#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gin s VAL 371 N 0.00 3.13 0.17 0.52 1.01 -1.26 -4.25 120.40 119.71 3gin s VAL 371 Ca 0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 3gin s VAL 371 Cb 0.00 -2.41 -0.08 0.00 0.00 0.00 0.00 36.38 33.89 3gin s VAL 371 CO 0.00 0.45 1.30 -0.44 0.00 0.00 0.00 175.10 176.40 3gin s SER 372 N 1.42 6.93 -0.09 3.32 0.01 -0.78 -3.44 113.70 121.08 3gin s SER 372 Ca 0.05 2.32 -0.01 0.00 1.31 0.00 0.00 55.95 59.62 3gin s SER 372 Cb -0.14 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.46 3gin s SER 372 CO -0.05 -0.52 -0.04 -0.54 0.41 0.00 0.00 173.24 172.50 3gin s LYS 373 N 0.22 3.03 -0.15 12.44 -0.14 0.74 -0.48 119.74 135.40 3gin s LYS 373 Ca 0.58 -0.50 0.00 0.00 -1.36 0.00 0.00 55.97 54.69 3gin s LYS 373 Cb -0.35 -2.72 -0.00 0.00 -1.68 0.00 0.00 37.83 33.07 3gin s LYS 373 CO 0.35 0.58 -0.15 0.42 -0.76 0.00 0.00 175.35 175.80 3gin s ILE 374 N -0.55 2.76 0.15 2.17 -1.09 -0.10 -1.64 121.20 122.89 3gin s ILE 374 Ca 0.09 -0.74 -0.23 0.00 -2.23 0.00 0.00 60.65 57.53 3gin s ILE 374 Cb -0.12 -2.17 0.07 0.00 -1.58 0.00 0.00 42.46 38.67 3gin s ILE 374 CO 0.02 0.51 0.63 0.72 -1.23 0.00 0.00 174.94 175.59 3gin s PHE 375 N 0.75 -0.51 0.27 3.97 -0.71 -0.95 -0.09 117.98 120.71 3gin s PHE 375 Ca -0.06 0.30 -0.29 0.00 -1.04 0.00 0.00 56.93 55.84 3gin s PHE 375 Cb -0.15 0.56 -0.09 0.00 -1.21 0.00 0.00 43.02 42.12 3gin s PHE 375 CO 0.01 -0.84 1.10 -0.06 -1.34 0.00 0.00 175.22 174.09 3gin s PHE 376 N -3.71 3.59 0.33 3.49 0.40 0.01 0.15 117.98 122.25 3gin s PHE 376 Ca 0.02 1.70 0.03 0.00 -0.60 0.00 0.00 56.93 58.08 3gin s PHE 376 Cb -0.01 -3.28 0.64 0.00 0.51 0.00 0.00 43.02 40.88 3gin s PHE 376 CO -0.12 -0.52 1.92 1.49 0.70 0.00 0.00 175.22 178.68 3gin h GLU 377 N 3.88 0.87 -4.72 0.44 4.81 -1.25 -3.40 114.58 115.20 3gin h GLU 377 Ca -0.47 -0.05 -0.29 0.00 -0.13 0.00 0.00 59.36 58.42 3gin h GLU 377 Cb 1.21 -0.20 -0.20 0.00 0.63 0.00 0.00 28.75 30.20 3gin h GLU 377 CO 0.67 0.57 -0.73 1.14 -0.73 0.00 0.00 179.01 179.93 3gin s GLN 378 N -5.80 0.65 0.21 1.92 -2.07 -1.26 -5.05 119.66 108.24 3gin s GLN 378 Ca -0.11 -0.91 0.26 0.00 -1.82 0.00 0.00 55.36 52.78 3gin s GLN 378 Cb 0.20 -0.38 0.77 0.00 -1.09 0.00 0.00 33.01 32.52 3gin s GLN 378 CO 0.79 0.06 1.75 0.41 -1.32 0.00 0.00 175.29 176.98 3gin n GLY 379 N 1.12 -1.69 2.91 2.60 0.00 -1.26 -4.83 105.19 104.03 3gin n GLY 379 Ca -0.20 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 3gin n GLY 379 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gin s THR 380 N -3.11 0.52 0.18 2.61 2.01 -1.26 -1.73 115.64 114.86 3gin s THR 380 Ca 0.10 -0.15 0.08 0.00 0.31 0.00 0.00 61.69 62.04 3gin s THR 380 Cb 0.12 -0.53 -0.04 0.00 0.01 0.00 0.00 72.50 72.06 3gin s THR 380 CO 0.61 0.21 -0.17 -0.31 -0.69 0.00 0.00 174.62 174.26 3gin s TYR 381 N 0.71 1.79 0.04 4.92 2.02 -0.26 -4.97 117.35 121.60 3gin s TYR 381 Ca -0.09 -0.50 0.02 0.00 -0.37 0.00 0.00 57.07 56.12 3gin s TYR 381 Cb -0.13 -0.87 -0.02 0.00 -0.40 0.00 0.00 41.96 40.54 3gin s TYR 381 CO 0.00 0.35 -0.06 -0.65 -1.57 0.00 0.00 175.55 173.61 3gin s GLN 382 N -3.07 0.48 0.16 -0.62 -0.21 -1.26 -1.84 119.66 113.30 3gin s GLN 382 Ca 0.18 -0.74 -0.22 0.00 0.02 0.00 0.00 55.36 54.60 3gin s GLN 382 Cb -0.04 -0.18 0.06 0.00 1.00 0.00 0.00 33.01 33.85 3gin s GLN 382 CO 0.07 0.02 0.58 0.00 -2.12 0.00 0.00 175.29 173.84 3gin s LEU 384 N -2.76 3.61 0.51 0.00 1.43 -1.26 -0.37 118.68 119.83 3gin s LEU 384 Ca 0.02 1.84 0.30 0.00 -1.03 0.00 0.00 54.13 55.26 3gin s LEU 384 Cb -0.01 -4.54 1.42 0.00 0.03 0.00 0.00 46.19 43.09 3gin s LEU 384 CO -0.12 -1.04 1.86 -0.33 0.23 0.00 0.00 176.35 176.95 3gin h GLU 385 N 0.79 0.08 -0.27 1.70 5.08 -1.52 -1.56 114.58 118.88 3gin h GLU 385 Ca -0.48 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 3gin h GLU 385 Cb 1.22 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3gin