#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ibc n TYR 358 N 0.00 0.27 -4.39 4.78 4.01 -1.26 -4.96 117.16 115.61 3ibc n TYR 358 Ca 0.00 -0.20 -0.24 0.00 -0.16 0.00 0.00 57.90 57.30 3ibc n TYR 358 Cb 0.00 -0.01 -0.13 0.00 -0.31 0.00 0.00 39.34 38.89 3ibc n TYR 358 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3ibc s GLN 359 N -1.24 1.18 0.23 -0.72 -0.21 -1.26 -5.11 119.66 112.53 3ibc s GLN 359 Ca 0.26 -1.06 -0.30 0.00 0.02 0.00 0.00 55.36 54.27 3ibc s GLN 359 Cb 0.16 -1.38 -0.09 0.00 1.00 0.00 0.00 33.01 32.70 3ibc s GLN 359 CO 0.22 0.33 1.37 0.71 -2.12 0.00 0.00 175.29 175.80 3ibc s TYR 360 N -1.04 3.14 -0.04 0.91 2.02 -1.26 -4.92 117.35 116.16 3ibc s TYR 360 Ca 0.06 1.13 -0.30 0.00 -0.37 0.00 0.00 57.07 57.60 3ibc s TYR 360 Cb -0.10 -3.71 -0.06 0.00 -0.40 0.00 0.00 41.96 37.70 3ibc s TYR 360 CO 0.03 -2.25 1.72 1.21 -1.57 0.00 0.00 175.55 174.69 3ibc s ASN 361 N 0.32 6.61 0.00 2.29 2.47 -1.26 -4.89 114.94 120.48 3ibc s ASN 361 Ca 0.58 2.31 0.21 0.00 0.42 0.00 0.00 52.86 56.38 3ibc s ASN 361 Cb -0.39 -2.53 0.31 0.00 -1.45 0.00 0.00 41.25 37.18 3ibc s ASN 361 CO 0.41 -0.97 1.28 0.23 -3.72 0.00 0.00 177.10 174.33 3ibc n MET 362 N 7.24 2.22 -2.67 0.43 2.81 -1.26 -4.83 117.12 121.06 3ibc n MET 362 Ca 0.18 -2.03 -0.42 0.00 -1.81 0.00 0.00 57.70 53.61 3ibc n MET 362 Cb 0.42 -1.44 -0.02 0.00 -0.71 0.00 0.00 33.22 31.48 3ibc n MET 362 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3ibc s ASN 363 N -1.52 6.71 0.05 7.83 2.47 -1.26 -4.90 114.94 124.31 3ibc s ASN 363 Ca 0.31 -2.07 -0.00 0.00 0.42 0.00 0.00 52.86 51.52 3ibc s ASN 363 Cb 0.20 -2.53 -0.03 0.00 -1.45 0.00 0.00 41.25 37.43 3ibc s ASN 363 CO 0.28 -1.23 -0.04 -0.36 -3.72 0.00 0.00 177.10 172.03 3ibc s PHE 364 N 3.97 0.49 0.19 0.43 0.40 -1.26 -5.03 117.98 117.18 3ibc s PHE 364 Ca 0.46 -0.86 -0.15 0.00 -0.60 0.00 0.00 56.93 55.78 3ibc s PHE 364 Cb 0.00 -0.34 0.18 0.00 0.51 0.00 0.00 43.02 43.37 3ibc s PHE 364 CO -0.03 -0.28 1.63 1.49 0.70 0.00 0.00 175.22 178.74 3ibc h GLU 365 N 3.66 -0.02 -4.89 0.44 4.81 -1.87 -3.43 114.58 113.28 3ibc h GLU 365 Ca -0.34 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.60 3ibc h GLU 365 Cb 1.17 0.01 -0.16 0.00 0.63 0.00 0.00 28.75 30.39 3ibc h GLU 365 CO 0.57 -0.02 -0.72 -1.59 -0.73 0.00 0.00 179.01 176.52 3ibc s LYS 366 N -6.21 0.88 0.05 1.92 -2.85 -0.62 -5.06 119.74 107.86 3ibc s LYS 366 Ca -0.14 -1.25 -0.21 0.00 -1.00 0.00 0.00 55.97 53.37 3ibc s LYS 366 Cb 0.17 -0.46 -0.13 0.00 -2.06 0.00 0.00 37.83 35.36 3ibc s LYS 366 CO 0.72 0.05 1.46 1.25 0.10 0.00 0.00 175.35 178.93 3ibc h LEU 367 N 3.27 0.28 0.00 2.77 5.85 -1.83 -0.86 115.31 124.79 3ibc h LEU 367 Ca -0.37 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.01 3ibc h LEU 367 Cb 1.18 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.14 3ibc h LEU 367 CO 0.58 0.56 0.00 0.61 -0.34 0.00 