#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jgx n ARG 387 N 0.00 0.76 -1.91 3.23 3.00 -1.26 -0.40 116.66 120.08 2jgx n ARG 387 Ca 0.00 -0.15 -0.02 0.00 -0.01 0.00 0.00 57.85 57.67 2jgx n ARG 387 Cb 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 32.46 31.94 2jgx n ARG 387 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2jgx n LYS 388 N 0.12 -0.69 -2.88 5.56 4.81 -1.16 -3.50 118.16 120.42 2jgx n LYS 388 Ca 0.01 0.98 -0.29 0.00 -0.87 0.00 0.00 58.31 58.14 2jgx n LYS 388 Cb 0.06 -2.76 -0.02 0.00 0.02 0.00 0.00 35.03 32.32 2jgx n LYS 388 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jgx s TYR 390 N -2.41 2.62 -0.18 0.00 5.04 -1.26 -1.75 117.35 119.41 2jgx s TYR 390 Ca 0.49 -1.08 -0.28 0.00 -2.44 0.00 0.00 57.07 53.76 2jgx s TYR 390 Cb -0.10 -1.76 -0.00 0.00 0.35 0.00 0.00 41.96 40.44 2jgx s TYR 390 CO 0.34 -0.45 0.97 0.12 -1.34 0.00 0.00 175.55 175.19 2jgx s PHE 391 N 0.48 3.41 0.80 4.97 2.19 -0.41 -4.97 117.98 124.45 2jgx s PHE 391 Ca -0.15 1.44 -0.10 0.00 0.33 0.00 0.00 56.93 58.45 2jgx s PHE 391 Cb -0.17 -3.18 0.10 0.00 -1.31 0.00 0.00 43.02 38.47 2jgx s PHE 391 CO 0.06 -0.35 1.14 -1.25 1.83 0.00 0.00 175.22 176.65 2jgx s PRO 392 N 2.59 1.73 -0.18 10.12 0.04 -1.26 -2.86 135.00 145.18 2jgx s PRO 392 Ca 0.44 -0.21 -0.24 0.00 0.04 0.00 0.00 61.00 61.03 2jgx s PRO 392 Cb -0.16 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.33 2jgx s PRO 392 CO 0.11 -1.65 0.77 -0.47 0.04 0.00 0.00 177.00 175.80 2jgx s TYR 393 N -3.51 3.40 -0.28 0.56 5.04 -1.26 -4.45 117.35 116.85 2jgx s TYR 393 Ca 0.64 1.14 -0.15 0.00 -2.44 0.00 0.00 57.07 56.27 2jgx s TYR 393 Cb -0.09 -2.95 -0.03 0.00 0.35 0.00 0.00 41.96 39.24 2jgx s TYR 393 CO 0.48 -0.23 0.38 -0.51 -1.34 0.00 0.00 175.55 174.33 2jgx s LEU 394 N 2.12 4.08 0.16 6.97 2.01 -1.26 -4.95 118.68 127.81 2jgx s LEU 394 Ca 0.35 0.24 0.04 0.00 0.01 0.00 0.00 54.13 54.77 2jgx s LEU 394 Cb -0.16 -2.42 -0.04 0.00 0.01 0.00 0.00 46.19 43.57 2jgx s LEU 394 CO 0.11 -0.20 1.36 -0.08 1.01 0.00 0.00 176.35 178.55 2jgx h GLU 395 N 8.20 0.14 -0.72 1.70 4.81 -1.96 -3.10 114.58 123.65 2jgx h GLU 395 Ca -0.31 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2jgx h GLU 395 Cb 1.16 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2jgx h GLU 395 CO 0.65 0.95 0.00 0.09 -0.73 0.00 0.00 179.01 179.97 2jgx n ASN 396 N -3.59 4.00 -4.11 1.04 4.13 -1.26 -4.96 115.26 110.50 2jgx n ASN 396 Ca -0.03 -2.03 -0.23 0.00 1.68 0.00 0.00 54.58 53.96 2jgx n ASN 396 Cb 0.84 -0.49 -0.09 0.00 -1.54 0.00 0.00 39.78 