h GLU 385 CO 0.58 0.05 0.00 0.27 -1.00 0.00 0.00 179.01 178.91 3gin n ASN 386 N -4.31 2.33 0.03 1.42 6.94 -1.26 -3.19 115.26 117.22 3gin n ASN 386 Ca 0.21 -1.84 0.07 0.00 -0.02 0.00 0.00 54.58 53.00 3gin n ASN 386 Cb 0.99 -0.17 0.29 0.00 -2.36 0.00 0.00 39.78 38.53 3gin n ASN 386 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3gin n GLY 388 N -0.33 2.02 3.03 0.00 0.00 -1.26 -4.77 105.19 103.87 3gin n GLY 388 Ca 0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3gin n GLY 388 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gin s THR 389 N 0.00 0.14 -0.17 2.61 -4.23 -1.26 -1.12 115.64 111.60 3gin s THR 389 Ca 0.00 -1.14 -0.07 0.00 -1.18 0.00 0.00 61.69 59.29 3gin s THR 389 Cb 0.00 -0.65 -0.04 0.00 1.34 0.00 0.00 72.50 73.14 3gin s THR 389 CO 0.00 -0.63 0.08 0.54 -0.54 0.00 0.00 174.62 174.07 3gin s VAL 390 N -2.20 4.94 -0.06 2.29 0.11 -0.41 -4.94 120.40 120.14 3gin s VAL 390 Ca -0.09 0.01 -0.13 0.00 -2.93 0.00 0.00 61.98 58.85 3gin s VAL 390 Cb -0.04 -3.21 -0.05 0.00 -1.53 0.00 0.00 36.38 31.55 3gin s VAL 390 CO -0.04 0.49 0.33 0.00 -3.33 0.00 0.00 175.10 172.55 3gin s ALA 391 N 0.10 3.71 0.01 1.54 0.00 -1.26 -0.99 121.76 124.87 3gin s ALA 391 Ca 0.06 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 51.71 3gin s ALA 391 Cb -0.12 -2.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.68 3gin s ALA 391 CO 0.00 0.42 -0.16 -0.51 0.00 0.00 0.00 175.76 175.51 3gin s LEU 392 N -0.71 2.09 -0.16 0.00 1.02 0.86 -4.97 118.68 116.82 3gin s LEU 392 Ca 0.20 -0.37 -0.02 0.00 0.02 0.00 0.00 54.13 53.96 3gin s LEU 392 Cb -0.15 -0.78 -0.02 0.00 0.02 0.00 0.00 46.19 45.26 3gin s LEU 392 CO 0.09 0.14 -0.07 -0.89 0.02 0.00 0.00 176.35 175.65 3gin s THR 393 N -0.56 3.51 -0.23 5.49 2.01 -1.26 -0.61 115.64 123.99 3gin s THR 393 Ca 0.05 -0.49 -0.09 0.00 0.31 0.00 0.00 61.69 61.47 3gin s THR 393 Cb -0.07 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 3gin s THR 393 CO 0.00 0.49 0.13 -0.63 -0.69 0.00 0.00 174.62 173.92 3gin s ILE 394 N 0.52 5.07 -0.02 1.82 1.01 0.30 -0.71 121.20 129.19 3gin s ILE 394 Ca -0.05 0.08 -0.07 0.00 0.00 0.00 0.00 60.65 60.60 3gin s ILE 394 Cb -0.15 -3.35 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 3gin s ILE 394 CO 0.03 0.36 0.26 -0.63 0.00 0.00 0.00 174.94 174.96 3gin s ILE 395 N 1.03 5.32 -0.16 2.92 -1.09 0.12 -1.00 121.20 128.34 3gin s ILE 395 Ca 0.06 0.23 -0.02 0.00 -2.23 0.00 0.00 60.65 58.69 3gin s ILE 395 Cb -0.14 -3.55 -0.02 0.00 -1.58 0.00 0.00 42.46 37.17 3gin s ILE 395 CO 0.04 0.43 -0.07 -0.60 -1.23 0.00 0.00 174.94 173.51 3gin s ARG 396 N -1.57 3.51 -0.02 2.79 3.52 0.26 -2.24 118.95 125.21 3gin s ARG 396 Ca 0.25 -0.60 -0.01 0.00 -0.13 0.00 0.00 55.73 55.24 3gin s ARG 396 Cb -0.13 -2.82 0.01 0.00 -1.56 0.00 0.00 34.95 30.44 3gin s ARG 396 CO 0.14 0.15 0.04 0.50 -0.81 0.00 0.00 175.30 175.32 3gin s ARG 397 N 0.56 0.03 0.00 5.12 3.52 -0.65 -4.70 118.95 122.83 3gin s ARG 397 Ca -0.05 0.08 0.00 0.00 -0.13 0.00 0.00 55.73 55.63 3gin s ARG 397 Cb -0.15 -0.03 0.00 0.00 -1.56 0.00 0.00 34.95 33.21 3gin s ARG 397 CO 0.03 -0.03 0.00 0.41 -0.81 0.00 0.00 175.30 174.90 3gin n GLY 398 N 3.27 0.43 7.00 8.12 0.00 -1.26 -0.19 105.19 122.56 3gin n GLY 398 Ca -0.15 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.05 3gin n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gin n GLY 399 N 0.65 0.64 3.42 -0.02 0.00 -1.22 -3.96 105.19 104.69 3gin n GLY 399 Ca 0.00 -0.88 -0.44 0.00 0.00 0.00 0.00 46.02 44.70 3gin n GLY 399 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gin s ASP 400 N -4.00 6.20 0.00 1.61 -1.08 -1.26 -4.92 116.67 113.22 3gin s ASP 400 Ca 0.00 -1.13 0.09 0.00 -0.52 0.00 0.00 52.55 50.99 3gin s ASP 400 Cb 0.00 -2.34 0.49 0.00 -1.46 0.00 0.00 42.92 39.60 3gin s ASP 400 CO 0.00 -1.18 1.12 0.18 0.52 0.00 0.00 175.17 