#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qoh s ASP 403 N 0.00 6.47 0.08 0.00 1.11 -1.26 -1.52 116.67 121.55 1qoh s ASP 403 Ca 0.00 -1.56 -0.18 0.00 0.18 0.00 0.00 52.55 50.99 1qoh s ASP 403 Cb 0.00 -2.46 -0.10 0.00 1.07 0.00 0.00 42.92 41.44 1qoh s ASP 403 CO 0.00 -1.31 1.44 0.00 1.18 0.00 0.00 175.17 176.48 1qoh s ALA 405 N -4.58 -0.83 -0.17 0.00 0.00 -1.21 -4.99 121.76 109.98 1qoh s ALA 405 Ca -0.13 0.08 -0.06 0.00 0.00 0.00 0.00 51.96 51.85 1qoh s ALA 405 Cb 0.07 0.41 0.08 0.00 0.00 0.00 0.00 23.12 23.68 1qoh s ALA 405 CO 0.78 -0.48 0.36 0.21 0.00 0.00 0.00 175.76 176.63 1qoh s LYS 406 N -2.82 0.26 0.00 0.00 2.20 -1.26 -1.16 119.74 116.97 1qoh s LYS 406 Ca -0.03 0.91 0.00 0.00 -0.36 0.00 0.00 55.97 56.49 1qoh s LYS 406 Cb -0.00 0.18 0.00 0.00 -1.51 0.00 0.00 37.83 36.50 1qoh s LYS 406 CO -0.05 -0.25 0.00 0.41 -0.36 0.00 0.00 175.35 175.10 1qoh n GLY 407 N 5.28 -0.85 3.84 5.54 0.00 -0.64 -4.75 105.19 113.60 1qoh n GLY 407 Ca -0.09 -1.11 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 1qoh n GLY 407 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qoh s LYS 408 N -1.79 4.02 -0.19 1.61 -0.14 -1.26 -1.19 119.74 120.80 1qoh s LYS 408 Ca 0.00 0.94 -0.29 0.00 -1.36 0.00 0.00 55.97 55.26 1qoh s LYS 408 Cb 0.00 -2.19 -0.00 0.00 -1.68 0.00 0.00 37.83 33.96 1qoh s LYS 408 CO 0.00 -0.15 1.13 0.42 -0.76 0.00 0.00 175.35 175.99 1qoh s ILE 409 N -2.43 4.52 0.02 2.17 1.01 -1.26 -4.46 121.20 120.78 1qoh s ILE 409 Ca 0.59 1.84 -0.21 0.00 0.00 0.00 0.00 60.65 62.87 1qoh s ILE 409 Cb -0.10 -4.19 -0.17 0.00 0.01 0.00 0.00 42.46 38.02 1qoh s ILE 409 CO 0.25 -0.15 1.27 -0.08 0.00 0.00 0.00 174.94 176.23 1qoh h GLU 410 N 7.71 0.33 -2.80 2.79 4.81 -0.91 -3.48 114.58 123.04 1qoh h GLU 410 Ca -0.23 -0.21 0.03 0.00 -0.13 0.00 0.00 59.36 58.82 1qoh h GLU 410 Cb 1.08 0.03 -0.12 0.00 0.63 0.00 0.00 28.75 30.37 1qoh h GLU 410 CO 0.97 0.81 0.29 -0.59 -0.73 0.00 0.00 179.01 179.76 1qoh s PHE 411 N -4.01 -0.44 0.20 0.92 -0.12 -1.25 -5.00 117.98 108.28 1qoh s PHE 411 Ca -0.14 0.23 0.06 0.00 -0.05 0.00 0.00 56.93 57.02 1qoh s PHE 411 Cb 0.04 0.57 -0.05 0.00 -0.63 0.00 0.00 43.02 42.96 1qoh s PHE 411 CO 0.76 -0.81 -0.09 -1.54 -0.05 0.00 0.00 175.22 173.49 1qoh s SER 412 N -2.71 2.15 -0.16 1.98 1.04 -1.26 -1.55 113.70 113.18 1qoh s SER 412 Ca 0.03 -1.08 -0.09 0.00 0.48 0.00 0.00 55.95 55.30 1qoh s SER 412 Cb -0.01 -0.06 0.06 0.00 0.10 0.00 0.00 66.02 66.10 1qoh s SER 412 CO -0.10 -0.32 0.39 -0.75 0.98 0.00 0.00 173.24 173.45 1qoh s LYS 413 N -3.74 0.37 -0.19 4.02 2.20 0.19 -4.98 119.74 117.60 1qoh s LYS 413 Ca 0.22 0.78 -0.18 0.00 -0.36 0.00 0.00 55.97 56.43 1qoh s LYS 413 Cb 0.02 -0.02 -0.03 0.00 -1.51 0.00 0.00 37.83 36.29 1qoh s LYS 413 CO 0.05 -0.16 0.49 -0.47 -0.36 0.00 0.00 175.35 174.90 1qoh s TYR 414 N 1.46 3.39 0.29 4.03 6.14 -1.26 -1.12 117.35 130.29 1qoh s TYR 414 Ca -0.09 0.76 0.03 0.00 0.64 0.00 0.00 57.07 58.41 1qoh s TYR 414 Cb -0.09 -2.63 -0.03 0.00 0.42 0.00 0.00 41.96 39.64 1qoh s TYR 414 CO -0.12 -0.05 0.45 -0.80 0.64 0.00 0.00 175.55 175.67 1qoh s ASN 415 N 1.06 6.27 0.55 4.32 0.01 -0.47 -5.00 114.94 121.68 1qoh s ASN 415 Ca 0.23 0.20 0.27 0.00 -0.71 0.00 0.00 52.86 52.85 1qoh s ASN 415 Cb -0.15 -1.87 1.61 0.00 0.41 0.00 0.00 41.25 41.25 1qoh s ASN 415 CO 0.09 -0.20 2.18 -0.08 -1.51 0.00 0.00 177.10 177.58 1qoh h GLU 416 N 0.96 0.00 -0.39 -0.60 4.81 -1.97 -1.27 114.58 116.12 1qoh h GLU 416 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1qoh h GLU 416 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1qoh h GLU 416 CO 0.60 0.05 0.00 -0.40 -0.73 0.00 0.00 179.01 178.53 1qoh n ASP 417 N -3.89 1.86 -0.25 1.04 5.68 -1.26 -4.88 116.55 114.84 1qoh n ASP 417 Ca -0.03 -2.06 -0.03 0.00 -0.50 0.00 0.00 54.79 52.17 1qoh n ASP 417 Cb 0.14 -0.27 -0.01 0.00 -1.14 0.00 0.00 41.12 39.84 1qoh n ASP 417 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1qoh n ASN 418 N 0.38 -3.83 -4.96 -1.12 3.02 -0.48 -5.03 115.26 103.24 1qoh n ASN 418 Ca 0.10 0.08 -0.23 0.00 -0.03 0.00 0.00 54.58 54.51 1qoh n ASN 418 Cb 0.32 -1.62 0.04 0.00 -0.61 0.00 0.00 39.78 37.92 1qoh n ASN 418 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1qoh s THR 419 N -1.98 2.86 -0.06 3.41 -4.23 -1.26 -4.89 115.64 109.50 1qoh s THR 419 Ca 0.00 -0.52 0.02 0.00 -1.18 0.00 0.00 61.69 60.00 1qoh s THR 419 Cb 0.00 -3.10 0.02 0.00 1.34 0.00 0.00 72.50 70.75 1qoh s THR 419 CO 0.00 -0.08 -0.10 0.12 -0.54 0.00 0.00 174.62 174.02 1qoh s PHE 420 N -2.83 1.30 -0.04 3.99 5.36 -0.29 -1.36 117.98 124.11 1qoh s PHE 420 Ca 0.56 -0.48 0.02 0.00 -0.96 0.00 0.00 56.93 56.08 1qoh s PHE 420 Cb -0.10 -0.99 -0.03 0.00 -0.34 0.00 0.00 43.02 41.56 1qoh s PHE 420 CO 0.40 -0.27 -0.07 0.99 -1.46 0.00 0.00 175.22 174.81 1qoh s THR 421 N 0.77 3.66 0.05 0.12 2.01 -0.27 -0.51 115.64 121.46 1qoh s THR 421 Ca -0.13 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 61.29 1qoh s THR 421 Cb -0.15 -2.53 -0.02 0.00 0.01 0.00 0.00 72.50 69.80 1qoh s THR 421 CO 0.02 0.51 -0.12 0.68 -0.69 0.00 0.00 174.62 175.02 1qoh s VAL 422 N -0.89 0.91 -0.24 3.82 -7.23 0.09 -0.64 120.40 116.22 1qoh