38.50 2jgx n ASN 396 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2jgx s GLY 397 N -0.99 2.39 -0.44 7.41 0.00 -1.17 -1.31 107.32 113.20 2jgx s GLY 397 Ca 0.49 -1.51 -0.20 0.00 0.00 0.00 0.00 44.72 43.49 2jgx s GLY 397 CO 0.32 -1.76 0.60 -0.19 0.00 0.00 0.00 173.10 172.08 2jgx s TYR 398 N -3.33 3.09 -0.05 1.90 1.51 0.48 -4.71 117.35 116.24 2jgx s TYR 398 Ca 0.29 -0.12 -0.05 0.00 -1.01 0.00 0.00 57.07 56.18 2jgx s TYR 398 Cb 0.04 -3.26 -0.18 0.00 -0.11 0.00 0.00 41.96 38.45 2jgx s TYR 398 CO 0.16 -0.84 3.24 0.27 -1.11 0.00 0.00 175.55 177.27 2jgx n ASN 399 N 6.13 5.39 0.08 2.29 0.23 -1.26 -4.37 115.26 123.75 2jgx n ASN 399 Ca -0.03 -2.54 0.01 0.00 -0.53 0.00 0.00 54.58 51.49 2jgx n ASN 399 Cb 0.48 -1.35 0.34 0.00 -2.08 0.00 0.00 39.78 37.17 2jgx n ASN 399 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2jgx h GLN 400 N 2.62 0.33 -0.00 -3.83 4.20 -1.92 -2.72 115.11 113.78 2jgx h GLN 400 Ca 0.18 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2jgx h GLN 400 Cb 1.35 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.09 2jgx h GLN 400 CO 0.26 0.47 -0.74 0.09 -0.67 0.00 0.00 178.83 178.24 2jgx n ASN 401 N -4.24 0.87 -4.72 1.46 3.02 -1.26 -4.92 115.26 105.47 2jgx n ASN 401 Ca -0.00 -0.74 -0.42 0.00 -0.03 0.00 0.00 54.58 53.39 2jgx n ASN 401 Cb 0.29 0.63 -0.03 0.00 -0.61 0.00 0.00 39.78 40.07 2jgx n ASN 401 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jgx n TYR 402 N -1.36 2.76 -0.24 3.10 9.36 -1.03 -1.44 117.16 128.31 2jgx n TYR 402 Ca 0.05 0.02 0.00 0.00 3.32 0.00 0.00 57.90 61.30 2jgx n TYR 402 Cb 0.34 -2.68 0.00 0.00 -0.63 0.00 0.00 39.34 36.37 2jgx n TYR 402 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2jgx n GLY 403 N 4.00 0.75 3.79 2.98 0.00 -1.13 -5.03 105.19 110.55 2jgx n GLY 403 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 2jgx n GLY 403 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jgx s ARG 404 N -0.76 3.02 0.03 1.61 0.52 -0.52 -4.98 118.95 117.86 2jgx s ARG 404 Ca 0.00 -0.58 0.07 0.00 -0.52 0.00 0.00 55.73 54.70 2jgx s ARG 404 Cb 0.00 -2.81 -0.02 0.00 0.52 0.00 0.00 34.95 32.63 2jgx s ARG 404 CO 0.00 0.60 -0.21 0.15 0.02 0.00 0.00 175.30 175.87 2jgx s LYS 405 N -2.16 1.45 0.04 3.54 1.02 -1.26 -1.29 119.74 121.08 2jgx s LYS 405 Ca 0.28 -0.89 -0.00 0.00 0.02 0.00 0.00 55.97 55.37 2jgx s LYS 405 Cb -0.12 -1.52 -0.03 0.00 -0.52 0.00 0.00 37.83 35.63 2jgx s LYS 405 CO 0.20 0.40 -0.04 -0.06 -0.92 0.00 0.00 175.35 174.93 2jgx s PHE 406 N -0.73 0.48 0.05 3.18 0.08 -0.72 -4.96 117.98 115.38 2jgx