0.00 178.44 179.85 3ibc n GLY 368 N -0.19 0.52 3.80 3.75 0.00 -1.26 -1.03 105.19 110.79 3ibc n GLY 368 Ca -0.05 -1.83 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 3ibc n GLY 368 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ibc s LYS 369 N -1.53 4.33 -0.34 1.61 2.47 -1.26 0.28 119.74 125.30 3ibc s LYS 369 Ca 0.00 0.93 0.00 0.00 -1.56 0.00 0.00 55.97 55.35 3ibc s LYS 369 Cb 0.00 -3.02 0.11 0.00 -1.46 0.00 0.00 37.83 33.46 3ibc s LYS 369 CO 0.00 0.47 0.12 0.00 0.16 0.00 0.00 175.35 176.10 3ibc s ILE 371 N 1.26 5.03 -0.20 0.00 1.01 -0.26 -1.76 121.20 126.28 3ibc s ILE 371 Ca 0.12 1.28 -0.00 0.00 0.00 0.00 0.00 60.65 62.04 3ibc s ILE 371 Cb -0.19 -3.98 0.02 0.00 0.01 0.00 0.00 42.46 38.32 3ibc s ILE 371 CO -0.18 0.16 -0.14 -0.63 0.00 0.00 0.00 174.94 174.15 3ibc s ILE 372 N 1.51 2.44 -0.38 2.92 1.01 -0.45 0.81 121.20 129.04 3ibc s ILE 372 Ca 0.32 -0.91 -0.12 0.00 0.00 0.00 0.00 60.65 59.94 3ibc s ILE 372 Cb -0.16 -2.10 0.03 0.00 0.01 0.00 0.00 42.46 40.23 3ibc s ILE 372 CO 0.13 0.44 0.23 -0.63 0.00 0.00 0.00 174.94 175.10 3ibc s ILE 373 N 1.32 4.75 -0.69 2.92 1.01 -0.45 -0.20 121.20 129.86 3ibc s ILE 373 Ca 0.04 -0.82 -0.11 0.00 0.00 0.00 0.00 60.65 59.76 3ibc s ILE 373 Cb -0.14 -3.65 0.18 0.00 0.01 0.00 0.00 42.46 38.85 3ibc s ILE 373 CO -0.09 -0.26 0.59 0.21 0.00 0.00 0.00 174.94 175.38 3ibc s ASN 374 N 1.58 6.14 -0.42 3.58 2.47 0.12 -1.51 114.94 126.90 3ibc s ASN 374 Ca 0.03 -2.52 -0.19 0.00 0.42 0.00 0.00 52.86 50.60 3ibc s ASN 374 Cb -0.19 -2.09 0.02 0.00 -1.45 0.00 0.00 41.25 37.54 3ibc s ASN 374 CO 0.08 -0.57 0.56 0.20 -3.72 0.00 0.00 177.10 173.64 3ibc s ASN 375 N 2.01 6.28 -0.12 -4.21 0.01 -0.34 -1.52 114.94 117.05 3ibc s ASN 375 Ca 0.14 -0.40 0.02 0.00 -0.71 0.00 0.00 52.86 51.92 3ibc s ASN 375 Cb -0.17 -2.28 -0.09 0.00 0.41 0.00 0.00 41.25 39.12 3ibc s ASN 375 CO -0.05 -0.67 -0.09 1.17 -1.51 0.00 0.00 177.10 175.96 3ibc n LYS 376 N 5.97 0.64 -4.45 -0.60 4.81 -1.26 -4.48 118.16 118.79 3ibc n LYS 376 Ca -0.04 0.06 -0.34 0.00 -0.87 0.00 0.00 58.31 57.12 3ibc n LYS 376 Cb 0.48 -1.25 -0.11 0.00 0.02 0.00 0.00 35.03 34.18 3ibc n LYS 376 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 3ibc s ASN 377 N -5.03 4.97 0.28 3.14 0.01 -1.26 -1.27 114.94 115.78 3ibc s ASN 377 Ca -0.15 0.04 0.03 0.00 -0.71 0.00 0.00 52.86 52.07 3ibc s ASN 377 Cb 0.04 -1.44 -0.06 0.00 0.41 0.00 0.00 41.25 40.20 3ibc s ASN 377 CO 0.30 0.33 0.04 -0.36 -1.51 0.00 0.00 177.10 175.90 3ibc s PHE 378 N -0.60 1.75 0.22 2.20 0.40 -1.26 -4.50 117.98 116.20 3ibc s PHE 378 Ca 0.09 -0.98 -0.30 0.00 -0.60 0.00 0.00 56.93 55.15 3ibc s PHE 378 Cb -0.12 -1.08 -0.09 0.00 0.51 0.00 0.00 43.02 42.25 3ibc s PHE 378 CO 0.02 -0.06 0.94 -0.51 0.70 0.00 0.00 175.22 176.31 3ibc s ASP 379 N -3.39 7.63 0.29 1.36 1.01 -0.94 -4.93 116.67 117.69 3ibc s ASP 379 Ca 0.34 1.93 0.03 0.00 0.71 0.00 