#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 2.45 0.18 0.52 0.11 -1.26 -4.39 120.40 118.02 3gin s VAL 371 Ca 0.00 -0.95 -0.30 0.00 -2.93 0.00 0.00 61.98 57.80 3gin s VAL 371 Cb 0.00 -2.14 -0.08 0.00 -1.53 0.00 0.00 36.38 32.63 3gin s VAL 371 CO 0.00 0.40 1.28 -0.44 -3.33 0.00 0.00 175.10 173.01 3gin s SER 372 N 1.31 6.95 -0.13 3.54 0.01 0.11 -3.52 113.70 121.97 3gin s SER 372 Ca 0.03 2.33 -0.02 0.00 1.31 0.00 0.00 55.95 59.60 3gin s SER 372 Cb -0.15 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.45 3gin s SER 372 CO -0.09 -0.49 -0.05 -0.54 0.41 0.00 0.00 173.24 172.48 3gin s LYS 373 N -0.02 3.37 -0.16 12.44 -0.14 0.10 -0.74 119.74 134.60 3gin s LYS 373 Ca 0.56 -0.53 -0.03 0.00 -1.36 0.00 0.00 55.97 54.62 3gin s LYS 373 Cb -0.35 -2.81 -0.02 0.00 -1.68 0.00 0.00 37.83 32.97 3gin s LYS 373 CO 0.37 0.38 -0.06 0.42 -0.76 0.00 0.00 175.35 175.70 3gin s ILE 374 N -0.03 3.63 0.01 2.17 -1.09 -0.39 -2.07 121.20 123.43 3gin s ILE 374 Ca 0.01 -0.45 -0.28 0.00 -2.23 0.00 0.00 60.65 57.70 3gin s ILE 374 Cb -0.13 -2.58 0.09 0.00 -1.58 0.00 0.00 42.46 38.26 3gin s ILE 374 CO 0.03 0.49 0.81 0.72 -1.23 0.00 0.00 174.94 175.76 3gin s PHE 375 N 0.48 -0.43 0.27 3.97 -0.71 -0.92 0.40 117.98 121.05 3gin s PHE 375 Ca -0.05 0.38 -0.29 0.00 -1.04 0.00 0.00 56.93 55.92 3gin s PHE 375 Cb -0.15 0.52 -0.09 0.00 -1.21 0.00 0.00 43.02 42.09 3gin s PHE 375 CO 0.03 -0.60 1.18 -0.06 -1.34 0.00 0.00 175.22 174.43 3gin s PHE 376 N -2.85 3.41 0.48 3.49 0.40 -0.23 0.60 117.98 123.28 3gin s PHE 376 Ca 0.02 1.56 0.17 0.00 -0.60 0.00 0.00 56.93 58.08 3gin s PHE 376 Cb -0.01 -3.42 1.18 0.00 0.51 0.00 0.00 43.02 41.28 3gin s PHE 376 CO -0.07 -1.05 2.03 1.49 0.70 0.00 0.00 175.22 178.33 3gin h GLU 377 N 4.03 0.20 -3.67 0.44 4.81 -1.10 -3.40 114.58 115.88 3gin h GLU 377 Ca -0.47 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 58.62 3gin h GLU 377 Cb 1.22 -0.04 -0.19 0.00 0.63 0.00 0.00 28.75 30.37 3gin h GLU 377 CO 0.68 0.13 -0.49 1.14 -0.73 0.00 0.00 179.01 179.74 3gin s GLN 378 N -5.21 0.57 0.44 1.92 -2.07 -1.26 -5.06 119.66 108.98 3gin s GLN 378 Ca -0.06 -0.62 0.24 0.00 -1.82 0.00 0.00 55.36 53.10 3gin s GLN 378 Cb 0.19 0.23 0.53 0.00 -1.09 0.00 0.00 33.01 32.86 3gin s GLN 378 CO 0.72 -0.14 1.67 0.78 -1.32 0.00 0.00 175.29 177.00 3gin h GLY 379 N 3.84 0.00 -5.36 2.60 0.00 -1.89 -3.46 103.07 98.80 3gin h GLY 379 Ca -0.32 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.66 3gin h GLY 379 CO 0.47 0.00 -0.76 -1.59 0.00 0.00 0.00 176.54 174.65 3gin s THR 380 N -3.29 0.51 0.07 4.70 2.01 -1.26 -0.95 115.64 117.43 3gin s THR 380 Ca 0.05 -0.27 0.05 0.00 0.31 0.00 0.00 61.69 61.84 3gin s THR 380 Cb 0.06 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 72.11 3gin s THR 380 CO 0.66 0.15 -0.15 -0.31 -0.69 0.00 0.00 174.62 174.28 3gin s TYR 381 N -0.11 1.25 0.09 4.92 2.02 0.05 -4.95 117.35 120.63 3gin s TYR 381 Ca 0.02 -0.45 0.06 0.00 -0.37 0.00 0.00 57.07 56.33 3gin s TYR 381 Cb -0.03 -0.71 -0.03 0.00 -0.40 0.00 0.00 41.96 40.79 3gin s TYR 381 CO -0.00 0.06 -0.15 -0.65 -1.57 0.00 0.00 175.55 173.24 3gin s GLN 382 N -1.69 0.90 0.03 -0.62 -0.21 -1.26 -0.81 119.66 116.00 3gin s GLN 382 Ca -0.01 -1.04 -0.27 0.00 0.02 0.00 0.00 55.36 54.05 3gin s GLN 382 Cb -0.10 -0.90 0.07 0.00 1.00 0.00 0.00 33.01 33.09 3gin s GLN 382 CO 0.02 0.19 0.67 0.00 -2.12 0.00 0.00 175.29 174.06 3gin s LEU 384 N -1.91 3.70 0.62 0.00 1.43 -1.26 0.17 118.68 121.42 3gin s LEU 384 Ca -0.05 1.97 0.34 0.00 -1.03 0.00 0.00 54.13 55.37 3gin s LEU 384 Cb -0.00 -4.56 1.97 0.00 0.03 0.00 0.00 46.19 43.62 3gin s LEU 384 CO -0.01 -1.07 2.25 -0.08 0.23 0.00 0.00 176.35 177.67 3gin h GLU 385 N 1.06 0.00 -0.67 1.70 4.81 -1.37 -2.14 114.58 117.96 3gin h GLU 385 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 