 1.32 -0.63 0.21 0.00 0.00 175.17 176.33 2v3s s ILE 512 N -0.19 3.30 0.31 0.77 1.09 -1.26 -4.87 121.20 120.35 2v3s s ILE 512 Ca 0.02 1.02 -0.28 0.00 -1.10 0.00 0.00 60.65 60.31 2v3s s ILE 512 Cb -0.13 -3.65 -0.13 0.00 -1.06 0.00 0.00 42.46 37.49 2v3s s ILE 512 CO 0.03 0.13 1.19 -2.65 -0.10 0.00 0.00 174.94 173.53 2v3s n PRO 513 N 3.02 1.80 -3.36 2.79 -0.02 -1.26 -4.87 135.00 133.10 2v3s n PRO 513 Ca 0.07 0.63 -0.11 0.00 -2.02 0.00 0.00 63.50 62.08 2v3s n PRO 513 Cb 0.43 -2.13 -0.08 0.00 -0.02 0.00 0.00 33.50 31.69 2v3s n PRO 513 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2v3s s ASP 514 N -0.36 0.47 0.19 2.55 -1.08 0.59 -5.00 116.67 114.04 2v3s s ASP 514 Ca 0.58 0.05 -0.08 0.00 -0.52 0.00 0.00 52.55 52.59 2v3s s ASP 514 Cb -0.63 1.00 0.11 0.00 -1.46 0.00 0.00 42.92 41.94 2v3s s ASP 514 CO 0.60 -0.31 1.66 -2.24 0.52 0.00 0.00 175.17 175.39 2v3s h ASP 515 N 8.20 1.01 -0.70 -0.34 2.03 -1.95 -0.62 116.42 124.04 2v3s h ASP 515 Ca -0.18 -0.29 0.16 0.00 -0.73 0.00 0.00 57.03 55.99 2v3s h ASP 515 Cb 1.15 -0.27 -0.13 0.00 -0.83 0.00 0.00 39.33 39.24 2v3s h ASP 515 CO 0.28 1.07 -0.11 0.61 -1.03 0.00 0.00 179.24 180.05 2v3s n GLY 516 N -0.43 -1.11 0.00 7.15 0.00 -1.26 -1.93 105.19 107.62 2v3s n GLY 516 Ca 0.03 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.78 2v3s n GLY 516 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2v3s n LYS 517 N -5.08 2.29 -3.99 1.61 5.02 -1.01 -4.96 118.16 112.05 2v3s n LYS 517 Ca 0.13 -0.25 -0.34 0.00 -2.02 0.00 0.00 58.31 55.82 2v3s n LYS 517 Cb 0.41 -0.74 -0.01 0.00 -0.02 0.00 0.00 35.03 34.68 2v3s n LYS 517 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2v3s n LEU 518 N -0.40 -1.60 -4.35 -0.35 4.77 -0.80 -4.98 117.00 109.30 2v3s n LEU 518 Ca 0.00 -1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 54.47 2v3s n LEU 518 Cb 0.01 -1.98 -0.13 0.00 -2.33 0.00 0.00 43.42 38.99 2v3s n LEU 518 CO 0.00 0.56 -0.31 -0.63 -1.33 0.00 0.00 177.39 175.67 2v3s s ILE 519 N -3.80 3.81 -0.00 -0.08 1.01 -0.31 -4.42 121.20 117.41 2v3s s ILE 519 Ca 0.26 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.34 2v3s s ILE 519 Cb -0.12 -2.87 0.00 0.00 0.01 0.00 0.00 42.46 39.48 2v3s s ILE 519 CO 0.93 0.22 0.00 0.61 0.00 0.00 0.00 174.94 176.70 2v3s n GLY 520 N 4.85 0.30 3.14 6.18 0.00 -1.26 -0.30 105.19 118.10 2v3s n GLY 520 Ca -0.16 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 2v3s n GLY 520 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2v3s s PHE 521 N -1.59 0.85 0.26 1.61 0.40 -1.26 -0.49 117.98 117.76 2v3s s PHE 521 Ca 0.00 -0.79 0.02 0.00 -0.60 0.00 0.00 56.93 55.56 2v3s s PHE 521 Cb 0.00 -0.49 -0.05 0.00 0.51 0.00 0.00 43.02 42.99 2v3s s PHE 521 CO 0.00 -0.12 0.09 0.00 0.70 0.00 0.00 175.22 175.89 2v3s s ALA 522 N -2.95 1.77 -0.02 5.36 0.00 -0.14 -4.73 121.76 121.04 2v3s s ALA 522 Ca 0.06 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 50.15 2v3s s ALA 522 Cb 0.01 0.98 0.03 0.00 0.00 0.00 0.00 23.12 24.13 2v3s s ALA 522 CO -0.03 -0.43 0.01 -1.14 0.00 0.00 0.00 175.76 174.17 2v3s s GLN 523 N -4.01 0.10 -0.10 0.00 0.74 -0.33 -1.19 119.66 114.87 2v3s s GLN 523 Ca 0.37 0.12 -0.01 0.00 0.05 0.00 0.00 55.36 55.88 2v3s s GLN 523 Cb 0.08 -0.32 -0.03 0.00 1.10 0.00 0.00 33.01 33.84 2v3s s GLN 523 CO 0.13 -0.13 -0.04 -0.51 -0.55 0.00 0.00 175.29 174.19 2v3s s LEU 524 N 0.92 3.31 0.08 3.68 1.43 -0.03 -0.34 118.68 127.73 2v3s s LEU 524 Ca -0.08 -0.01 -0.09 0.00 -1.03 0.00 0.00 54.13 52.91 2v3s s LEU 524 Cb -0.12 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.35 2v3s s LEU 524 CO -0.02 0.30 0.21 -0.94 0.23 0.00 0.00 176.35 176.13 2v3s s SER 525 N -0.44 0.07 0.12 2.29 1.04 -0.34 -0.33 113.70 116.11 2v3s s SER 525 Ca 0.07 -0.55 -0.30 0.00 0.48 0.00 0.00 55.95 55.65 2v3s s SER 525 Cb -0.12 0.34 -0.06 0.00 0.10 0.00 0.00 66.02 66.27 2v3s s SER 525 CO 0.02 -0.69 0.95 -0.63 0.98 0.00 0.00 173.24 173.87 2v3s s ILE 526 N -3.51 4.46 -1.84 -1.02 -1.09 -0.33 -0.99 121.20 116.87 2v3s s ILE 526 Ca 0.02 2.05 0.00 0.00 -2.23 0.00 0.00 60.65 60.49 2v3s s ILE 526 Cb 0.03 -4.31 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 2v3s s ILE 526 CO -0.09 0.34 0.46 -0.24 -1.23 0.00 0.00 174.94 174.18