0.00 52.55 55.57 3ibc s ASP 379 Cb 0.07 -2.61 0.68 0.00 1.01 0.00 0.00 42.92 42.07 3ibc s ASP 379 CO 0.13 0.13 1.75 0.50 0.21 0.00 0.00 175.17 177.89 3ibc h LYS 380 N 4.32 0.62 -0.01 8.23 3.64 -1.91 -0.33 116.57 131.13 3ibc h LYS 380 Ca -0.45 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 3ibc h LYS 380 Cb 1.20 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.88 3ibc h LYS 380 CO 0.68 0.41 0.22 -0.39 -2.27 0.00 0.00 179.45 178.11 3ibc h VAL 381 N 0.64 0.02 0.00 2.00 -1.51 -1.95 0.23 116.25 115.68 3ibc h VAL 381 Ca 0.54 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 66.01 3ibc h VAL 381 Cb 0.87 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 3ibc h VAL 381 CO -0.41 0.00 -0.25 0.71 -1.23 0.00 0.00 177.57 176.39 3ibc h THR 382 N 0.00 0.00 0.00 7.19 1.35 -1.37 -3.47 112.91 116.61 3ibc h THR 382 Ca 0.01 -0.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 3ibc h THR 382 Cb 0.45 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 3ibc h THR 382 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3ibc n GLY 383 N 1.14 0.76 3.87 5.82 0.00 0.82 -5.01 105.19 112.58 3ibc n GLY 383 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3ibc n GLY 383 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ibc s MET 384 N -0.13 3.86 0.34 1.61 -1.94 -1.26 -5.09 119.30 116.69 3ibc s MET 384 Ca 0.00 0.52 0.08 0.00 -1.71 0.00 0.00 55.69 54.58 3ibc s MET 384 Cb 0.00 -2.43 -0.03 0.00 2.01 0.00 0.00 34.83 34.38 3ibc s MET 384 CO 0.00 0.06 0.22 0.20 -0.01 0.00 0.00 175.02 175.49 3ibc s GLY 385 N -2.78 1.87 -0.06 -0.03 0.00 -1.26 -4.79 107.32 100.27 3ibc s GLY 385 Ca 0.52 -1.75 -0.35 0.00 0.00 0.00 0.00 44.72 43.14 3ibc s GLY 385 CO 0.25 -1.67 1.80 -0.62 0.00 0.00 0.00 173.10 172.86 3ibc n VAL 386 N -1.26 0.43 -2.71 1.40 0.31 -1.26 -4.82 118.33 110.43 3ibc n VAL 386 Ca -0.02 -0.08 -0.43 0.00 -0.01 0.00 0.00 64.34 63.80 3ibc n VAL 386 Cb 0.61 -1.71 -0.00 0.00 -0.91 0.00 0.00 33.84 31.82 3ibc n VAL 386 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3ibc s ARG 387 N 3.34 3.97 0.23 5.55 0.52 -0.40 -4.97 118.95 127.19 3ibc s ARG 387 Ca 0.91 -2.10 -0.30 0.00 -0.52 0.00 0.00 55.73 53.72 3ibc s ARG 387 Cb -0.74 -5.35 -0.09 0.00 0.52 0.00 0.00 34.95 29.28 3ibc s ARG 387 CO 0.51 -2.08 1.35 -0.80 0.02 0.00 0.00 175.30 174.30 3ibc s ASN 388 N 3.83 6.80 0.00 0.23 0.01 -1.26 -2.68 114.94 121.88 3ibc s ASN 388 Ca 0.49 2.51 0.00 0.00 -0.71 0.00 0.00 52.86 55.15 3ibc s ASN 388 Cb 0.01 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 39.05 3ibc s ASN 388 CO 0.03 -0.59 0.00 0.61 -1.51 0.00 0.00 177.10 175.65 3ibc n GLY 389 N 2.20 0.54 0.15 0.66 0.00 -1.26 -4.94 105.19 102.54 3ibc n GLY 389 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.10 3ibc n GLY 389 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ibc h THR 390 N 0.00 1.06 -0.57 2.61 1.03 -1.90 -2.94 112.91 112.19 3ibc h THR 390 Ca 0.00 -2.07 -0.09 0.00 -0.01 0.00 0.00 66.41 64.24 3ibc h THR 390 Cb 0.00 2.23 -0.02 0.00 -1.07 0.00 0.00 68.15 69.29 3ibc h THR 390 CO 0.00 0.52 0.01 0.44 -0.01 0.00 0.00 175.52 176.48 3ibc h ASP 391 N 0.00 0.96 0.03 0.00 3.32 -1.92 -0.27 116.42 118.54 3ibc h ASP 391 Ca -0.01 -0.26 0.03 0.00 0.02 0.00 0.00 57.03 56.82 3ibc h ASP 391 Cb 1.19 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.44 3ibc h ASP 391 CO 0.07 1.01 -0.29 0.50 -1.72 0.00 0.00 179.24 178.81 3ibc h LYS 392 N 0.91 -0.44 -0.18 3.56 1.63 -1.94 0.31 116.57 120.41 3ibc h LYS 392 Ca 0.17 0.03 0.03 0.00 -0.85 0.00 0.00 60.65 60.03 3ibc h LYS 392 Cb 0.52 0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.22 3ibc h LYS 392 CO 0.03 -0.29 -0.02 -0.44 -3.45 0.00 0.00 179.45 175.28 3ibc h ASP 393 N -0.46 -0.11 -0.62 4.20 3.32 -1.38 0.38 116.42 121.76 3ibc h ASP 393 Ca 0.05 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.20 3ibc h ASP 393 Cb 0.53 0.09 -0.05 0.00 0.22 0.00 0.00 39.33 40.11 3ibc h ASP 393 CO -0.22 -0.03 0.35 0.00 -1.72 0.00 0.00 179.24 177.61 3ibc h ALA 394 N 1.17 0.82 -0.57 3.45 0.00 -0.55 0.55 119.26 124.13 3ibc h ALA 394 Ca 0.09 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3ibc h ALA 394 Cb 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3ibc h ALA 394 CO -0.16 0.03 0.18 0.93 0.00 0.00 0.00 179.25 180.23 3ibc h GLU 395 N 0.66 0.88 0.45 0.00 5.08 0.02 -1.67 114.58 119.99 3ibc h GLU 395 Ca 0.27 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 3ibc h GLU 395 Cb 0.14 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3ibc h GLU 395 CO -0.16 0.79 -0.21 0.00 -1.00 0.00 0.00 179.01 178.42 3ibc h ALA 396 N 1.05 -0.60 -0.42 3.43 0.00 -0.13 -2.62 119.26 119.97 3ibc h ALA 396 Ca 0.18 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.00 3ibc h ALA 396 Cb 0.27 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.22 3ibc h ALA 396 CO -0.01 -0.72 -0.10 -0.07 0.00 0.00 0.00 179.25 178.35 3ibc h LEU 397 N -0.83 -0.37 0.31 0.00 3.38 0.11 -0.79 115.31 117.12 3ibc h LEU 397 Ca -0.06 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3ibc h LEU 397 Cb 0.56 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3ibc h LEU 397 CO 0.10 -0.13 -0.15 2.19 0.09 0.00 0.00 178.44 180.54 3ibc h PHE 398 N 0.01 -0.39 -0.70 1.13 -5.15 -1.34 0.26 116.94 110.76 3ibc h PHE 398 Ca 0.20 -0.01 0.12 0.00 -0.20 0.00 0.00 57.97 58.09 3ibc h PHE 398 Cb 0.31 0.13 -0.09 0.00 0.22 0.00 0.00 35.95 36.52 3ibc h PHE 398 CO -0.36 -0.17 0.27 0.87 -2.00 0.00 0.00 178.31 176.91 3ibc h LYS 399 N -0.52 0.42 0.47 6.09 1.57 -1.25 0.43 116.57 123.77 3ibc h LYS 399 Ca -0.04 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 3ibc h LYS 399 Cb 0.39 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3ibc h LYS 399 CO 0.07 0.27 -0.22 0.00 -0.57 0.00 0.00 179.45 