3gin h GLU 385 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 3gin h GLU 385 CO 0.58 0.00 0.00 0.27 -0.73 0.00 0.00 179.01 179.13 3gin n ASN 386 N -3.58 4.15 0.12 1.04 6.94 -1.26 -2.92 115.26 119.76 3gin n ASN 386 Ca -0.02 -2.22 0.13 0.00 -0.02 0.00 0.00 54.58 52.44 3gin n ASN 386 Cb 0.13 -0.52 0.46 0.00 -2.36 0.00 0.00 39.78 37.49 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 0.58 2.05 2.97 0.00 0.00 -1.26 -4.84 105.19 104.69 3gin n GLY 388 Ca 0.04 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 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 0.12 -0.13 2.61 -4.23 -1.26 0.21 115.64 112.96 3gin s THR 389 Ca 0.00 -0.79 -0.04 0.00 -1.18 0.00 0.00 61.69 59.67 3gin s THR 389 Cb 0.00 -0.25 -0.04 0.00 1.34 0.00 0.00 72.50 73.56 3gin s THR 389 CO 0.00 -0.42 0.03 0.54 -0.54 0.00 0.00 174.62 174.23 3gin s VAL 390 N -1.25 4.56 -0.23 2.29 0.11 0.21 -4.91 120.40 121.18 3gin s VAL 390 Ca -0.13 -0.14 -0.11 0.00 -2.93 0.00 0.00 61.98 58.67 3gin s VAL 390 Cb -0.09 -2.98 -0.05 0.00 -1.53 0.00 0.00 36.38 31.73 3gin s VAL 390 CO -0.01 0.55 0.19 0.00 -3.33 0.00 0.00 175.10 172.50 3gin s ALA 391 N -0.35 3.61 0.08 1.54 0.00 -1.26 -0.70 121.76 124.68 3gin s ALA 391 Ca 0.08 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 51.27 3gin s ALA 391 Cb -0.12 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 3gin s ALA 391 CO 0.02 -0.19 -0.06 -0.51 0.00 0.00 0.00 175.76 175.02 3gin s LEU 392 N 1.06 3.21 -0.17 0.00 1.02 0.21 -4.96 118.68 119.05 3gin s LEU 392 Ca 0.09 -0.27 -0.02 0.00 0.02 0.00 0.00 54.13 53.96 3gin s LEU 392 Cb -0.14 -1.96 -0.01 0.00 0.02 0.00 0.00 46.19 44.11 3gin s LEU 392 CO 0.05 0.20 -0.09 -0.89 0.02 0.00 0.00 176.35 175.63 3gin s THR 393 N -1.21 3.16 -0.24 5.49 2.01 -1.26 -0.37 115.64 123.22 3gin s THR 393 Ca 0.22 -0.60 -0.12 0.00 0.31 0.00 0.00 61.69 61.50 3gin s THR 393 Cb -0.11 -2.38 -0.05 0.00 0.01 0.00 0.00 72.50 69.97 3gin s THR 393 CO 0.14 0.48 0.23 -0.63 -0.69 0.00 0.00 174.62 174.16 3gin s ILE 394 N 0.88 5.30 -0.11 1.82 1.01 0.17 -0.45 121.20 129.82 3gin s ILE 394 Ca -0.02 0.32 -0.06 0.00 0.00 0.00 0.00 60.65 60.88 3gin s ILE 394 Cb -0.15 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 3gin s ILE 394 CO 0.00 0.29 0.14 -0.63 0.00 0.00 0.00 174.94 174.74 3gin s ILE 395 N 1.33 5.46 -0.12 2.92 -1.09 0.20 -1.03 121.20 128.86 3gin s ILE 395 Ca 0.10 0.17 -0.01 0.00 -2.23 0.00 0.00 60.65 58.68 3gin s ILE 395 Cb -0.14 -3.39 -0.03 0.00 -1.58 0.00 0.00 42.46 37.32 3gin s ILE 395 CO 0.07 0.60 -0.07 -0.60 -1.23 0.00 0.00 174.94 173.70 3gin s ARG 396 N -1.09 3.25 -0.06 2.79 3.52 0.15 -2.17 118.95 125.35 3gin s ARG 396 Ca 0.16 -0.57 -0.05 0.00 -0.13 0.00 0.00 55.73 55.13 3gin s ARG 396 Cb -0.12 -2.72 0.02 0.00 -1.56 0.00 0.00 34.95 30.57 3gin s ARG 396 CO 0.05 0.39 0.15 0.50 -0.81 0.00 0.00 175.30 175.58 3gin s ARG 397 N -0.07 0.17 0.00 5.12 3.52 -0.88 -4.62 118.95 122.19 3gin s ARG 397 Ca 0.00 0.23 0.00 0.00 -0.13 0.00 0.00 55.73 55.83 3gin s ARG 397 Cb -0.13 0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.31 3gin s ARG 397 CO 0.03 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.89 3gin n GLY 398 N 3.12 -1.50 7.00 8.12 0.00 -1.26 -0.73 105.19 119.95 3gin n GLY 398 Ca -0.14 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.76 0.10 3.37 -0.02 0.00 -1.23 -3.82 105.19 101.83 3gin n GLY 399 Ca 0.00 -0.95 -0.45 0.00 0.00 0.00 0.00 46.02 44.62 3gin n GLY 399 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gin s ASP 400 N -4.00 6.46 0.00 1.61 1.01 -1.26 -4.87 116.67 115.61 3gin s ASP 400 Ca 0.00 -1.99 0.11 0.00 0.71 0.00 0.00 52.55 51.38 3gin s ASP 400 Cb 0.00 -2.28 0.51 0.00 1.01 0.00 0.00 42.92 42.16 3gin s ASP 400 CO 0.00 -0.91 1.32 0.18 0.21 0.00 0.00 175.17 175.97 3gin n LEU 401 N 5.51 0.00 0.21 