s PHE 406 Ca 0.07 -0.86 -0.21 0.00 0.12 0.00 0.00 56.93 56.06 2jgx s PHE 406 Cb -0.09 -0.34 -0.06 0.00 -0.57 0.00 0.00 43.02 41.96 2jgx s PHE 406 CO 0.01 -0.28 0.62 0.14 -0.10 0.00 0.00 175.22 175.61 2jgx s VAL 407 N -3.00 4.75 0.28 -0.44 -7.23 -1.26 0.37 120.40 113.87 2jgx s VAL 407 Ca -0.01 1.33 -0.29 0.00 -1.81 0.00 0.00 61.98 61.20 2jgx s VAL 407 Cb 0.01 -3.96 -0.13 0.00 0.56 0.00 0.00 36.38 32.86 2jgx s VAL 407 CO -0.06 0.48 1.24 1.67 -0.31 0.00 0.00 175.10 178.12 2jgx n GLN 408 N 2.18 1.79 0.00 4.82 7.27 -1.26 -3.00 117.38 129.18 2jgx n GLN 408 Ca -0.08 0.63 0.00 0.00 0.07 0.00 0.00 57.00 57.63 2jgx n GLN 408 Cb 0.50 -2.17 0.00 0.00 2.41 0.00 0.00 30.24 30.98 2jgx n GLN 408 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2jgx n GLY 409 N 1.44 1.16 3.59 1.69 0.00 0.16 -4.92 105.19 108.31 2jgx n GLY 409 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 2jgx n GLY 409 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jgx s LYS 410 N -0.46 2.17 0.09 1.61 -0.14 -1.16 -4.96 119.74 116.88 2jgx s LYS 410 Ca 0.00 -1.08 0.05 0.00 -1.36 0.00 0.00 55.97 53.58 2jgx s LYS 410 Cb 0.00 -2.29 -0.03 0.00 -1.68 0.00 0.00 37.83 33.82 2jgx s LYS 410 CO 0.00 0.49 -0.12 0.45 -0.76 0.00 0.00 175.35 175.40 2jgx s SER 411 N -2.45 1.65 -0.11 2.83 0.15 -1.26 0.64 113.70 115.15 2jgx s SER 411 Ca 0.23 -0.74 -0.17 0.00 0.70 0.00 0.00 55.95 55.96 2jgx s SER 411 Cb -0.10 -0.03 0.04 0.00 -1.71 0.00 0.00 66.02 64.22 2jgx s SER 411 CO 0.15 -0.17 0.44 -0.51 1.20 0.00 0.00 173.24 174.35 2jgx s ILE 412 N -1.96 0.02 0.15 6.45 -1.16 -0.66 -4.97 121.20 119.06 2jgx s ILE 412 Ca 0.04 -0.14 -0.28 0.00 -0.51 0.00 0.00 60.65 59.76 2jgx s ILE 412 Cb -0.06 -0.68 -0.07 0.00 0.61 0.00 0.00 42.46 42.26 2jgx s ILE 412 CO 0.02 -0.08 0.87 -0.62 -2.81 0.00 0.00 174.94 172.32 2jgx s ASP 413 N -0.39 7.47 -0.12 4.50 2.15 -1.26 -1.03 116.67 127.99 2jgx s ASP 413 Ca -0.05 1.74 0.03 0.00 0.43 0.00 0.00 52.55 54.70 2jgx s ASP 413 Cb -0.03 -2.55 0.01 0.00 -0.30 0.00 0.00 42.92 40.04 2jgx s ASP 413 CO 0.03 0.09 -0.20 -0.69 -0.17 0.00 0.00 175.17 174.22 2jgx s VAL 414 N -0.67 1.86 -0.17 1.11 1.01 0.46 -4.95 120.40 119.06 2jgx s VAL 414 Ca 0.41 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.47 2jgx s VAL 414 Cb -0.24 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 2jgx s VAL 414 CO 0.28 0.51 -0.02 0.00 0.00 0.00 0.00 175.10 175.87 2jgx s ALA 415 N 0.71 3.02 0.49 5.51 0.00 -1.26 -4.80 121.76 125.43 2jgx s ALA 415 Ca -0.11 -0.87 0.06 0.00 0.00 0.00 0.00 51.96 51.04 2jgx s ALA 