179.00 3ibc h PHE 401 N -0.73 0.00 -0.77 0.00 -1.00 -0.14 -2.17 116.94 112.13 3ibc h PHE 401 Ca -0.06 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.66 3ibc h PHE 401 Cb 0.53 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.06 3ibc h PHE 401 CO -0.02 0.14 0.27 -0.09 -1.61 0.00 0.00 178.31 177.00 3ibc h ARG 402 N 0.00 1.18 -0.61 1.51 2.43 -0.77 -2.53 114.38 115.60 3ibc h ARG 402 Ca -0.00 -0.23 -0.04 0.00 -0.81 0.00 0.00 59.98 58.89 3ibc h ARG 402 Cb 0.43 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 3ibc h ARG 402 CO 0.02 0.98 0.20 0.77 -1.51 0.00 0.00 179.97 180.42 3ibc h SER 403 N 1.14 0.84 0.40 -3.80 0.02 -1.11 -1.66 113.55 109.38 3ibc h SER 403 Ca 0.25 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 3ibc h SER 403 Cb 0.27 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 3ibc h SER 403 CO -0.01 0.78 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.37 3ibc h LEU 404 N 0.88 0.00 0.00 5.07 3.38 -1.33 -3.45 115.31 119.86 3ibc h LEU 404 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3ibc h LEU 404 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3ibc h LEU 404 CO -0.01 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.15 3ibc n GLY 405 N -0.65 1.22 3.84 0.83 0.00 -0.62 -5.03 105.19 104.78 3ibc n GLY 405 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 3ibc n GLY 405 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ibc s PHE 406 N -2.00 3.41 -0.69 1.61 0.08 -1.01 -4.19 117.98 115.19 3ibc s PHE 406 Ca 0.00 1.40 -0.12 0.00 0.12 0.00 0.00 56.93 58.33 3ibc s PHE 406 Cb 0.00 -2.81 0.18 0.00 -0.57 0.00 0.00 43.02 39.82 3ibc s PHE 406 CO 0.00 -0.71 0.60 -0.51 -0.10 0.00 0.00 175.22 174.50 3ibc s ASP 407 N -3.55 6.28 0.00 1.36 1.01 0.14 -4.58 116.67 117.34 3ibc s ASP 407 Ca 0.58 -2.40 -0.19 0.00 0.71 0.00 0.00 52.55 51.25 3ibc s ASP 407 Cb -0.12 -2.13 -0.06 0.00 1.01 0.00 0.00 42.92 41.62 3ibc s ASP 407 CO 0.44 -0.63 0.54 0.54 0.21 0.00 0.00 175.17 176.27 3ibc s VAL 408 N 0.63 4.92 -0.04 -1.27 0.11 -1.26 -1.56 120.40 121.92 3ibc s VAL 408 Ca 0.13 1.13 0.05 0.00 -2.93 0.00 0.00 61.98 60.36 3ibc s VAL 408 Cb -0.18 -3.87 -0.01 0.00 -1.53 0.00 0.00 36.38 30.79 3ibc s VAL 408 CO -0.04 0.47 -0.21 -0.63 -3.33 0.00 0.00 175.10 171.37 3ibc s ILE 409 N -0.51 1.69 -0.18 7.04 1.01 -0.73 -4.94 121.20 124.59 3ibc s ILE 409 Ca 0.28 -0.87 -0.00 0.00 0.00 0.00 0.00 60.65 60.06 3ibc s ILE 409 Cb -0.18 -1.44 0.00 0.00 0.01 0.00 0.00 42.46 40.86 3ibc s ILE 409 CO 0.16 0.48 -0.15 -0.69 0.00 0.00 0.00 174.94 174.74 3ibc s VAL 410 N -0.12 2.62 0.04 2.92 1.01 -1.26 -1.35 120.40 124.26 3ibc s VAL 410 Ca -0.02 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.22 3ibc s VAL 410 Cb -0.12 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3ibc s VAL 410 CO 0.02 0.50 0.02 -0.31 0.00 0.00 0.00 175.10 175.34 3ibc s TYR 411 N 1.09 