175.80 3gin n LEU 401 N 6.80 0.00 0.03 -1.34 4.77 -1.26 -2.07 117.00 123.93 3gin n LEU 401 Ca -0.06 0.20 0.13 0.00 -0.03 0.00 0.00 56.01 56.24 3gin n LEU 401 Cb 0.44 -0.20 0.40 0.00 -2.33 0.00 0.00 43.42 41.73 3gin n LEU 401 CO 0.60 -0.14 0.70 0.35 -1.33 0.00 0.00 177.39 177.57 3gin n THR 402 N -1.20 0.19 -1.82 -5.08 -2.24 -1.26 0.50 114.28 103.37 3gin n THR 402 Ca 0.05 -0.11 -0.32 0.00 -2.27 0.00 0.00 64.05 61.40 3gin n THR 402 Cb 0.06 -0.26 0.03 0.00 -2.10 0.00 0.00 70.33 68.06 3gin n THR 402 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3gin s ASN 403 N -3.55 5.42 -0.17 3.42 0.02 -0.88 -4.41 114.94 114.78 3gin s ASN 403 Ca 0.11 1.84 -0.12 0.00 -1.02 0.00 0.00 52.86 53.68 3gin s ASN 403 Cb 0.16 -2.53 -0.05 0.00 0.02 0.00 0.00 41.25 38.85 3gin s ASN 403 CO 0.62 -1.42 0.21 -0.89 0.02 0.00 0.00 177.10 175.65 3gin s THR 404 N -2.55 5.36 -0.06 1.60 2.01 -1.26 -3.93 115.64 116.82 3gin s THR 404 Ca 0.63 0.37 0.05 0.00 0.31 0.00 0.00 61.69 63.05 3gin s THR 404 Cb -0.17 -3.54 -0.01 0.00 0.01 0.00 0.00 72.50 68.79 3gin s THR 404 CO 0.43 0.43 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.87 3gin s VAL 405 N 0.26 1.87 -0.11 3.82 1.01 -0.64 -4.31 120.40 122.31 3gin s VAL 405 Ca 0.13 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 61.14 3gin s VAL 405 Cb -0.12 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 3gin s VAL 405 CO 0.01 0.52 -0.08 -0.36 0.00 0.00 0.00 175.10 175.19 3gin s PHE 406 N -0.03 2.90 -0.03 5.22 0.40 0.16 -0.50 117.98 126.10 3gin s PHE 406 Ca -0.06 -0.26 -0.00 0.00 -0.60 0.00 0.00 56.93 56.01 3gin s PHE 406 Cb -0.14 -1.81 0.03 0.00 0.51 0.00 0.00 43.02 41.61 3gin s PHE 406 CO 0.04 0.07 0.02 0.54 0.70 0.00 0.00 175.22 176.59 3gin s VAL 407 N -0.16 0.05 0.49 -0.44 0.11 -0.58 -1.07 120.40 118.80 3gin s VAL 407 Ca 0.01 0.19 -0.18 0.00 -2.93 0.00 0.00 61.98 59.07 3gin s VAL 407 Cb -0.13 -0.19 -0.09 0.00 -1.53 0.00 0.00 36.38 34.44 3gin s VAL 407 CO 0.03 0.13 0.99 -1.81 -3.33 0.00 0.00 175.10 171.11 3gin s ASP 408 N 1.25 6.61 0.04 3.54 1.01 -0.23 -0.41 116.67 128.49 3gin s ASP 408 Ca -0.07 1.67 0.00 0.00 0.71 0.00 0.00 52.55 54.87 3gin s ASP 408 Cb -0.13 -2.53 -0.03 0.00 1.01 0.00 0.00 42.92 41.24 3gin s ASP 408 CO -0.03 -0.59 -0.04 0.72 0.21 0.00 0.00 175.17 175.44 3gin s PHE 409 N -2.39 0.50 -0.28 4.23 -0.12 -0.13 -1.18 117.98 118.61 3gin s PHE 409 Ca 0.61 -0.75 -0.23 0.00 -0.05 0.00 0.00 56.93 56.51 3gin s PHE 409 Cb -0.11 -0.33 0.11 0.00 -0.63 0.00 0.00 43.02 42.06 3gin s PHE 409 CO 0.25 -0.23 0.94 0.50 -0.05 0.00 0.00 175.22 176.62 3gin s ARG 410 N -2.61 0.57 0.53 1.99 3.52 -0.77 -2.13 118.95 120.05 3gin s ARG 410 Ca -0.04 0.74 -0.17 0.00 -0.13 0.00 0.00 55.73 56.13 3gin s ARG 410 Cb -0.02 0.25 -0.07 0.00 -1.56 0.00 0.00 34.95 33.55 3gin s ARG 410 CO -0.04 -0.08 1.01 0.95 -0.81 0.00 0.00 175.30 176.33 3gin s THR 411 N 0.50 4.26 -0.03 4.11 -4.23 -0.67 -1.41 115.64 118.16 3gin s THR 411 Ca 0.00 1.12 -0.02 0.00 -1.18 0.00 0.00 61.69 61.61 3gin s THR 411 Cb -0.05 -3.59 0.02 0.00 1.34 0.00 0.00 72.50 70.21 3gin s THR 411 CO -0.07 -0.58 0.08 -0.70 -0.54 0.00 0.00 174.62 172.81 3gin s GLU 412 N -3.95 0.06 0.32 3.99 2.12 -0.18 -4.90 118.70 116.16 3gin s GLU 412 Ca 0.61 0.16 -0.29 0.00 0.36 0.00 0.00 54.97 55.81 3gin s GLU 412 Cb -0.12 -0.04 -0.11 0.00 0.26 0.00 0.00 34.13 34.12 3gin s GLU 412 CO 0.31 -0.06 1.50 -0.51 -0.54 0.00 0.00 175.26 175.96 3gin s ASP 413 N 0.40 6.44 0.00 -1.70 1.01 -1.26 -0.55 116.67 121.00 3gin s ASP 413 Ca -0.03 2.92 0.00 0.00 0.71 0.00 0.00 52.55 56.16 3gin s ASP 413 Cb -0.04 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.24 3gin s ASP 413 CO -0.01 -0.83 0.00 0.61 0.21 0.00 0.00 175.17 175.14 3gin n GLY 414 N 1.39 0.44 0.18 0.21 0.00 -1.03 -4.71 105.19 101.66 3gin n GLY 414 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 3gin n GLY 