415 Cb -0.16 -1.64 0.06 0.00 0.00 0.00 0.00 23.12 21.38 2jgx s ALA 415 CO 0.02 0.10 0.49 0.00 0.00 0.00 0.00 175.76 176.37 2jgx s HIS 417 N -2.28 3.15 -0.30 0.00 3.76 -0.43 -4.62 115.29 114.58 2jgx s HIS 417 Ca 0.37 1.49 -0.35 0.00 -0.15 0.00 0.00 55.06 56.43 2jgx s HIS 417 Cb -0.03 -2.93 -0.11 0.00 1.11 0.00 0.00 32.58 30.62 2jgx s HIS 417 CO 0.24 -0.88 2.12 -2.30 -0.85 0.00 0.00 174.74 173.06 2jgx n PRO 418 N -1.95 1.30 0.00 8.40 -0.02 -1.26 -0.63 135.00 140.84 2jgx n PRO 418 Ca 0.08 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2jgx n PRO 418 Cb 0.53 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2jgx n PRO 418 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgx n GLY 419 N 6.02 1.52 3.62 -1.23 0.00 -1.26 -5.07 105.19 108.79 2jgx n GLY 419 Ca 0.37 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.08 2jgx n GLY 419 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jgx s TYR 420 N -2.07 2.86 0.17 1.61 2.02 0.20 -0.61 117.35 121.53 2jgx s TYR 420 Ca 0.00 -0.09 -0.19 0.00 -0.37 0.00 0.00 57.07 56.42 2jgx s TYR 420 Cb 0.00 -1.51 0.04 0.00 -0.40 0.00 0.00 41.96 40.10 2jgx s TYR 420 CO 0.00 0.43 0.53 0.00 -1.57 0.00 0.00 175.55 174.94 2jgx s ALA 421 N -1.20 -1.18 0.77 3.71 0.00 0.13 -4.59 121.76 119.40 2jgx s ALA 421 Ca 0.22 0.07 -0.12 0.00 0.00 0.00 0.00 51.96 52.13 2jgx s ALA 421 Cb -0.11 0.82 0.06 0.00 0.00 0.00 0.00 23.12 23.89 2jgx s ALA 421 CO 0.14 -0.76 1.12 -0.51 0.00 0.00 0.00 175.76 175.75 2jgx s LEU 422 N -2.81 3.10 0.24 0.00 1.43 -1.22 -0.61 118.68 118.80 2jgx s LEU 422 Ca 0.05 1.99 -0.31 0.00 -1.03 0.00 0.00 54.13 54.82 2jgx s LEU 422 Cb -0.01 -4.54 -0.14 0.00 0.03 0.00 0.00 46.19 41.53 2jgx s LEU 422 CO -0.08 -2.19 1.35 -2.65 0.23 0.00 0.00 176.35 173.00 2jgx n PRO 423 N -3.36 1.88 -1.23 1.29 -0.02 -1.25 -0.94 135.00 131.37 2jgx n PRO 423 Ca 0.10 0.67 -0.08 0.00 -2.02 0.00 0.00 63.50 62.17 2jgx n PRO 423 Cb 0.52 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 2jgx n PRO 423 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2jgx n LYS 424 N 1.86 -0.81 -3.37 -0.52 5.02 -1.26 -2.94 118.16 116.14 2jgx n LYS 424 Ca 0.12 0.72 -0.20 0.00 -2.02 0.00 0.00 58.31 56.93 2jgx n LYS 424 Cb 0.31 -4.62 0.06 0.00 -0.02 0.00 0.00 35.03 30.76 2jgx n LYS 424 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jgx n ALA 425 N 1.15 -1.06 -1.78 7.82 0.00 -0.12 -5.00 120.51 121.51 2jgx n ALA 425 Ca -0.08 0.33 -0.31 0.00 0.00 0.00 0.00 53.44 53.38 2jgx n ALA 425 Cb 0.33 -4.57 0.01 0.00 0.00 0.00 0.00 19.45 15.22 2jgx n ALA 