3.10 0.05 5.22 1.51 0.72 -4.99 117.35 124.05 3ibc s TYR 411 Ca 0.00 0.06 0.07 0.00 -1.01 0.00 0.00 57.07 56.19 3ibc s TYR 411 Cb -0.14 -1.63 -0.03 0.00 -0.11 0.00 0.00 41.96 40.05 3ibc s TYR 411 CO -0.05 0.49 -0.19 -0.80 -1.11 0.00 0.00 175.55 173.89 3ibc s ASN 412 N -1.93 2.31 -0.63 2.29 0.01 -1.26 0.12 114.94 115.84 3ibc s ASN 412 Ca 0.23 -0.54 -0.01 0.00 -0.71 0.00 0.00 52.86 51.83 3ibc s ASN 412 Cb -0.12 -0.17 0.00 0.00 0.41 0.00 0.00 41.25 41.37 3ibc s ASN 412 CO 0.15 0.12 0.45 0.47 -1.51 0.00 0.00 177.10 176.77 3ibc n ASP 413 N 1.73 -3.53 -4.89 -1.22 8.00 -0.58 -4.91 116.55 111.16 3ibc n ASP 413 Ca -0.18 -0.75 -0.31 0.00 0.71 0.00 0.00 54.79 54.27 3ibc n ASP 413 Cb 0.54 -1.18 -0.04 0.00 -0.02 0.00 0.00 41.12 40.41 3ibc n ASP 413 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ibc s SER 415 N -2.69 4.59 0.13 0.00 1.04 -1.26 -1.15 113.70 114.37 3ibc s SER 415 Ca 0.46 0.44 -0.14 0.00 0.48 0.00 0.00 55.95 57.19 3ibc s SER 415 Cb -0.11 -1.00 -0.01 0.00 0.10 0.00 0.00 66.02 65.00 3ibc s SER 415 CO 0.25 -1.76 1.57 0.00 0.98 0.00 0.00 173.24 174.29 3ibc h ALA 417 N 0.89 0.69 0.35 0.00 0.00 -1.99 -1.84 119.26 117.36 3ibc h ALA 417 Ca 0.12 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ibc h ALA 417 Cb 0.51 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3ibc h ALA 417 CO 0.02 -0.08 -0.24 -0.22 0.00 0.00 0.00 179.25 178.73 3ibc h LYS 418 N 0.51 -0.56 -0.51 0.00 1.63 -1.88 -0.49 116.57 115.28 3ibc h LYS 418 Ca 0.24 0.04 0.09 0.00 -0.85 0.00 0.00 60.65 60.17 3ibc h LYS 418 Cb 0.16 0.13 -0.08 0.00 -0.60 0.00 0.00 32.23 31.84 3ibc h LYS 418 CO -0.17 -0.38 0.06 0.52 -3.45 0.00 0.00 179.45 176.03 3ibc h MET 419 N -0.59 0.18 0.16 1.90 2.86 -0.94 0.37 114.93 118.88 3ibc h MET 419 Ca -0.03 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3ibc h MET 419 Cb 0.50 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 3ibc h MET 419 CO 0.01 0.12 -0.16 1.96 1.06 0.00 0.00 176.91 179.90 3ibc h GLN 420 N 0.18 -0.34 -0.11 1.72 1.08 -1.14 -1.52 115.11 114.98 3ibc h GLN 420 Ca 0.26 0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.48 3ibc h GLN 420 Cb 0.37 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 3ibc h GLN 420 CO -0.38 -0.23 0.06 0.22 -0.95 0.00 0.00 178.83 177.56 3ibc h ASP 421 N -0.35 0.14 -0.29 1.46 3.58 -0.59 -0.12 116.42 120.25 3ibc h ASP 421 Ca 0.00 -0.08 0.07 0.00 0.42 0.00 0.00 57.03 57.44 3ibc h ASP 421 Cb 0.34 -0.04 -0.07 0.00 1.72 0.00 0.00 39.33 41.28 3ibc h ASP 421 CO -0.04 0.18 -0.16 0.25 -2.88 0.00 0.00 179.24 176.58 3ibc h LEU 422 N 0.09 -0.53 -0.51 2.28 6.46 -0.19 0.18 115.31 123.09 3ibc h LEU 422 Ca 0.04 0.12 -0.14 0.00 -0.12 0.00 0.00 57.88 57.78 3ibc h LEU 422 Cb 0.07 0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 3ibc h LEU 422 CO -0.01 -0.20 -0.27 -0.07 -0.62 0.00 0.00 178.44 177.28 3ibc h LEU 423 N -0.13 0.97 