414 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3gin h THR 415 N 0.00 0.00 -3.30 2.61 1.35 -1.70 -3.44 112.91 108.42 3gin h THR 415 Ca 0.00 -0.95 -0.56 0.00 -0.55 0.00 0.00 66.41 64.35 3gin h THR 415 Cb 0.00 1.79 -0.04 0.00 -1.73 0.00 0.00 68.15 68.17 3gin h THR 415 CO 0.00 0.00 0.01 0.00 -0.25 0.00 0.00 175.52 175.28 3gin s ALA 416 N -3.25 3.55 -0.08 6.62 0.00 -0.15 -4.80 121.76 123.65 3gin s ALA 416 Ca 0.05 0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.14 3gin s ALA 416 Cb 0.07 -2.72 -0.02 0.00 0.00 0.00 0.00 23.12 20.46 3gin s ALA 416 CO 0.70 0.35 -0.17 -0.80 0.00 0.00 0.00 175.76 175.84 3gin s ASN 417 N -1.01 3.75 0.43 0.00 0.01 -1.26 -4.46 114.94 112.41 3gin s ASN 417 Ca 0.31 -0.33 -0.26 0.00 -0.71 0.00 0.00 52.86 51.87 3gin s ASN 417 Cb -0.20 -1.13 -0.09 0.00 0.41 0.00 0.00 41.25 40.24 3gin s ASN 417 CO 0.20 0.25 1.43 0.00 -1.51 0.00 0.00 177.10 177.48 3gin s ALA 418 N -0.18 3.31 0.00 0.60 0.00 -1.26 -0.60 121.76 123.63 3gin s ALA 418 Ca -0.01 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.42 3gin s ALA 418 Cb -0.13 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.40 3gin s ALA 418 CO 0.03 -1.14 0.00 0.41 0.00 0.00 0.00 175.76 175.07 3gin n GLY 419 N 0.56 0.83 2.00 0.00 0.00 -0.02 -4.75 105.19 103.82 3gin n GLY 419 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3gin n GLY 419 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3gin n SER 420 N 0.00 -0.13 -0.04 1.61 2.88 -0.93 -4.93 113.62 112.07 3gin n SER 420 Ca 0.00 0.14 -0.01 0.00 -1.33 0.00 0.00 58.87 57.66 3gin n SER 420 Cb 0.00 0.21 -0.10 0.00 -0.75 0.00 0.00 64.21 63.57 3gin n SER 420 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3gin n ASP 421 N -2.75 1.85 -3.71 -3.46 8.00 0.23 -4.79 116.55 111.91 3gin n ASP 421 Ca 0.00 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 3gin n ASP 421 Cb 0.00 1.12 -0.05 0.00 -0.02 0.00 0.00 41.12 42.17 3gin n ASP 421 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3gin s TYR 422 N -2.55 -0.08 -0.18 1.24 1.13 -1.21 -1.27 117.35 114.42 3gin s TYR 422 Ca -0.06 -0.26 -0.20 0.00 -1.41 0.00 0.00 57.07 55.13 3gin s TYR 422 Cb 0.06 0.19 -0.03 0.00 -1.10 0.00 0.00 41.96 41.07 3gin s TYR 422 CO 0.54 -0.69 0.60 -1.21 -2.51 0.00 0.00 175.55 172.28 3gin s GLU 423 N -3.83 4.23 0.05 -3.49 2.02 -0.08 -0.84 118.70 116.75 3gin s GLU 423 Ca 0.05 0.58 -0.37 0.00 0.02 0.00 0.00 54.97 55.25 3gin s GLU 423 Cb 0.02 -3.56 -0.17 0.00 0.10 0.00 0.00 34.13 30.53 3gin s GLU 423 CO -0.10 -0.17 1.35 0.34 0.02 0.00 0.00 175.26 176.70 3gin n PHE 424 N 4.82 1.49 -3.82 1.61 -0.00 -1.26 -4.45 117.46 115.84 3gin n PHE 424 Ca -0.02 0.67 -0.13 0.00 -0.00 0.00 0.00 57.45 57.96 3gin n PHE 424 Cb 0.50 -2.32 -0.15 0.00 -0.00 0.00 0.00 39.48 37.51 3gin n PHE 424 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 3gin s THR 425 N 0.70 -0.03 0.15 -2.13 2.01 -1.26 -5.01 115.64 110.07 3gin s THR 425 Ca 0.86 0.11 -0.08 0.00 0.31 0.00 0.00 61.69 62.89 3gin s THR 425 Cb -0.99 -0.05 -0.01 0.00 0.01 0.00 0.00 72.50 71.46 3gin s THR 425 CO 0.49 0.04 0.24 -1.83 -0.69 0.00 0.00 174.62 172.87 3gin s GLU 426 N 0.52 1.08 0.00 4.92 -1.05 -1.26 -1.68 118.70 121.24 3gin s GLU 426 Ca -0.04 -1.18 0.00 0.00 -0.15 0.00 0.00 54.97 53.59 3gin s GLU 426 Cb -0.06 0.35 0.00 0.00 -0.44 0.00 0.00 34.13 33.98 3gin s GLU 426 CO -0.01 -0.38 0.00 0.41 0.95 0.00 0.00 175.26 176.23 3gin n GLY 427 N -0.17 -1.55 3.31 -3.83 0.00 -0.91 -4.99 105.19 97.05 3gin n GLY 427 Ca -0.08 -1.05 -0.32 0.00 0.00 0.00 0.00 46.02 44.57 3gin n GLY 427 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gin s THR 428 N -2.32 2.32 -0.04 2.61 2.01 -1.26 -0.95 115.64 118.00 3gin s THR 428 Ca 0.00 -0.97 -0.00 0.00 0.31 0.00 0.00 61.69 61.02 3gin s THR 428 Cb 0.00 -1.87 -0.03 0.00 0.01 0.00 0.00 72.50 70.61 3gin s THR 428 CO 0.00 0.57 0.01 -0.69 -0.69 0.00 0.00 174.62 173.82 3gin s VAL 429 N -0.20 4.28 -0.19 3.82 1.01 0.45 -4.97 120.40 124.60 3gin s VAL 429 Ca -0.02 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 3gin s VAL 429 Cb -0.13 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.39 3gin s VAL 429 CO 0.03 0.49 -0.13 -0.69 0.00 0.00 0.00 175.10 174.81 3gin s VAL 430 N -0.99 2.73 -0.69 2.92 1.01 -1.26 -1.53 120.40 122.59 3gin s VAL 430 Ca 0.17 -0.72 -0.19 0.00 0.00 0.00 0.00 61.98 61.24 3gin s VAL 430 Cb -0.11 -2.19 0.12 0.00 0.00 0.00 0.00 36.38 34.19 3gin s VAL 430 CO 0.06 0.49 0.81 -0.36 0.00 0.00 0.00 175.10 176.10 3gin s PHE 431 N 1.23 3.09 0.96 5.22 0.40 0.34 -4.96 117.98 124.27 3gin s PHE 431 Ca 0.03 -1.14 -0.12 0.00 -0.60 0.00 0.00 56.93 55.10 3gin s PHE 431 Cb -0.14 -4.06 0.17 0.00 0.51 0.00 0.00 43.02 39.50 3gin s PHE 431 CO -0.06 -1.32 1.09 0.15 0.70 0.00 0.00 175.22 175.78 3gin s LYS 432 N 2.47 0.68 0.14 0.44 1.02 -1.26 -1.62 119.74 121.62 3gin s LYS 432 Ca 0.17 0.90 -0.35 0.00 0.02 0.00 0.00 55.97 56.71 3gin s LYS 432 Cb -0.18 -1.74 -0.15 0.00 -0.52 0.00 0.00 37.83 35.24 3gin s LYS 432 CO 0.02 -2.66 1.43 -2.30 -0.92 0.00 0.00 175.35 170.92 3gin n PRO 433 N -4.18 1.66 0.00 -1.68 -0.02 -1.25 -1.17 135.00 128.36 3gin n PRO 433 Ca 0.07 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 3gin n PRO 433 Cb 0.55 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 3gin n PRO 433 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gin n GLY 434 N 2.81 2.96 3.71 -1.23 0.00 0.18 -4.96 105.19 108.67 3gin n GLY 434 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3gin n GLY 434 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gin s GLU 435 N -0.21 4.45 -0.00 1.61 2.02 -0.32 -4.92 118.70 121.33 3gin s GLU 435 Ca 0.00 1.74 0.05 0.00 0.02 0.00 0.00 54.97 56.78 3gin s GLU 435 Cb 0.00 -3.36 -0.07 0.00 0.10 0.00 0.00 34.13 30.81 3gin s GLU 435 CO 0.00 -0.23 0.18 0.25 0.02 0.00 0.00 175.26 175.48 3gin n THR 436 N 3.90 0.00 -3.96 3.63 -2.24 -1.26 -4.78 114.28 109.57 3gin n THR 436 Ca 0.09 -0.28 -0.19 0.00 -2.27 0.00 0.00 64.05 61.39 3gin n THR 436 Cb 0.47 0.77 -0.17 0.00 -2.10 0.00 0.00 70.33 69.30 3gin n THR 436 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3gin s GLN 437 N -1.81 0.52 -0.03 -0.78 -0.21 -1.26 -0.57 119.66 115.52 3gin s GLN 437 Ca 0.01 0.04 0.04 0.00 0.02 0.00 0.00 55.36 55.46 3gin s GLN 437 Cb 0.04 -0.71 -0.00 0.00 1.00 0.00 0.00 33.01 33.34 3gin s GLN 437 CO 0.22 -0.16 -0.15 0.15 -2.12 0.00 0.00 175.29 173.23 3gin s LYS 438 N 1.25 1.46 -0.15 2.91 -0.14 -0.17 -4.97 119.74 119.92 3gin s LYS 438 Ca -0.06 -0.53 -0.06 0.00 -1.36 0.00 0.00 55.97 53.96 3gin s LYS 438 Cb -0.13 -1.32 -0.04 0.00 -1.68 0.00 0.00 37.83 34.66 3gin s LYS 438 CO -0.02 0.24 0.08 -2.00 -0.76 0.00 0.00 175.35 172.89 3gin s GLU 439 N -0.03 3.66 0.07 1.68 2.12 -1.26 -0.54 118.70 124.40 3gin s GLU 439 Ca -0.01 -0.29 0.09 0.00 0.36 0.00 0.00 54.97 55.12 3gin s GLU 439 Cb -0.09 -3.15 -0.03 0.00 0.26 0.00 0.00 34.13 31.12 3gin s GLU 439 CO 0.01 0.50 -0.23 0.96 -0.54 0.00 0.00 175.26 175.96 3gin s ILE 440 N -0.25 1.87 0.02 -3.70 -4.36 0.23 -4.95 121.20 110.05 3gin s ILE 440 Ca 0.09 -1.41 0.08 0.00 -0.26 0.00 0.00 60.65 59.14 3gin s ILE 440 Cb -0.12 -1.64 -0.03 0.00 1.25 0.00 0.00 42.46 41.92 3gin s ILE 440 CO 0.01 0.15 -0.22 -0.13 0.24 0.00 0.00 174.94 175.00 3gin s ARG 441 N -1.51 2.04 -0.06 0.37 0.52 -1.26 -0.10 118.95 118.95 3gin s ARG 441 Ca 0.09 -0.98 0.03 0.00 -0.52 0.00 0.00 55.73 54.35 3gin s ARG 441 Cb -0.10 -2.11 0.01 0.00 0.52 0.00 0.00 34.95 33.27 3gin s ARG 441 CO 0.03 0.55 -0.14 0.08 0.02 0.00 0.00 175.30 175.83 3gin s VAL 442 N -0.79 1.26 0.08 3.52 1.01 -0.16 -4.97 120.40 120.34 3gin s VAL 442 Ca 0.12 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 3gin s VAL 442 Cb -0.10 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.10 