s VAL 422 Ca 0.14 -1.11 -0.03 0.00 -1.81 0.00 0.00 61.98 59.17 1qoh s VAL 422 Cb -0.11 -0.88 0.01 0.00 0.56 0.00 0.00 36.38 35.96 1qoh s VAL 422 CO 0.04 -0.20 -0.04 -0.75 -0.31 0.00 0.00 175.10 173.84 1qoh s LYS 423 N -1.48 3.10 -0.08 4.82 2.20 -0.60 -1.10 119.74 126.61 1qoh s LYS 423 Ca -0.03 -0.81 0.02 0.00 -0.36 0.00 0.00 55.97 54.79 1qoh s LYS 423 Cb -0.09 -3.02 0.02 0.00 -1.51 0.00 0.00 37.83 33.22 1qoh s LYS 423 CO 0.01 -0.31 -0.11 0.08 -0.36 0.00 0.00 175.35 174.66 1qoh s VAL 424 N 1.41 1.11 -1.35 4.02 1.01 -0.05 -0.12 120.40 126.43 1qoh s VAL 424 Ca 0.03 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.51 1qoh s VAL 424 Cb -0.15 -1.04 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1qoh s VAL 424 CO -0.04 0.36 1.07 -1.20 0.00 0.00 0.00 175.10 175.29 1qoh n SER 425 N 4.07 -4.69 0.00 3.32 7.64 -1.26 -2.09 113.62 120.61 1qoh n SER 425 Ca -0.21 -0.62 0.00 0.00 1.01 0.00 0.00 58.87 59.05 1qoh n SER 425 Cb 0.51 -4.79 0.00 0.00 -1.01 0.00 0.00 64.21 58.92 1qoh n SER 425 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qoh n GLY 426 N -1.72 1.44 3.45 0.23 0.00 -1.26 -4.99 105.19 102.34 1qoh n GLY 426 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 1qoh n GLY 426 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qoh s ARG 427 N -0.14 1.99 -0.11 1.61 0.52 -0.89 -5.05 118.95 116.88 1qoh s ARG 427 Ca 0.00 -1.03 -0.07 0.00 -0.52 0.00 0.00 55.73 54.11 1qoh s ARG 427 Cb 0.00 -2.15 -0.04 0.00 0.52 0.00 0.00 34.95 33.28 1qoh s ARG 427 CO 0.00 0.53 0.15 -1.21 0.02 0.00 0.00 175.30 174.79 1qoh s GLU 428 N -1.52 3.46 0.00 3.54 2.02 -1.26 -0.88 118.70 124.06 1qoh s GLU 428 Ca 0.15 -0.12 0.00 0.00 0.02 0.00 0.00 54.97 55.02 1qoh s GLU 428 Cb -0.10 -3.18 -0.00 0.00 0.10 0.00 0.00 34.13 30.94 1qoh s GLU 428 CO 0.06 0.77 -0.02 0.71 0.02 0.00 0.00 175.26 176.79 1qoh s TYR 429 N -1.05 0.18 0.29 1.61 2.02 -0.26 0.68 117.35 120.81 1qoh s TYR 429 Ca 0.16 -0.11 0.12 0.00 -0.37 0.00 0.00 57.07 56.87 1qoh s TYR 429 Cb -0.12 -0.11 -0.05 0.00 -0.40 0.00 0.00 41.96 41.27 1qoh s TYR 429 CO 0.05 -0.03 -0.18 1.67 -1.57 0.00 0.00 175.55 175.49 1qoh s TRP 430 N -0.27 2.30 0.03 2.71 1.48 -0.82 -0.73 118.94 123.63 1qoh s TRP 430 Ca -0.02 -0.36 -0.04 0.00 -1.06 0.00 0.00 56.10 54.62 1qoh s TRP 430 Cb -0.02 -1.05 -0.01 0.00 -1.16 0.00 0.00 33.47 31.23 1qoh s TRP 430 CO -0.00 0.70 0.06 -0.08 -4.06 0.00 0.00 176.95 173.56 1qoh s THR 431 N -2.53 0.12 -0.59 0.66 -1.32 0.33 -1.22 115.64 111.09 1qoh s THR 431 Ca 0.30 -1.00 0.12 0.00 -1.21 0.00 0.00 61.69 59.91 1qoh s THR 431 Cb -0.04 -0.65 0.36 0.00 -1.51 0.00 0.00 72.50 70.66 1qoh s THR 431 CO 0.15 -0.55 1.29 -0.46 -2.21 0.00 0.00 174.62 172.84 1qoh n ASN 432 N 1.12 3.17 -4.46 8.08 0.23 -1.26 -1.14 115.26 121.00 1qoh n ASN 432 Ca -0.21 -2.38 -0.43 0.00 -0.53 0.00 0.00 54.58 51.04 1qoh n ASN 432 Cb 0.57 -0.33 -0.04 0.00 -2.08 0.00 0.00 39.78 37.90 1qoh n ASN 432 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1qoh s ARG 433 N -1.67 3.12 0.58 -3.83 1.81 -1.26 -4.90 118.95 112.79 1qoh s ARG 433 Ca 0.28 -0.79 0.29 0.00 -1.72 0.00 0.00 55.73 53.79 1qoh s ARG 433 Cb 0.19 -4.23 1.48 0.00 -0.45 0.00 0.00 34.95 31.94 1qoh s ARG 433 CO 0.12 -1.84 1.91 0.11 -0.68 0.00 0.00 175.30 174.92 1qoh h TRP 434 N 9.60 0.00 -0.03 -0.53 5.08 -1.91 0.10 115.95 128.27 1qoh h TRP 434 Ca -0.29 0.00 -0.04 0.00 1.08 0.00 0.00 58.89 59.65 1qoh h TRP 434 Cb 1.07 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.22 1qoh h TRP 434 CO 0.98 0.00 -0.17 -0.91 -1.28 0.00 0.00 178.44 177.06 1qoh h ASN 435 N 0.00 0.04 0.49 0.11 4.21 -2.02 -2.94 115.58 115.47 1qoh h ASN 435 Ca 0.23 -0.01 -0.13 0.00 1.21 0.00 0.00 56.30 57.61 1qoh h ASN 435 Cb 1.20 -0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 38.37 1qoh h ASN 435 CO -0.00 0.21 -0.57 -0.07 -1.29 0.00 0.00 177.43 175.70 1qoh h LEU 436 N 0.04 0.10 -0.64 1.61 3.38 -1.38 -3.37 115.31 115.05 1qoh h LEU 436 Ca 0.01 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 57.99 1qoh h LEU 436 Cb 0.32 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 40.94 1qoh h LEU 436 CO 0.02 0.65 -0.56 1.56 0.09 0.00 0.00 178.44 180.20 1qoh h GLN 437 N 0.07 -0.23 -0.39 1.13 4.20 -1.61 0.36 115.11 118.64 1qoh h GLN 437 Ca -0.00 0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 1qoh h GLN 437 Cb 1.03 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.85 1qoh h GLN 437 CO 0.08 -0.16 0.01 -1.00 -0.67 0.00 0.00 178.83 177.10 1qoh h PRO 438 N -0.24 0.60 -0.41 1.46 0.13 -1.78 -0.87 132.00 130.89 1qoh h PRO 438 Ca 0.11 -0.13 -0.06 0.00 -0.87 0.00 0.00 66.00 65.05 1qoh h PRO 438 Cb 0.53 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.56 1qoh h PRO 438 CO -0.73 0.62 0.02 -0.07 -0.23 0.00 0.00 178.00 177.61 1qoh h LEU 439 N 0.58 0.69 -0.33 1.56 3.38 -1.30 -1.39 115.31 118.49 1qoh h LEU 439 Ca 0.12 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1qoh h LEU 439 Cb 0.35 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1qoh h LEU 439 CO 0.01 0.81 0.04 -0.07 0.09 0.00 0.00 178.44 179.32 1qoh h LEU 440 N 0.54 0.54 -0.97 1.67 3.38 -0.13 -2.19 115.31 118.16 1qoh h LEU 440 Ca 