1.23 4.77 -1.26 -1.43 117.00 126.04 3gin n LEU 401 Ca 0.04 0.42 0.07 0.00 -0.03 0.00 0.00 56.01 56.51 3gin n LEU 401 Cb 0.45 -0.42 0.46 0.00 -2.33 0.00 0.00 43.42 41.58 3gin n LEU 401 CO 0.48 -0.26 0.79 0.71 -1.33 0.00 0.00 177.39 177.78 3gin h THR 402 N 0.00 0.91 -4.16 -5.08 1.35 -1.93 0.44 112.91 104.44 3gin h THR 402 Ca 0.00 -1.13 -0.52 0.00 -0.55 0.00 0.00 66.41 64.22 3gin h THR 402 Cb 0.16 1.67 0.11 0.00 -1.73 0.00 0.00 68.15 68.35 3gin h THR 402 CO 0.00 0.29 0.40 0.20 -0.25 0.00 0.00 175.52 176.16 3gin s ASN 403 N -6.52 5.03 0.01 5.36 0.02 -0.51 -4.37 114.94 113.96 3gin s ASN 403 Ca -0.02 2.16 -0.24 0.00 -1.02 0.00 0.00 52.86 53.75 3gin s ASN 403 Cb 0.13 -2.57 -0.05 0.00 0.02 0.00 0.00 41.25 38.78 3gin s ASN 403 CO 0.67 -1.69 0.72 -0.89 0.02 0.00 0.00 177.10 175.93 3gin s THR 404 N -2.06 4.84 -0.05 1.60 2.01 -1.00 -4.09 115.64 116.90 3gin s THR 404 Ca 0.71 1.51 0.05 0.00 0.31 0.00 0.00 61.69 64.27 3gin s THR 404 Cb -0.24 -4.06 -0.01 0.00 0.01 0.00 0.00 72.50 68.20 3gin s THR 404 CO 0.38 0.35 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.78 3gin s VAL 405 N 0.12 1.61 -0.09 3.82 1.01 -0.21 -1.35 120.40 125.31 3gin s VAL 405 Ca 0.37 -0.82 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 3gin s VAL 405 Cb -0.19 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 3gin s VAL 405 CO 0.21 0.46 -0.07 -0.36 0.00 0.00 0.00 175.10 175.33 3gin s PHE 406 N -0.05 2.93 0.01 5.22 0.40 0.16 -0.66 117.98 125.99 3gin s PHE 406 Ca -0.03 -0.13 0.01 0.00 -0.60 0.00 0.00 56.93 56.19 3gin s PHE 406 Cb -0.12 -1.77 -0.01 0.00 0.51 0.00 0.00 43.02 41.63 3gin s PHE 406 CO 0.02 0.19 -0.05 0.54 0.70 0.00 0.00 175.22 176.63 3gin s VAL 407 N -0.44 0.34 0.21 -0.44 0.11 -0.92 -1.16 120.40 118.10 3gin s VAL 407 Ca 0.06 -0.38 -0.09 0.00 -2.93 0.00 0.00 61.98 58.64 3gin s VAL 407 Cb -0.12 -0.33 -0.07 0.00 -1.53 0.00 0.00 36.38 34.33 3gin s VAL 407 CO 0.02 -0.04 0.52 -1.81 -3.33 0.00 0.00 175.10 170.46 3gin s ASP 408 N -0.45 6.61 0.14 3.54 1.01 0.67 -1.13 116.67 127.06 3gin s ASP 408 Ca -0.02 0.87 0.06 0.00 0.71 0.00 0.00 52.55 54.17 3gin s ASP 408 Cb -0.04 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.65 3gin s ASP 408 CO -0.00 -0.05 -0.14 0.72 0.21 0.00 0.00 175.17 175.91 3gin s PHE 409 N -1.78 1.48 -0.27 4.23 -0.12 0.65 -1.37 117.98 120.80 3gin s PHE 409 Ca 0.46 -0.57 -0.17 0.00 -0.05 0.00 0.00 56.93 56.60 3gin s PHE 409 Cb -0.11 -0.76 0.08 0.00 -0.63 0.00 0.00 43.02 41.60 3gin s PHE 409 CO 0.22 0.19 0.68 0.50 -0.05 0.00 0.00 175.22 176.75 3gin s ARG 410 N -2.91 0.71 0.45 1.99 3.52 -0.57 -1.38 118.95 120.77 3gin s ARG 410 Ca 0.12 1.16 -0.21 0.00 -0.13 0.00 0.00 55.73 56.67 3gin s ARG 410 Cb -0.04 0.18 -0.10 0.00 -1.56 0.00 0.00 34.95 33.43 3gin s ARG 410 CO 0.04 -0.14 0.98 0.95 -0.81 0.00 0.00 175.30 176.32 3gin s THR 411 N 1.39 4.17 0.00 4.11 -4.23 -0.57 -0.09 115.64 120.41 3gin s THR 411 Ca -0.08 1.36 0.02 0.00 -1.18 0.00 0.00 61.69 61.81 3gin s THR 411 Cb -0.05 -3.55 -0.01 0.00 1.34 0.00 0.00 72.50 70.23 3gin s THR 411 CO -0.16 -0.28 -0.08 -0.70 -0.54 0.00 0.00 174.62 172.86 3gin s GLU 412 N -3.17 0.62 0.28 3.99 2.12 0.73 -4.88 118.70 118.39 3gin s GLU 412 Ca 0.64 -0.34 -0.30 0.00 0.36 0.00 0.00 54.97 55.33 3gin s GLU 412 Cb -0.12 -0.59 -0.13 0.00 0.26 0.00 0.00 34.13 33.56 3gin s GLU 412 CO 0.16 0.16 1.46 -0.25 -0.54 0.00 0.00 175.26 176.24 3gin n ASP 413 N 2.72 3.15 0.00 -1.70 9.92 -1.26 -0.42 116.55 128.97 3gin n ASP 413 Ca -0.14 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.27 3gin n ASP 413 Cb 0.57 -1.50 0.00 0.00 -0.64 0.00 0.00 41.12 39.55 3gin n ASP 413 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3gin n GLY 414 N 1.91 0.32 0.17 0.44 0.00 -0.99 -4.65 105.19 102.39 3gin n GLY 414 Ca 0.09 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.21 