3gin s VAL 442 CO 0.02 0.38 1.10 -0.83 0.00 0.00 0.00 175.10 175.77 3gin s GLY 443 N 0.42 2.70 -0.15 4.51 0.00 -1.26 -1.28 107.32 112.25 3gin s GLY 443 Ca -0.11 0.74 -0.03 0.00 0.00 0.00 0.00 44.72 45.32 3gin s GLY 443 CO 0.03 1.81 -0.06 -0.42 0.00 0.00 0.00 173.10 174.46 3gin s ILE 444 N 0.63 3.66 -0.21 0.90 -1.09 -0.28 -0.90 121.20 123.91 3gin s ILE 444 Ca 0.54 -0.44 -0.13 0.00 -2.23 0.00 0.00 60.65 58.39 3gin s ILE 444 Cb -0.27 -2.59 -0.05 0.00 -1.58 0.00 0.00 42.46 37.98 3gin s ILE 444 CO 0.30 0.50 0.25 -0.63 -1.23 0.00 0.00 174.94 174.14 3gin s ILE 445 N 0.37 5.31 0.28 2.92 1.01 -0.40 -4.34 121.20 126.35 3gin s ILE 445 Ca -0.06 0.40 -0.11 0.00 0.00 0.00 0.00 60.65 60.88 3gin s ILE 445 Cb -0.15 -3.59 -0.07 0.00 0.01 0.00 0.00 42.46 38.66 3gin s ILE 445 CO 0.04 0.33 0.62 -0.62 0.00 0.00 0.00 174.94 175.31 3gin s ASP 446 N 0.91 6.63 0.02 3.58 2.15 -1.19 -4.78 116.67 124.00 3gin s ASP 446 Ca 0.12 1.02 0.00 0.00 0.43 0.00 0.00 52.55 54.13 3gin s ASP 446 Cb -0.14 -2.27 -0.00 0.00 -0.30 0.00 0.00 42.92 40.22 3gin s ASP 446 CO 0.05 -0.16 0.02 -0.90 -0.17 0.00 0.00 175.17 174.01 3gin n ASP 447 N -0.42 -0.06 -0.28 -0.34 5.68 -1.26 -5.07 116.55 114.81 3gin n ASP 447 Ca 0.01 -1.15 0.06 0.00 -0.50 0.00 0.00 54.79 53.21 3gin n ASP 447 Cb 0.53 0.13 0.08 0.00 -1.14 0.00 0.00 41.12 40.72 3gin n ASP 447 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3gin n ASP 448 N -2.71 1.34 -4.77 -1.12 -0.08 -1.26 -4.96 116.55 102.99 3gin n ASP 448 Ca 0.00 -2.64 -0.37 0.00 -1.51 0.00 0.00 54.79 50.27 3gin n ASP 448 Cb 0.04 -0.33 -0.06 0.00 2.34 0.00 0.00 41.12 43.10 3gin n ASP 448 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 3gin s ILE 449 N -1.65 5.19 -0.11 5.18 1.01 -1.26 -4.92 121.20 124.64 3gin s ILE 449 Ca 0.19 0.75 -0.29 0.00 0.00 0.00 0.00 60.65 61.30 3gin s ILE 449 Cb 0.17 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.92 3gin s ILE 449 CO 0.01 0.44 0.99 0.12 0.00 0.00 0.00 174.94 176.50 3gin s PHE 450 N -0.03 3.50 0.33 3.97 5.36 -1.26 -4.81 117.98 125.04 3gin s PHE 450 Ca 0.22 1.56 -0.07 0.00 -0.96 0.00 0.00 56.93 57.67 3gin s PHE 450 Cb -0.15 -3.17 0.01 0.00 -0.34 0.00 0.00 43.02 39.37 3gin s PHE 450 CO 0.09 -0.23 0.53 -1.83 -1.46 0.00 0.00 175.22 172.32 3gin s GLU 451 N 2.04 1.88 0.89 10.12 -1.05 -1.26 -5.09 118.70 126.23 3gin s GLU 451 Ca 0.47 -1.58 -0.11 0.00 -0.15 0.00 0.00 54.97 53.61 3gin s GLU 451 Cb -0.18 0.48 0.13 0.00 -0.44 0.00 0.00 34.13 34.12 3gin s GLU 451 CO 0.17 -0.80 1.15 -1.83 0.95 0.00 0.00 175.26 174.90 3gin s GLU 452 N -3.15 1.20 0.52 -4.83 1.03 -1.26 -4.70 118.70 107.51 3gin s GLU 452 Ca 0.26 1.55 -0.21 0.00 0.03 0.00 0.00 54.97 56.60 3gin s GLU 452 Cb -0.01 -1.75 -0.06 0.00 -0.80 0.00 0.00 34.13 31.51 3gin s GLU 452 CO 0.16 -2.50 1.25 -0.51 -1.33 0.00 0.00 175.26 172.33 3gin s ASP 453 N -2.65 5.60 0.07 0.83 1.01 -1.26 -4.73 116.67 115.53 3gin s ASP 453 Ca 0.67 2.50 0.02 0.00 0.71 0.00 0.00 52.55 56.45 3gin s ASP 453 Cb -0.23 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.05 3gin s ASP 453 CO 0.57 -1.32 -0.07 -0.54 0.21 0.00 0.00 175.17 174.01 3gin s LYS 454 N -2.93 0.67 0.18 8.23 1.02 -0.75 -4.98 119.74 121.20 3gin s LYS 454 Ca 0.70 -1.05 0.06 0.00 0.02 0.00 0.00 55.97 55.70 3gin s LYS 454 Cb -0.33 -0.22 -0.05 0.00 -0.52 0.00 0.00 37.83 36.71 3gin s LYS 454 CO 0.39 0.01 -0.11 0.54 -0.92 0.00 0.00 175.35 175.26 3gin s ASN 455 N -2.32 2.19 0.19 2.83 2.20 -1.26 0.24 114.94 119.00 3gin s ASN 455 Ca 0.01 -1.04 0.03 0.00 -0.94 0.00 0.00 52.86 50.92 3gin s ASN 455 Cb -0.02 -0.07 -0.01 0.00 -2.00 0.00 0.00 41.25 39.14 3gin s ASN 455 CO -0.03 -0.27 0.18 2.22 -2.94 0.00 0.00 177.10 176.27 3gin n PHE 456 N -0.31 -0.57 -4.40 1.54 1.16 0.53 -0.98 117.46 114.44 3gin n PHE 456 Ca -0.09 -1.51 -0.24 0.00 -1.87 0.00 0.00 57.45 53.75 3gin n PHE 456 Cb 0.61 