0.12 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1qoh h LEU 440 Cb 0.44 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1qoh h LEU 440 CO 0.02 0.68 0.56 -0.61 0.09 0.00 0.00 178.44 179.18 1qoh h GLN 441 N 0.39 1.28 -0.70 1.13 4.15 -1.00 -0.40 115.11 119.96 1qoh h GLN 441 Ca 0.10 -0.12 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 1qoh h GLN 441 Cb 0.37 -0.27 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 1qoh h GLN 441 CO 0.01 0.89 0.42 0.77 -1.93 0.00 0.00 178.83 179.00 1qoh h SER 442 N 1.30 0.84 -0.64 -0.69 0.02 -1.18 -0.92 113.55 112.28 1qoh h SER 442 Ca 0.34 -0.06 0.04 0.00 -0.84 0.00 0.00 61.79 61.27 1qoh h SER 442 Cb -0.05 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 62.23 1qoh h SER 442 CO -0.06 0.65 0.38 0.00 -1.14 0.00 0.00 176.83 176.66 1qoh h ALA 443 N 1.22 0.84 -0.46 3.77 0.00 -0.69 -0.64 119.26 123.29 1qoh h ALA 443 Ca 0.25 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1qoh h ALA 443 Cb -0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1qoh h ALA 443 CO -0.05 0.10 0.07 0.37 0.00 0.00 0.00 179.25 179.74 1qoh h GLN 444 N 0.72 0.71 -0.39 0.00 4.15 -0.52 -1.20 115.11 118.59 1qoh h GLN 444 Ca 0.27 -0.15 -0.13 0.00 0.77 0.00 0.00 58.65 59.41 1qoh h GLN 444 Cb 0.08 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 1qoh h GLN 444 CO -0.13 0.67 -0.28 -0.07 -1.93 0.00 0.00 178.83 177.09 1qoh h LEU 445 N 0.68 0.86 -1.53 -2.39 3.38 0.21 -3.12 115.31 113.40 1qoh h LEU 445 Ca 0.15 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1qoh h LEU 445 Cb 0.32 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1qoh h LEU 445 CO 0.00 1.08 0.00 0.35 0.09 0.00 0.00 178.44 179.96 1qoh n THR 446 N -4.09 0.11 -3.31 0.22 -2.24 -0.51 -4.95 114.28 99.51 1qoh n THR 446 Ca -0.01 -0.43 -0.18 0.00 -2.27 0.00 0.00 64.05 61.17 1qoh n THR 446 Cb 0.47 0.90 0.06 0.00 -2.10 0.00 0.00 70.33 69.66 1qoh n THR 446 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qoh n GLY 447 N 1.28 -0.16 3.81 3.38 0.00 -0.79 -4.99 105.19 107.71 1qoh n GLY 447 Ca 0.17 0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1qoh n GLY 447 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1qoh s MET 448 N -5.97 3.16 -0.19 1.61 -1.94 -0.52 -4.94 119.30 110.50 1qoh s MET 448 Ca 0.43 1.09 -0.20 0.00 -1.71 0.00 0.00 55.69 55.30 1qoh s MET 448 Cb -0.19 -2.02 -0.03 0.00 2.01 0.00 0.00 34.83 34.61 1qoh s MET 448 CO 0.54 -0.93 0.61 0.99 -0.01 0.00 0.00 175.02 176.22 1qoh s THR 449 N -2.72 5.04 0.11 2.05 2.01 -1.26 -4.42 115.64 116.46 1qoh s THR 449 Ca 0.61 