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 0.16 -3.59 2.61 1.35 -1.83 -3.45 112.91 108.17 3gin h THR 415 Ca 0.00 -1.25 -0.52 0.00 -0.55 0.00 0.00 66.41 64.09 3gin h THR 415 Cb 0.00 1.94 -0.03 0.00 -1.73 0.00 0.00 68.15 68.33 3gin h THR 415 CO 0.00 0.09 0.10 0.00 -0.25 0.00 0.00 175.52 175.47 3gin s ALA 416 N -3.19 3.40 -0.15 6.62 0.00 0.08 -4.78 121.76 123.74 3gin s ALA 416 Ca 0.04 0.15 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 3gin s ALA 416 Cb 0.07 -2.81 -0.01 0.00 0.00 0.00 0.00 23.12 20.36 3gin s ALA 416 CO 0.72 0.33 -0.10 -0.80 0.00 0.00 0.00 175.76 175.91 3gin s ASN 417 N -1.73 4.14 0.16 0.00 0.01 -1.26 -4.48 114.94 111.77 3gin s ASN 417 Ca 0.44 -0.33 -0.34 0.00 -0.71 0.00 0.00 52.86 51.93 3gin s ASN 417 Cb -0.16 -1.65 -0.14 0.00 0.41 0.00 0.00 41.25 39.71 3gin s ASN 417 CO 0.20 0.12 1.58 0.00 -1.51 0.00 0.00 177.10 177.49 3gin n ALA 418 N 3.85 1.32 0.00 0.60 0.00 -1.26 -1.05 120.51 123.97 3gin n ALA 418 Ca -0.18 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.70 3gin n ALA 418 Cb 0.52 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.62 3gin n ALA 418 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gin n GLY 419 N 3.40 3.30 0.02 0.00 0.00 0.21 -4.77 105.19 107.36 3gin n GLY 419 Ca 0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.17 3gin n GLY 419 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gin n SER 420 N 0.01 3.87 -0.05 1.61 3.41 -0.81 -4.84 113.62 116.82 3gin n SER 420 Ca 0.00 -0.01 -0.02 0.00 -0.26 0.00 0.00 58.87 58.57 3gin n SER 420 Cb 0.00 0.14 -0.12 0.00 -0.26 0.00 0.00 64.21 63.97 3gin n SER 420 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3gin n ASP 421 N -2.45 1.30 -3.77 4.04 8.00 -0.21 -4.72 116.55 118.73 3gin n ASP 421 Ca -0.06 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.38 3gin n ASP 421 Cb 0.58 1.15 -0.02 0.00 -0.02 0.00 0.00 41.12 42.81 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 -2.61 -0.20 -0.23 1.24 1.13 -1.24 -1.99 117.35 113.45 3gin s TYR 422 Ca -0.07 -0.17 -0.09 0.00 -1.41 0.00 0.00 57.07 55.33 3gin s TYR 422 Cb 0.06 0.67 -0.04 0.00 -1.10 0.00 0.00 41.96 41.55 3gin s TYR 422 CO 0.63 -1.03 0.12 -1.21 -2.51 0.00 0.00 175.55 171.55 3gin s GLU 423 N -3.64 3.94 0.01 -3.49 2.02 -0.66 0.66 118.70 117.55 3gin s GLU 423 Ca 0.10 -0.34 -0.32 0.00 0.02 0.00 0.00 54.97 54.44 3gin s GLU 423 Cb -0.04 -3.42 -0.11 0.00 0.10 0.00 0.00 34.13 30.67 3gin s GLU 423 CO 0.03 0.04 1.90 0.34 0.02 0.00 0.00 175.26 177.59 3gin n PHE 424 N 4.30 2.45 -4.74 1.61 7.35 -1.26 -4.60 117.46 122.58 3gin n PHE 424 Ca -0.16 -0.17 -0.25 0.00 -0.76 0.00 0.00 57.45 56.12 3gin n PHE 424 Cb 0.52 -2.73 -0.16 0.00 0.35 0.00 0.00 39.48 37.46 3gin n PHE 424 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 3gin s THR 425 N 3.83 1.29 0.07 -2.13 2.01 -1.26 -5.04 115.64 114.41 3gin s THR 425 Ca 0.89 -0.64 -0.08 0.00 0.31 0.00 0.00 61.69 62.17 3gin s THR 425 Cb -0.55 -1.12 -0.00 0.00 0.01 0.00 0.00 72.50 70.84 3gin s THR 425 CO 0.45 0.38 0.17 -1.83 -0.69 0.00 0.00 174.62 173.09 3gin s GLU 426 N 0.09 0.78 0.00 4.92 -1.05 -1.26 -1.51 118.70 120.67 3gin s GLU 426 Ca -0.04 -0.91 0.00 0.00 -0.15 0.00 0.00 54.97 53.87 3gin s GLU 426 Cb -0.11 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 33.90 3gin s GLU 426 CO 0.02 -0.24 0.00 0.41 0.95 0.00 0.00 175.26 176.40 3gin n GLY 427 N 0.13 -1.33 3.26 -3.83 0.00 -0.48 -4.98 105.19 97.96 3gin n GLY 427 Ca -0.16 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.37 2.29 -0.07 2.61 2.01 -1.26 -0.25 115.64 118.60 3gin s THR 428 Ca 0.00 -0.94 -0.09 0.00 0.31 0.00 0.00 61.69 60.97 3gin s THR 428 Cb 0.00 -1.89 -0.05 0.00 0.01 0.00 0.00 72.50 70.58 3gin s THR 428 CO 0.00 0.55 0.22 -0.69 -0.69 0.00 0.00 174.62 174.02 3gin s VAL 