425 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jgx s GLN 426 N -6.05 3.48 0.00 0.00 -0.21 -1.15 -4.88 119.66 110.85 2jgx s GLN 426 Ca 0.47 0.86 0.00 0.00 0.02 0.00 0.00 55.36 56.71 2jgx s GLN 426 Cb -0.21 -2.06 0.00 0.00 1.00 0.00 0.00 33.01 31.74 2jgx s GLN 426 CO 0.58 -0.67 0.00 0.25 -2.12 0.00 0.00 175.29 173.34 2jgx n THR 427 N -2.62 0.00 -4.31 -0.19 -2.24 -1.26 -3.38 114.28 100.28 2jgx n THR 427 Ca 0.07 -0.29 -0.24 0.00 -2.27 0.00 0.00 64.05 61.31 2jgx n THR 427 Cb 0.54 0.80 -0.13 0.00 -2.10 0.00 0.00 70.33 69.45 2jgx n THR 427 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2jgx s THR 428 N -1.23 1.74 -0.03 4.28 -4.23 -1.26 -0.40 115.64 114.50 2jgx s THR 428 Ca 0.00 -1.54 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 2jgx s THR 428 Cb 0.00 -1.57 -0.00 0.00 1.34 0.00 0.00 72.50 72.26 2jgx s THR 428 CO 0.00 -0.04 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.19 2jgx s VAL 429 N -1.14 1.34 -0.24 2.29 1.01 -0.19 -4.88 120.40 118.59 2jgx s VAL 429 Ca 0.07 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.28 2jgx s VAL 429 Cb -0.10 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2jgx s VAL 429 CO 0.04 0.39 0.10 -0.89 0.00 0.00 0.00 175.10 174.74 2jgx s THR 430 N -0.04 4.76 -0.11 3.92 2.01 -1.26 -1.66 115.64 123.26 2jgx s THR 430 Ca -0.01 -0.03 -0.29 0.00 0.31 0.00 0.00 61.69 61.67 2jgx s THR 430 Cb -0.10 -3.22 -0.06 0.00 0.01 0.00 0.00 72.50 69.14 2jgx s THR 430 CO 0.01 0.35 1.87 0.00 -0.69 0.00 0.00 174.62 176.16 2jgx s MET 432 N 4.87 0.19 -0.38 0.00 1.00 0.12 0.39 119.30 125.48 2jgx s MET 432 Ca 0.84 0.41 -0.03 0.00 0.00 0.00 0.00 55.69 56.90 2jgx s MET 432 Cb -0.34 -0.06 0.00 0.00 0.00 0.00 0.00 34.83 34.44 2jgx s MET 432 CO 0.35 -0.12 0.26 -1.91 0.00 0.00 0.00 175.02 173.60 2jgx n GLU 433 N 3.82 -0.66 -2.59 2.03 2.13 -1.26 0.28 120.64 124.38 2jgx n GLU 433 Ca -0.21 0.20 -0.19 0.00 0.66 0.00 0.00 57.16 57.62 2jgx n GLU 433 Cb 0.54 -0.85 -0.00 0.00 0.27 0.00 0.00 31.44 31.41 2jgx n GLU 433 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2jgx n ASN 434 N -0.74 -5.18 0.00 4.31 6.94 0.47 -4.75 115.26 116.30 2jgx n ASN 434 Ca -0.12 -0.03 0.00 0.00 -0.02 0.00 0.00 54.58 54.41 2jgx n ASN 434 Cb 0.29 -4.30 0.00 0.00 -2.36 0.00 0.00 39.78 33.40 2jgx n ASN 434 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2jgx n GLY 435 N -1.05 4.10 2.71 4.83 0.00 0.14 -4.30 105.19 111.62 2jgx n GLY 435 Ca -0.18 -1.02 -0.26 0.00 0.00 0.00 0.00 46.02 44.57 2jgx n GLY 435 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jgx