1.15 0.07 0.00 0.31 0.00 0.00 61.69 63.82 1qoh s THR 449 Cb -0.15 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 1qoh s THR 449 CO 0.45 0.13 -0.08 0.68 -0.69 0.00 0.00 174.62 175.11 1qoh s VAL 450 N 1.83 3.48 -0.21 3.82 -7.23 -0.33 -0.23 120.40 121.53 1qoh s VAL 450 Ca 0.28 -1.27 0.02 0.00 -1.81 0.00 0.00 61.98 59.20 1qoh s VAL 450 Cb -0.16 -2.65 0.04 0.00 0.56 0.00 0.00 36.38 34.17 1qoh s VAL 450 CO 0.10 0.08 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.93 1qoh s THR 451 N -1.30 2.02 -0.09 5.32 2.01 0.10 -1.62 115.64 122.08 1qoh s THR 451 Ca 0.23 -1.18 -0.27 0.00 0.31 0.00 0.00 61.69 60.78 1qoh s THR 451 Cb -0.11 -1.97 -0.02 0.00 0.01 0.00 0.00 72.50 70.41 1qoh s THR 451 CO 0.15 0.29 0.87 -0.63 -0.69 0.00 0.00 174.62 174.61 1qoh s ILE 452 N 1.25 4.89 -0.17 1.82 -1.09 -0.31 -1.64 121.20 125.95 1qoh s ILE 452 Ca -0.01 1.78 0.01 0.00 -2.23 0.00 0.00 60.65 60.19 1qoh s ILE 452 Cb -0.16 -4.19 0.01 0.00 -1.58 0.00 0.00 42.46 36.54 1qoh s ILE 452 CO -0.09 0.10 -0.17 -0.63 -1.23 0.00 0.00 174.94 172.91 1qoh s ILE 453 N 1.56 2.37 0.34 2.92 1.01 -0.83 -0.61 121.20 127.96 1qoh s ILE 453 Ca 0.43 -0.85 -0.17 0.00 0.00 0.00 0.00 60.65 60.06 1qoh s ILE 453 Cb -0.18 -2.00 0.04 0.00 0.01 0.00 0.00 42.46 40.33 1qoh s ILE 453 CO 0.18 0.52 0.75 -0.55 0.00 0.00 0.00 174.94 175.85 1qoh s SER 454 N 1.08 -0.06 0.02 3.58 0.15 -0.57 -3.84 113.70 114.05 1qoh s SER 454 Ca -0.00 -0.97 0.14 0.00 0.70 0.00 0.00 55.95 55.82 1qoh s SER 454 Cb -0.14 0.80 -0.18 0.00 -1.71 0.00 0.00 66.02 64.78 1qoh s SER 454 CO -0.06 -1.55 0.79 0.78 1.20 0.00 0.00 173.24 174.40 1qoh h ASN 455 N 2.01 0.00 -3.39 5.45 -0.26 -1.88 -1.15 115.58 116.36 1qoh h ASN 455 Ca -0.27 0.00 -0.67 0.00 -0.56 0.00 0.00 56.30 54.80 1qoh h ASN 455 Cb 1.25 0.00 -0.33 0.00 -1.06 0.00 0.00 38.32 38.18 1qoh h ASN 455 CO 0.34 0.82 -0.78 0.42 -1.06 0.00 0.00 177.43 177.17 1qoh s THR 456 N -2.74 2.65 -2.34 2.81 -4.23 -1.26 -4.90 115.64 105.63 1qoh s THR 456 Ca -0.03 -0.97 0.22 0.00 -1.18 0.00 0.00 61.69 59.73 1qoh s THR 456 Cb 0.08 -2.28 0.40 0.00 1.34 0.00 0.00 72.50 72.04 1qoh s THR 456 CO 0.82 0.32 1.36 0.00 -0.54 0.00 0.00 174.62 176.57 1qoh s SER 458 N -1.44 6.87 0.22 0.00 1.04 -1.26 -4.93 113.70 114.20 1qoh s SER 458 Ca 0.36 2.08 -0.31 0.00 0.48 0.00 0.00 55.95 58.56 1qoh s SER 458 Cb 0.21 -2.59 -0.15 0.00 0.10 0.00 0.00 66.02 63.59 1qoh s SER 458 CO 0.30 -0.42 1.15 -0.24 0.98 0.00 0.00 173.24 175.01 1qoh n SER 459 N 0.19 1.52 0.00 7.02 2.88 -1.26 -1.90 113.62 122.08 1qoh n SER 459 Ca 0.04 