429 N 0.26 5.36 -0.24 3.82 1.01 -0.28 -4.96 120.40 125.37 3gin s VAL 429 Ca -0.15 0.36 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 3gin s VAL 429 Cb -0.17 -3.50 0.02 0.00 0.00 0.00 0.00 36.38 32.73 3gin s VAL 429 CO 0.08 0.58 -0.08 -0.69 0.00 0.00 0.00 175.10 174.98 3gin s VAL 430 N -1.08 2.75 -0.64 2.92 1.01 -1.26 -2.15 120.40 121.95 3gin s VAL 430 Ca 0.19 -1.01 -0.25 0.00 0.00 0.00 0.00 61.98 60.92 3gin s VAL 430 Cb -0.13 -2.37 0.05 0.00 0.00 0.00 0.00 36.38 33.93 3gin s VAL 430 CO 0.08 0.25 1.05 -0.36 0.00 0.00 0.00 175.10 176.12 3gin s PHE 431 N 1.32 2.61 0.83 5.22 0.40 0.16 -4.97 117.98 123.55 3gin s PHE 431 Ca 0.01 -0.19 -0.11 0.00 -0.60 0.00 0.00 56.93 56.04 3gin s PHE 431 Cb -0.16 -4.32 0.09 0.00 0.51 0.00 0.00 43.02 39.13 3gin s PHE 431 CO -0.06 -1.65 1.09 0.15 0.70 0.00 0.00 175.22 175.45 3gin s LYS 432 N 4.49 1.83 -0.15 0.44 1.02 -1.26 -1.04 119.74 125.06 3gin s LYS 432 Ca 0.29 0.86 -0.40 0.00 0.02 0.00 0.00 55.97 56.74 3gin s LYS 432 Cb -0.13 -1.87 -0.18 0.00 -0.52 0.00 0.00 37.83 35.14 3gin s LYS 432 CO 0.15 -1.86 1.46 -2.30 -0.92 0.00 0.00 175.35 171.89 3gin n PRO 433 N -3.63 0.73 0.00 -1.68 -0.02 -1.26 -1.58 135.00 127.57 3gin n PRO 433 Ca 0.07 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3gin n PRO 433 Cb 0.55 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 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 3.11 2.20 3.71 -1.23 0.00 0.16 -4.96 105.19 108.17 3gin n GLY 434 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.45 4.46 -0.01 1.61 2.02 -0.61 -4.94 118.70 120.78 3gin s GLU 435 Ca 0.00 1.67 0.08 0.00 0.02 0.00 0.00 54.97 56.74 3gin s GLU 435 Cb 0.00 -3.39 -0.11 0.00 0.10 0.00 0.00 34.13 30.72 3gin s GLU 435 CO 0.00 -0.22 0.19 0.25 0.02 0.00 0.00 175.26 175.50 3gin n THR 436 N 3.97 0.00 -3.87 3.63 -2.24 -1.26 -4.74 114.28 109.77 3gin n THR 436 Ca 0.08 -0.20 -0.12 0.00 -2.27 0.00 0.00 64.05 61.55 3gin n THR 436 Cb 0.48 0.43 -0.13 0.00 -2.10 0.00 0.00 70.33 69.00 3gin n THR 436 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gin s GLN 437 N -2.41 0.10 -0.01 -0.78 -2.07 -1.26 0.31 119.66 113.54 3gin s GLN 437 Ca -0.02 -0.04 0.02 0.00 -1.82 0.00 0.00 55.36 53.51 3gin s GLN 437 Cb 0.05 0.04 -0.00 0.00 -1.09 0.00 0.00 33.01 32.01 3gin s GLN 437 CO 0.32 -0.02 -0.07 0.15 -1.32 0.00 0.00 175.29 174.35 3gin s LYS 438 N -0.21 0.69 -0.21 9.60 -0.14 -0.20 -4.98 119.74 124.28 3gin s LYS 438 Ca -0.03 -0.26 -0.10 0.00 -1.36 0.00 0.00 55.97 54.23 3gin s LYS 438 Cb -0.02 -0.66 -0.05 0.00 -1.68 0.00 0.00 37.83 35.42 3gin s LYS 438 CO 0.00 0.13 0.13 -2.00 -0.76 0.00 0.00 175.35 172.85 3gin s GLU 439 N -0.01 4.11 0.06 1.68 2.12 -1.26 -0.66 118.70 124.74 3gin s GLU 439 Ca 0.00 -0.26 0.08 0.00 0.36 0.00 0.00 54.97 55.15 3gin s GLU 439 Cb -0.05 -3.44 -0.03 0.00 0.26 0.00 0.00 34.13 30.86 3gin s GLU 439 CO -0.00 0.19 -0.20 0.96 -0.54 0.00 0.00 175.26 175.68 3gin s ILE 440 N 0.66 2.69 0.01 -3.70 -4.36 0.50 -4.97 121.20 112.04 3gin s ILE 440 Ca 0.07 -1.31 0.08 0.00 -0.26 0.00 0.00 60.65 59.23 3gin s ILE 440 Cb -0.12 -2.15 -0.02 0.00 1.25 0.00 0.00 42.46 41.42 3gin s ILE 440 CO 0.01 0.28 -0.24 -0.13 0.24 0.00 0.00 174.94 175.10 3gin s ARG 441 N -1.59 1.78 -0.09 0.37 0.52 -1.26 0.65 118.95 119.33 3gin s ARG 441 Ca 0.15 -0.93 0.03 0.00 -0.52 0.00 0.00 55.73 54.45 3gin s ARG 441 Cb -0.10 -1.81 0.01 0.00 0.52 0.00 0.00 34.95 33.56 3gin s ARG 441 CO 0.06 0.48 -0.16 0.08 0.02 0.00 0.00 175.30 175.78 3gin s VAL 442 N -0.67 1.49 0.31 3.52 1.01 0.13 -4.96 120.40 121.24 3gin s VAL 442 Ca 0.09 -0.68 -0.29 0.00 0.00 0.00 0.00 61.98 61.11 3gin s VAL 442 Cb -0.09 -1.34 -0.10 0.00 0.00 0.00 0.00 36.38 34.85 3gin s VAL 442 CO 0.00 0.44 1.41 -0.83 0.00 0.00 0.00 175.10 176.12 3gin s GLY 443 N 0.65 2.73 -0.13 4.51 0.00 -1.26 -0.62 