0.19 -0.13 0.00 -1.61 0.00 0.00 39.48 38.54 3gin n PHE 456 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3gin s LEU 457 N 0.00 2.24 -0.17 5.98 1.43 0.29 -0.52 118.68 127.94 3gin s LEU 457 Ca 0.21 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 3gin s LEU 457 Cb 0.01 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.40 3gin s LEU 457 CO 0.15 0.08 -0.11 -0.69 0.23 0.00 0.00 176.35 176.01 3gin s VAL 458 N -1.03 1.47 -0.05 -1.59 1.01 0.10 -1.01 120.40 119.30 3gin s VAL 458 Ca 0.06 -0.74 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 3gin s VAL 458 Cb -0.09 -1.50 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3gin s VAL 458 CO 0.03 0.29 0.28 -1.00 0.00 0.00 0.00 175.10 174.70 3gin s HIS 459 N 1.50 3.66 0.02 5.22 3.76 -0.50 -0.77 115.29 128.17 3gin s HIS 459 Ca 0.02 0.75 -0.01 0.00 -0.15 0.00 0.00 55.06 55.67 3gin s HIS 459 Cb -0.14 -2.11 -0.04 0.00 1.11 0.00 0.00 32.58 31.40 3gin s HIS 459 CO -0.09 0.68 0.16 -0.51 -0.85 0.00 0.00 174.74 174.13 3gin s LEU 460 N -1.15 4.23 0.28 0.89 1.43 0.78 -1.85 118.68 123.28 3gin s LEU 460 Ca 0.21 0.26 -0.21 0.00 -1.03 0.00 0.00 54.13 53.36 3gin s LEU 460 Cb -0.14 -2.64 0.03 0.00 0.03 0.00 0.00 46.19 43.46 3gin s LEU 460 CO 0.10 0.23 0.75 -0.94 0.23 0.00 0.00 176.35 176.72 3gin s SER 461 N -2.11 -0.22 -1.22 2.29 1.04 -0.32 -4.90 113.70 108.26 3gin s SER 461 Ca 0.29 -0.65 -0.03 0.00 0.48 0.00 0.00 55.95 56.04 3gin s SER 461 Cb -0.13 0.72 -0.01 0.00 0.10 0.00 0.00 66.02 66.70 3gin s SER 461 CO 0.21 -1.35 0.83 -3.20 0.98 0.00 0.00 173.24 170.71 3gin n ASN 462 N -0.57 -2.68 -4.73 7.02 5.15 -1.26 -1.07 115.26 117.11 3gin n ASN 462 Ca -0.05 -0.76 -0.41 0.00 -0.60 0.00 0.00 54.58 52.76 3gin n ASN 462 Cb 0.59 -4.50 -0.03 0.00 -0.53 0.00 0.00 39.78 35.31 3gin n ASN 462 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3gin s VAL 463 N -3.51 3.60 -0.06 3.44 1.01 -1.26 -4.10 120.40 119.52 3gin s VAL 463 Ca 0.12 1.31 -0.05 0.00 0.00 0.00 0.00 61.98 63.36 3gin s VAL 463 Cb -0.03 -3.84 0.02 0.00 0.00 0.00 0.00 36.38 32.54 3gin s VAL 463 CO 0.78 0.19 0.15 -0.54 0.00 0.00 0.00 175.10 175.68 3gin s LYS 464 N -0.03 0.15 0.00 2.72 1.02 -0.24 -4.90 119.74 118.46 3gin s LYS 464 Ca 0.54 0.25 0.00 0.00 0.02 0.00 0.00 55.97 56.78 3gin s LYS 464 Cb -0.33 0.01 0.00 0.00 -0.52 0.00 0.00 37.83 37.00 3gin s LYS 464 CO 0.36 -0.06 0.00 0.28 -0.92 0.00 0.00 175.35 175.01 3gin n VAL 465 N 3.33 0.00 -0.74 3.17 0.31 -1.26 0.36 118.33 123.50 3gin n VAL 465 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 3gin n VAL 465 Cb 0.57 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.50 3gin n VAL 465 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gin n ALA 482 N -3.00 -2.13 -2.90 3.52 0.00 -1.26 -4.96 120.51 109.78 3gin n ALA 482 Ca 0.00 0.20 -0.33 0.00 0.00 0.00 0.00 53.44 53.31 3gin n ALA 482 Cb 0.00 -0.90 -0.14 0.00 0.00 0.00 0.00 19.45 18.40 3gin n ALA 482 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gin s LEU 483 N -2.05 2.63 0.04 0.00 1.43 -1.26 -5.10 118.68 114.37 3gin s LEU 483 Ca 0.00 -0.32 0.06 0.00 -1.03 0.00 0.00 54.13 52.84 3gin s LEU 483 Cb 0.00 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 3gin s LEU 483 CO 0.00 0.22 -0.16 0.00 0.23 0.00 0.00 176.35 176.64 3gin s ALA 484 N 0.02 1.35 0.34 4.21 0.00 -1.26 -1.86 121.76 124.55 3gin s ALA 484 Ca -0.05 -0.90 -0.11 0.00 0.00 0.00 0.00 51.96 50.90 3gin s ALA 484 Cb -0.14 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.77 3gin s ALA 484 CO 0.04 0.27 0.63 0.00 0.00 0.00 0.00 175.76 176.70 3gin s LEU 486 N -3.11 4.22 0.00 0.00 1.43 -1.26 -0.92 118.68 119.05 3gin s LEU 486 Ca 0.21 2.40 0.00 0.00 -1.03 0.00 0.00 54.13 55.71 3gin s LEU 486 Cb -0.03 -3.97 0.00 0.00 0.03 0.00 0.00 46.19 42.22 3gin s LEU 486 CO 0.14 -0.67 0.00 0.61 0.23 0.00 0.00 176.35 176.66 3gin n GLY 487 N 0.67 5.68 3.51 -3.19 0.00 0.87 -4.67 105.19 108.06 3gin n GLY 487 Ca 0.04 -1.98 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 3gin n GLY 487 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gin s SER 488 N 0.44 4.42 0.23 1.61 0.01 -1.26 -3.28 113.70 115.87 3gin s SER 488 Ca 0.00 -0.13 -0.27 0.00 1.31 0.00 0.00 55.95 56.86 3gin s SER 488 Cb 0.00 -1.26 -0.09 0.00 0.21 0.00 0.00 66.02 64.89 3gin s SER 488 CO 0.00 0.30 0.87 -2.16 0.41 0.00 0.00 173.24 172.66 3gin s PRO 489 N -0.43 4.66 0.00 12.44 0.04 -1.26 -4.75 135.00 145.70 3gin s PRO 489 Ca 0.06 1.30 0.12 0.00 0.04 0.00 0.00 61.00 62.52 3gin s PRO 489 Cb -0.12 -3.16 0.28 0.00 0.04 0.00 0.00 34.50 31.54 3gin s PRO 489 CO 0.02 0.49 1.19 -1.13 0.04 0.00 0.00 177.00 177.61 3gin n SER 490 N 1.30 2.80 -4.21 6.66 3.41 -1.21 -0.81 113.62 121.57 3gin n SER 490 Ca -0.03 -1.88 -0.30 0.00 -0.26 0.00 0.00 58.87 56.41 3gin n SER 490 Cb 0.48 -0.19 -0.16 0.00 -0.26 0.00 0.00 64.21 64.08 3gin n SER 490 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3gin s THR 491 N -1.02 1.81 -0.07 6.66 2.01 -1.26 -0.16 115.64 123.62 3gin s THR 491 Ca 0.23 -0.92 -0.00 0.00 0.31 0.00 0.00 61.69 61.31 3gin s THR 491 Cb 0.13 -1.55 -0.03 0.00 0.01 0.00 0.00 72.50 71.06 3gin s THR 491 CO 0.17 0.51 -0.03 0.00 -0.69 0.00 0.00 174.62 174.59 3gin s ALA 492 N 0.02 3.16 -0.13 7.40 0.00 0.05 -4.86 121.76 127.40 3gin s ALA 492 Ca -0.07 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 3gin s ALA 492 Cb -0.14 -1.35 -0.04 0.00 0.00 0.00 0.00 23.12 21.59 3gin s ALA 492 CO 0.04 0.59 0.03 -0.08 0.00 0.00 0.00 175.76 176.34 3gin s THR 493 N -0.88 4.57 -0.16 0.00 -1.32 -0.71 -0.72 115.64 116.42 3gin s THR 493 Ca 0.14 -0.13 0.01 0.00 -1.21 0.00 0.00 61.69 60.50 3gin s THR 493 Cb -0.11 -2.99 0.02 0.00 -1.51 0.00 0.00 72.50 67.91 3gin s THR 493 CO 0.03 0.55 -0.19 -0.69 -2.21 0.00 0.00 174.62 172.11 3gin s VAL 494 N -0.36 1.93 -0.24 5.08 1.01 0.32 -1.10 120.40 127.03 3gin s VAL 494 Ca 0.08 -0.87 -0.10 0.00 0.00 0.00 0.00 61.98 61.09 3gin s VAL 494 Cb -0.12 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 3gin s VAL 494 CO 0.02 0.52 0.13 -0.89 0.00 0.00 0.00 175.10 174.88 3gin s THR 495 N 1.17 5.09 -0.21 3.92 2.01 -0.77 -0.35 115.64 126.50 3gin s THR 495 Ca 0.01 0.09 -0.14 0.00 0.31 0.00 0.00 61.69 61.95 3gin s THR 495 Cb -0.14 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 3gin s THR 495 CO -0.09 0.35 0.33 -0.63 -0.69 0.00 0.00 174.62 173.89 3gin s ILE 496 N 1.14 5.25 -0.21 1.82 1.01 0.14 -1.88 121.20 128.46 3gin s ILE 496 Ca 0.06 0.55 -0.13 0.00 0.00 0.00 0.00 60.65 61.13 3gin s ILE 496 Cb -0.14 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 3gin s ILE 496 CO 0.05 0.28 0.29 -0.36 0.00 0.00 0.00 174.94 175.20 3gin s PHE 497 N 1.23 3.37 0.35 3.97 0.40 0.50 -1.80 117.98 126.00 3gin s PHE 497 Ca 0.16 0.47 -0.28 0.00 -0.60 0.00 0.00 56.93 56.68 3gin s PHE 497 Cb -0.14 -2.39 -0.10 0.00 0.51 0.00 0.00 43.02 40.89 3gin s PHE 497 CO 0.07 0.07 1.35 0.34 0.70 0.00 0.00 175.22 177.75 3gin s ASP 498 N 0.91 6.60 -0.05 1.36 -1.08 -1.26 -1.25 116.67 121.90 3gin s ASP 498 Ca 0.14 2.77 0.10 0.00 -0.52 0.00 0.00 52.55 55.04 3gin s ASP 498 Cb -0.14 -2.65 0.25 0.00 -1.46 0.00 0.00 42.92 38.92 3gin s ASP 498 CO 0.06 -0.66 1.19 -0.90 0.52 0.00 0.00 175.17 175.38 3gin n ASP 499 N 0.62 2.75 -4.90 -0.34 5.75 -1.26 -4.88 116.55 114.29 3gin n ASP 499 Ca 0.01 -2.32 -0.21 0.00 -0.01 0.00 0.00 54.79 52.26 3gin n ASP 499 Cb 0.41 -0.24 -0.03 0.00 -1.03 0.00 0.00 41.12 40.23 3gin n ASP 499 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 3gin s ASP 500 N -1.40 5.70 0.00 -1.12 1.01 -1.26 -5.11 116.67 114.49 3gin s ASP 500 Ca 0.21 -0.25 0.00 0.00 0.71 0.00 0.00 52.55 53.22 3gin s ASP 500 Cb 0.14 -1.32 0.00 0.00 1.01 0.00 0.00 42.92 42.75 3gin s ASP 500 CO 0.08 -0.23 0.00 1.57 0.21 0.00 0.00 175.17 176.80