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 1qoh n SER 459 Cb 0.49 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 1qoh n SER 459 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1qoh n GLY 460 N 1.78 0.66 3.89 0.46 0.00 0.21 -4.90 105.19 107.29 1qoh n GLY 460 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1qoh n GLY 460 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qoh s SER 461 N -2.81 6.38 0.50 1.61 0.01 -0.80 -4.80 113.70 113.80 1qoh s SER 461 Ca 0.00 1.09 -0.07 0.00 1.31 0.00 0.00 55.95 58.28 1qoh s SER 461 Cb 0.00 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 1qoh s SER 461 CO 0.00 -0.53 0.83 -0.83 0.41 0.00 0.00 173.24 173.12 1qoh s GLY 462 N -3.66 1.57 0.10 3.44 0.00 -1.26 -1.95 107.32 105.56 1qoh s GLY 462 Ca 0.50 -0.39 -0.16 0.00 0.00 0.00 0.00 44.72 44.67 1qoh s GLY 462 CO 0.39 -0.20 0.39 -0.11 0.00 0.00 0.00 173.10 173.57 1qoh s PHE 463 N -2.80 -0.19 0.00 1.90 -0.71 -0.36 -4.84 117.98 110.98 1qoh s PHE 463 Ca 0.49 -0.05 0.00 0.00 -1.04 0.00 0.00 56.93 56.33 1qoh s PHE 463 Cb -0.10 0.22 0.00 0.00 -1.21 0.00 0.00 43.02 41.93 1qoh s PHE 463 CO 0.45 -0.65 0.59 0.00 -1.34 0.00 0.00 175.22 174.28 1qoh n ALA 464 N 0.01 1.65 -3.33 1.99 0.00 -1.26 -4.37 120.51 115.20 1qoh n ALA 464 Ca -0.17 -0.44 -0.16 0.00 0.00 0.00 0.00 53.44 52.67 1qoh n ALA 464 Cb 0.62 -0.17 -0.15 0.00 0.00 0.00 0.00 19.45 19.75 1qoh n ALA 464 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1qoh s GLU 465 N 0.00 0.33 -0.16 0.00 2.12 -1.25 -5.09 118.70 114.65 1qoh s GLU 465 Ca 0.00 -0.02 -0.21 0.00 0.36 0.00 0.00 54.97 55.10 1qoh s GLU 465 Cb 0.00 -0.41 0.05 0.00 0.26 0.00 0.00 34.13 34.03 1qoh s GLU 465 CO 0.00 -0.04 0.54 0.54 -0.54 0.00 0.00 175.26 175.76 1qoh s VAL 466 N 0.55 0.01 -0.09 3.70 0.11 -1.26 -1.97 120.40 121.44 1qoh s VAL 466 Ca -0.06 -0.06 0.00 0.00 -2.93 0.00 0.00 61.98 58.93 1qoh s VAL 466 Cb -0.09 -0.79 -0.03 0.00 -1.53 0.00 0.00 36.38 33.95 1qoh s VAL 466 CO -0.01 -0.03 -0.08 -1.58 -3.33 0.00 0.00 175.10 170.07 1qoh s GLN 467 N -0.17 2.99 -0.26 1.54 0.74 -0.65 -4.94 119.66 118.90 1qoh s GLN 467 Ca -0.04 -0.57 -0.06 0.00 0.05 0.00 0.00 55.36 54.74 1qoh s GLN 467 Cb -0.03 -2.64 -0.00 0.00 1.10 0.00 0.00 33.01 31.43 1qoh s GLN 467 CO 0.03 0.52 0.04 -0.06 -0.55 0.00 0.00 175.29 175.27 1qoh s PHE 468 N -0.42 3.08 -0.30 1.67 0.08 -1.26 -0.72 117.98 120.11 1qoh s PHE 468 Ca 0.06 -0.85 0.02 0.00 0.12 0.00 0.00 56.93 56.28 1qoh s PHE 468 Cb -0.12 -2.20 0.02 0.00 -0.57 0.00 0.00 43.02 40.14 1qoh s PHE 468 CO 0.02 -0.52 0.58 0.09 -0.10 0.00 0.00 175.22 175.29