107.32 113.19 3gin s GLY 443 Ca -0.14 1.37 0.03 0.00 0.00 0.00 0.00 44.72 45.98 3gin s GLY 443 CO 0.04 2.15 -0.22 -0.42 0.00 0.00 0.00 173.10 174.64 3gin s ILE 444 N -0.72 2.06 -0.32 0.90 1.01 0.13 -1.65 121.20 122.62 3gin s ILE 444 Ca 0.54 -0.98 -0.18 0.00 0.00 0.00 0.00 60.65 60.02 3gin s ILE 444 Cb -0.42 -1.82 -0.01 0.00 0.01 0.00 0.00 42.46 40.22 3gin s ILE 444 CO 0.52 0.55 0.52 -0.63 0.00 0.00 0.00 174.94 175.90 3gin s ILE 445 N 0.75 5.03 0.52 2.92 1.01 -0.84 -4.31 121.20 126.27 3gin s ILE 445 Ca -0.09 0.54 -0.19 0.00 0.00 0.00 0.00 60.65 60.91 3gin s ILE 445 Cb -0.16 -3.92 -0.07 0.00 0.01 0.00 0.00 42.46 38.32 3gin s ILE 445 CO -0.00 -0.12 1.07 -0.62 0.00 0.00 0.00 174.94 175.26 3gin s ASP 446 N 1.70 6.06 0.36 3.58 2.15 -1.15 -4.67 116.67 124.69 3gin s ASP 446 Ca 0.20 1.98 0.04 0.00 0.43 0.00 0.00 52.55 55.19 3gin s ASP 446 Cb -0.15 -2.56 -0.03 0.00 -0.30 0.00 0.00 42.92 39.87 3gin s ASP 446 CO 0.12 -0.98 0.14 1.51 -0.17 0.00 0.00 175.17 175.79 3gin s ASP 447 N -2.07 2.25 0.00 -0.34 1.47 -1.26 -5.05 116.67 111.67 3gin s ASP 447 Ca 0.68 -1.59 0.25 0.00 1.18 0.00 0.00 52.55 53.07 3gin s ASP 447 Cb -0.18 0.38 0.46 0.00 -0.34 0.00 0.00 42.92 43.24 3gin s ASP 447 CO 0.25 -0.87 1.38 0.47 0.68 0.00 0.00 175.17 177.08 3gin n ASP 448 N -1.09 1.54 -4.82 2.11 9.92 -1.26 -4.97 116.55 117.97 3gin n ASP 448 Ca -0.02 -1.23 -0.37 0.00 -0.53 0.00 0.00 54.79 52.64 3gin n ASP 448 Cb 0.65 0.25 -0.06 0.00 -0.64 0.00 0.00 41.12 41.32 3gin n ASP 448 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3gin s ILE 449 N -2.43 5.26 -0.29 0.53 1.01 -1.26 -4.78 121.20 119.24 3gin s ILE 449 Ca 0.23 0.55 -0.24 0.00 0.00 0.00 0.00 60.65 61.20 3gin s ILE 449 Cb 0.19 -3.59 -0.00 0.00 0.01 0.00 0.00 42.46 39.07 3gin s ILE 449 CO 0.52 0.54 0.80 0.12 0.00 0.00 0.00 174.94 176.91 3gin s PHE 450 N -0.64 3.24 0.23 3.97 5.36 -1.26 -4.73 117.98 124.15 3gin s PHE 450 Ca 0.19 0.91 -0.02 0.00 -0.96 0.00 0.00 56.93 57.05 3gin s PHE 450 Cb -0.14 -3.16 -0.03 0.00 -0.34 0.00 0.00 43.02 39.35 3gin s PHE 450 CO 0.08 -0.51 0.21 -1.21 -1.46 0.00 0.00 175.22 172.33 3gin s GLU 451 N 2.91 1.36 0.64 10.12 2.02 -1.26 -5.02 118.70 129.47 3gin s GLU 451 Ca 0.33 -1.63 -0.17 0.00 0.02 0.00 0.00 54.97 53.51 3gin s GLU 451 Cb -0.14 0.31 -0.07 0.00 0.10 0.00 0.00 34.13 34.33 3gin s GLU 451 CO 0.11 -0.48 0.48 0.39 0.02 0.00 0.00 175.26 175.78 3gin n GLU 452 N -0.35 0.40 -1.95 1.61 4.71 -1.26 -4.75 120.64 119.05 3gin n GLU 452 Ca 0.02 0.17 -0.37 0.00 -0.01 0.00 0.00 57.16 56.97 3gin n GLU 452 Cb 0.65 -1.72 0.03 0.00 -1.01 0.00 0.00 31.44 29.39 3gin n GLU 452 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3gin s ASP 453 N -1.29 5.36 0.09 1.62 1.01 -1.26 -4.73 116.67 117.47 3gin s ASP 453 Ca 0.66 2.53 0.04 0.00 0.71 0.00 0.00 52.55 56.49 3gin s ASP 453 Cb -0.40 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 40.88 3gin s ASP 453 CO 0.57 -1.49 -0.10 -0.54 0.21 0.00 0.00 175.17 173.81 3gin s LYS 454 N -3.05 0.82 0.18 8.23 1.02 -0.76 -4.99 119.74 121.19 3gin s LYS 454 Ca 0.73 -1.10 0.03 0.00 0.02 0.00 0.00 55.97 55.65 3gin s LYS 454 Cb -0.34 -0.55 -0.05 0.00 -0.52 0.00 0.00 37.83 36.37 3gin s LYS 454 CO 0.39 0.09 -0.03 0.54 -0.92 0.00 0.00 175.35 175.43 3gin s ASN 455 N -2.29 1.50 0.21 2.83 2.20 -1.26 0.41 114.94 118.54 3gin s ASN 455 Ca 0.03 -1.14 -0.15 0.00 -0.94 0.00 0.00 52.86 50.66 3gin s ASN 455 Cb -0.04 0.06 0.01 0.00 -2.00 0.00 0.00 41.25 39.28 3gin s ASN 455 CO 0.00 -0.50 0.50 0.72 -2.94 0.00 0.00 177.10 174.89 3gin s PHE 456 N -3.52 0.07 0.08 1.54 -0.12 -0.48 -0.74 117.98 114.81 3gin s PHE 456 Ca 0.23 -0.43 0.08 0.00 -0.05 0.00 0.00 56.93 56.75 3gin s PHE 456 Cb 0.05 0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.72 3gin s PHE 456 CO 0.04 -0.95 -0.17 -0.51 -0.05 0.00 0.00 175.22 