s TRP 436 N -1.69 0.69 0.02 1.61 0.52 -1.25 0.15 118.94 118.98 2jgx s TRP 436 Ca 0.00 -0.49 -0.25 0.00 0.02 0.00 0.00 56.10 55.38 2jgx s TRP 436 Cb 0.00 -0.86 -0.18 0.00 -1.15 0.00 0.00 33.47 31.28 2jgx s TRP 436 CO 0.00 -0.49 1.39 1.03 0.02 0.00 0.00 176.95 178.90 2jgx h SER 437 N 8.32 -0.10 -0.06 2.95 0.87 -0.96 -3.15 113.55 121.42 2jgx h SER 437 Ca -0.17 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2jgx h SER 437 Cb 1.13 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2jgx h SER 437 CO 0.29 0.23 0.00 -0.81 -0.53 0.00 0.00 176.83 176.01 2jgx n PRO 438 N -5.00 1.77 -1.35 2.24 -0.04 -1.26 -5.00 135.00 126.36 2jgx n PRO 438 Ca -0.08 -1.13 0.00 0.00 -0.04 0.00 0.00 63.50 62.24 2jgx n PRO 438 Cb 0.20 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 2jgx n PRO 438 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2jgx n THR 439 N 0.37 -5.70 -2.55 0.52 -1.04 -1.19 -4.78 114.28 99.91 2jgx n THR 439 Ca 0.18 1.04 -0.41 0.00 -2.04 0.00 0.00 64.05 62.82 2jgx n THR 439 Cb 0.38 -3.83 -0.03 0.00 -1.82 0.00 0.00 70.33 65.03 2jgx n THR 439 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2jgx s PRO 440 N -1.70 3.43 -0.11 -2.82 0.05 -1.26 -4.61 135.00 127.97 2jgx s PRO 440 Ca 0.00 -0.79 -0.03 0.00 0.05 0.00 0.00 61.00 60.23 2jgx s PRO 440 Cb 0.00 -4.94 0.05 0.00 0.05 0.00 0.00 34.50 29.65 2jgx s PRO 440 CO 0.00 -2.21 0.06 1.03 0.05 0.00 0.00 177.00 175.93 2jgx s ARG 441 N 5.29 0.13 -1.19 4.56 0.52 -1.26 -4.99 118.95 122.01 2jgx s ARG 441 Ca 0.43 0.07 -0.19 0.00 -0.52 0.00 0.00 55.73 55.52 2jgx s ARG 441 Cb -0.03 -1.29 0.08 0.00 0.52 0.00 0.00 34.95 34.24 2jgx s ARG 441 CO -0.01 -0.50 1.58 0.00 0.02 0.00 0.00 175.30 176.39 2jgx s ILE 443 N 3.98 4.75 -0.35 0.00 1.01 0.22 -4.62 121.20 126.19 2jgx s ILE 443 Ca 0.49 0.70 -0.29 0.00 0.00 0.00 0.00 60.65 61.56 2jgx s ILE 443 Cb 0.01 -3.82 0.02 0.00 0.01 0.00 0.00 42.46 38.68 2jgx s ILE 443 CO 0.01 -0.87 1.15 -0.60 0.00 0.00 0.00 174.94 174.63 2jgx s ARG 444 N -4.63 3.95 -0.02 2.79 3.52 -1.26 0.19 118.95 123.49 2jgx s ARG 444 Ca 0.53 1.00 0.05 0.00 -0.13 0.00 0.00 55.73 57.18 2jgx s ARG 444 Cb -0.10 -3.81 -0.24 0.00 -1.56 0.00 0.00 34.95 29.23 2jgx s ARG 444 CO 0.43 -1.07 0.76 -0.24 -0.81 0.00 0.00 175.30 174.37 2jgx h VAL 445 N 5.91 1.02 0.00 7.11 3.04 -1.17 -3.47 116.25 128.69 2jgx h VAL 445 Ca -0.22 -2.78 0.00 0.00 -1.01 0.00 0.00 66.70 62.69 2jgx h VAL 445 Cb 1.07 2.58 0.00 0.00 -2.01 0.00 0.00 31.29 32.93 2jgx h VAL 445 CO 1.06 0.70 0.00 1.17 -1.01 0.00 0.00 177.57 179.49