173.59 3gin s LEU 457 N -2.93 2.73 -0.14 -1.99 2.01 0.44 -0.61 118.68 118.20 3gin s LEU 457 Ca 0.14 -0.47 0.01 0.00 0.01 0.00 0.00 54.13 53.82 3gin s LEU 457 Cb -0.01 -1.59 -0.00 0.00 0.01 0.00 0.00 46.19 44.60 3gin s LEU 457 CO 0.02 0.21 -0.17 -0.69 1.01 0.00 0.00 176.35 176.73 3gin s VAL 458 N -1.07 2.57 -0.10 -1.59 1.01 0.10 -0.19 120.40 121.14 3gin s VAL 458 Ca 0.17 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.35 3gin s VAL 458 Cb -0.11 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 3gin s VAL 458 CO 0.09 0.53 -0.13 -1.00 0.00 0.00 0.00 175.10 174.59 3gin s HIS 459 N 0.66 2.79 -0.00 5.22 3.76 0.87 -0.36 115.29 128.22 3gin s HIS 459 Ca -0.09 -0.39 -0.06 0.00 -0.15 0.00 0.00 55.06 54.38 3gin s HIS 459 Cb -0.16 -1.76 -0.05 0.00 1.11 0.00 0.00 32.58 31.73 3gin s HIS 459 CO 0.02 -0.01 0.24 -0.51 -0.85 0.00 0.00 174.74 173.64 3gin s LEU 460 N -0.15 4.37 0.24 0.89 1.43 0.12 -1.51 118.68 124.06 3gin s LEU 460 Ca -0.00 0.51 -0.22 0.00 -1.03 0.00 0.00 54.13 53.39 3gin s LEU 460 Cb -0.13 -2.62 0.04 0.00 0.03 0.00 0.00 46.19 43.50 3gin s LEU 460 CO 0.03 0.27 0.81 -0.94 0.23 0.00 0.00 176.35 176.75 3gin s SER 461 N -1.70 -0.22 -1.19 2.29 1.04 -0.47 -4.88 113.70 108.58 3gin s SER 461 Ca 0.27 -0.56 -0.02 0.00 0.48 0.00 0.00 55.95 56.11 3gin s SER 461 Cb -0.13 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 3gin s SER 461 CO 0.16 -1.20 0.90 -3.20 0.98 0.00 0.00 173.24 170.88 3gin n ASN 462 N -0.51 -2.92 -4.71 7.02 5.15 -1.26 -0.23 115.26 117.79 3gin n ASN 462 Ca -0.05 -0.71 -0.42 0.00 -0.60 0.00 0.00 54.58 52.80 3gin n ASN 462 Cb 0.60 -4.79 -0.03 0.00 -0.53 0.00 0.00 39.78 35.03 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 -3.45 3.64 0.03 3.44 1.01 -1.26 -4.13 120.40 119.68 3gin s VAL 463 Ca 0.12 1.17 0.02 0.00 0.00 0.00 0.00 61.98 63.28 3gin s VAL 463 Cb -0.02 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 3gin s VAL 463 CO 0.76 0.08 -0.06 -0.54 0.00 0.00 0.00 175.10 175.34 3gin s LYS 464 N 1.20 0.46 0.10 2.72 1.02 -0.31 -4.94 119.74 119.99 3gin s LYS 464 Ca 0.62 -0.68 0.08 0.00 0.02 0.00 0.00 55.97 56.01 3gin s LYS 464 Cb -0.33 -0.19 -0.04 0.00 -0.52 0.00 0.00 37.83 36.75 3gin s LYS 464 CO 0.29 0.03 -0.16 0.08 -0.92 0.00 0.00 175.35 174.67 3gin s VAL 465 N -1.31 2.97 -0.29 3.17 1.01 -1.26 -0.66 120.40 124.02 3gin s VAL 465 Ca -0.11 -1.38 0.18 0.00 0.00 0.00 0.00 61.98 60.67 3gin s VAL 465 Cb -0.09 -2.35 0.48 0.00 0.00 0.00 0.00 36.38 34.42 3gin s VAL 465 CO 0.00 0.15 1.09 -1.20 0.00 0.00 0.00 175.10 175.13 3gin n SER 466 N 0.91 2.32 0.00 3.32 7.64 -0.46 -5.00 113.62 122.36 3gin n SER 466 Ca -0.15 -2.59 0.00 0.00 1.01 0.00 0.00 58.87 57.14 3gin n SER 466 Cb 0.52 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 3gin n SER 466 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3gin n LEU 483 N -0.48 0.00 -3.80 -3.43 4.77 -1.26 -2.38 117.00 110.42 3gin n LEU 483 Ca 0.16 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.00 3gin n LEU 483 Cb 0.82 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.76 3gin n LEU 483 CO 0.19 0.00 -0.34 0.00 -1.33 0.00 0.00 177.39 175.91 3gin s ALA 484 N -1.35 0.01 0.24 -1.18 0.00 -1.26 0.09 121.76 118.31 3gin s ALA 484 Ca 0.00 0.24 -0.17 0.00 0.00 0.00 0.00 51.96 52.02 3gin s ALA 484 Cb 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.96 3gin s ALA 484 CO 0.00 -0.08 0.58 0.00 0.00 0.00 0.00 175.76 176.26 3gin s LEU 486 N -2.93 4.37 0.00 0.00 1.43 -1.26 -1.27 118.68 119.03 3gin s LEU 486 Ca 0.13 2.64 0.00 0.00 -1.03 0.00 0.00 54.13 55.88 3gin s LEU 486 Cb -0.03 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.60 3gin s LEU 486 CO 0.03 -0.83 0.00 0.61 0.23 0.00 0.00 176.35 176.40 3gin n GLY 487 N 3.61 2.18 3.15 -3.19 0.00 0.16 -4.73 105.19 106.37 3gin n GLY 487 Ca 0.13 -2.04 -0.28 0.00 0.00 0.00 0.00 46.02 43.84 3gin n GLY 487 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gin s SER 488 N -0.91 2.41 0.25 1.61 0.15 -1.26 -3.20 113.70 112.76 3gin s SER 488 Ca 0.00 -0.41 -0.26 0.00 0.70 0.00 0.00 55.95 55.98 3gin s SER 488 Cb 0.00 -0.87 -0.09 0.00 -1.71 0.00 0.00 66.02 63.35 3gin s SER 488 CO 0.00 0.14 0.87 -2.16 1.20 0.00 0.00 173.24 173.30 3gin s PRO 489 N 0.22 4.61 0.00 5.44 0.04 -1.26 -4.83 135.00 139.21 3gin s PRO 489 Ca -0.10 1.27 0.18 0.00 0.04 0.00 0.00 61.00 62.39 3gin s PRO 489 Cb -0.14 -3.04 0.10 0.00 0.04 0.00 0.00 34.50 31.45 3gin s PRO 489 CO 0.04 0.42 1.02 -1.13 0.04 0.00 0.00 177.00 177.40 3gin n SER 490 N 1.06 2.26 -4.37 6.66 3.41 -1.19 -1.07 113.62 120.38 3gin n SER 490 Ca -0.01 -1.63 -0.32 0.00 -0.26 0.00 0.00 58.87 56.65 3gin n SER 490 Cb 0.49 0.15 -0.15 0.00 -0.26 0.00 0.00 64.21 64.44 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 -1.68 2.47 -0.04 6.66 2.01 -1.26 -0.70 115.64 123.09 3gin s THR 491 Ca 0.19 -0.94 0.05 0.00 0.31 0.00 0.00 61.69 61.30 3gin s THR 491 Cb 0.15 -1.92 -0.02 0.00 0.01 0.00 0.00 72.50 70.72 3gin s THR 491 CO 0.30 0.58 -0.17 0.00 -0.69 0.00 0.00 174.62 174.64 3gin s ALA 492 N -0.53 2.56 -0.14 7.40 0.00 0.51 -4.85 121.76 126.71 3gin s ALA 492 Ca 0.07 -1.02 -0.05 0.00 0.00 0.00 0.00 51.96 50.97 3gin s ALA 492 Cb -0.11 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.10 3gin s ALA 492 CO 0.01 0.55 0.03 -0.08 0.00 0.00 0.00 175.76 176.26 3gin s THR 493 N -0.72 4.48 -0.19 0.00 -1.32 -0.13 -0.72 115.64 117.05 3gin s THR 493 Ca 0.11 -0.16 -0.01 0.00 -1.21 0.00 0.00 61.69 60.42 3gin s THR 493 Cb -0.10 -2.96 0.00 0.00 -1.51 0.00 0.00 72.50 67.92 3gin s THR 493 CO 0.00 0.52 -0.12 -0.69 -2.21 0.00 0.00 174.62 172.13 3gin s VAL 494 N -0.12 2.82 -0.27 5.08 1.01 0.22 -0.77 120.40 128.38 3gin s VAL 494 Ca 0.05 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.19 3gin s VAL 494 Cb -0.12 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 3gin s VAL 494 CO 0.02 0.48 0.38 -0.89 0.00 0.00 0.00 175.10 175.09 3gin s THR 495 N 1.21 5.17 -0.32 3.92 2.01 0.01 -1.39 115.64 126.25 3gin s THR 495 Ca 0.02 0.58 -0.19 0.00 0.31 0.00 0.00 61.69 62.42 3gin s THR 495 Cb -0.14 -3.70 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 3gin s THR 495 CO -0.05 0.15 0.54 -0.63 -0.69 0.00 0.00 174.62 173.95 3gin s ILE 496 N 2.08 5.00 -0.12 1.82 1.01 0.17 -1.50 121.20 129.66 3gin s ILE 496 Ca 0.15 0.56 -0.23 0.00 0.00 0.00 0.00 60.65 61.13 3gin s ILE 496 Cb -0.16 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 3gin s ILE 496 CO 0.10 -0.15 0.72 -0.36 0.00 0.00 0.00 174.94 175.25 3gin s PHE 497 N 2.44 3.50 0.31 3.97 0.40 0.13 -1.83 117.98 126.90 3gin s PHE 497 Ca 0.21 1.18 -0.29 0.00 -0.60 0.00 0.00 56.93 57.42 3gin s PHE 497 Cb -0.15 -2.85 -0.11 0.00 0.51 0.00 0.00 43.02 40.41 3gin s PHE 497 CO 0.12 -0.04 1.55 0.34 0.70 0.00 0.00 175.22 177.89 3gin s ASP 498 N 0.97 6.39 -0.08 1.36 2.15 -1.26 -0.94 116.67 125.26 3gin s ASP 498 Ca 0.36 2.95 0.17 0.00 0.43 0.00 0.00 52.55 56.45 3gin s ASP 498 Cb -0.17 -2.64 0.57 0.00 -0.30 0.00 0.00 42.92 40.38 3gin s ASP 498 CO 0.15 -0.88 1.49 -0.90 -0.17 0.00 0.00 175.17 174.86 3gin n ASP 499 N 1.75 4.04 -1.54 -0.34 5.75 -1.26 -4.86 116.55 120.08 3gin n ASP 499 Ca 0.06 -2.34 0.00 0.00 -0.01 0.00 0.00 54.79 52.50 3gin n ASP 499 Cb 0.38 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 3gin n ASP 499 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3gin n ASP 500 N 0.81 0.30 0.00 -1.12 8.00 -1.26 -5.11 116.55 118.16 3gin n ASP 500 Ca 0.21 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.94 3gin n ASP 500 Cb 0.73 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.83 3gin n ASP 500 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38