0.15 2.25 3.38 -1.14 -2.55 115.31 118.24 3ibc h LEU 423 Ca 0.15 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 3ibc h LEU 423 Cb 0.36 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3ibc h LEU 423 CO -0.37 1.17 -0.07 0.50 0.09 0.00 0.00 178.44 179.76 3ibc h LYS 424 N 0.79 -0.19 -0.80 1.13 3.64 -0.51 -1.47 116.57 119.17 3ibc h LYS 424 Ca 0.09 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.63 3ibc h LYS 424 Cb 0.84 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.61 3ibc h LYS 424 CO 0.07 -0.11 0.37 0.87 -2.27 0.00 0.00 179.45 178.39 3ibc h LYS 425 N -0.22 0.53 -0.94 1.90 1.57 -0.96 0.27 116.57 118.71 3ibc h LYS 425 Ca -0.02 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3ibc h LYS 425 Cb 0.17 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 3ibc h LYS 425 CO 0.03 0.35 0.62 0.00 -0.57 0.00 0.00 179.45 179.88 3ibc h ALA 426 N 1.55 1.20 0.00 3.86 0.00 -1.00 -0.82 119.26 124.05 3ibc h ALA 426 Ca 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.29 3ibc h ALA 426 Cb 0.63 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3ibc h ALA 426 CO -0.38 0.56 0.00 0.66 0.00 0.00 0.00 179.25 180.09 3ibc h SER 427 N 1.25 0.00 0.21 0.00 4.64 0.07 -2.51 113.55 117.20 3ibc h SER 427 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3ibc h SER 427 Cb -0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 3ibc h SER 427 CO -0.09 0.00 -0.36 -0.62 -0.87 0.00 0.00 176.83 174.90 3ibc n GLU 428 N -2.79 0.78 -1.57 4.77 1.02 -0.35 -4.74 120.64 117.76 3ibc n GLU 428 Ca 0.01 -0.52 -0.30 0.00 -0.02 0.00 0.00 57.16 56.34 3ibc n GLU 428 Cb 0.29 -1.49 0.19 0.00 -0.02 0.00 0.00 31.44 30.41 3ibc n GLU 428 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3ibc s GLU 429 N -2.57 0.10 -0.48 3.49 2.02 -0.95 -5.00 118.70 115.30 3ibc s GLU 429 Ca 0.21 -0.16 -0.16 0.00 0.02 0.00 0.00 54.97 54.88 3ibc s GLU 429 Cb 0.19 -1.76 0.08 0.00 0.10 0.00 0.00 34.13 32.74 3ibc s GLU 429 CO 0.57 -2.82 0.41 0.34 0.02 0.00 0.00 175.26 173.78 3ibc s ASP 430 N -4.40 6.15 -0.09 -0.19 2.15 -1.26 -4.89 116.67 114.14 3ibc s ASP 430 Ca 0.71 -1.41 0.14 0.00 0.43 0.00 0.00 52.55 52.42 3ibc s ASP 430 Cb -0.08 -2.19 0.55 0.00 -0.30 0.00 0.00 42.92 40.91 3ibc s ASP 430 CO 0.54 -0.68 1.42 1.41 -0.17 0.00 0.00 175.17 177.69 3ibc n HIS 431 N 5.21 1.14 -0.25 -5.34 8.25 -1.26 -4.56 115.22 118.40 3ibc n HIS 431 Ca -0.13 -0.45 0.06 0.00 -0.26 0.00 0.00 57.72 56.94 3ibc n HIS 431 Cb 0.43 -0.20 0.18 0.00 1.12 0.00 0.00 29.99 31.52 3ibc n HIS 431 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3ibc h THR 432 N 3.13 0.44 -0.50 1.59 2.02 -1.91 -1.42 112.91 116.25 3ibc h THR 432 Ca 0.00 -0.07 -0.08 0.00 0.77 0.00 0.00 66.41 67.03 3ibc h THR 432 Cb 1.16 0.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.75 3ibc h THR 432 CO 0.18 0.04 0.11 0.59 0.37 0.00 0.00 175.52 176.80 3ibc n ASN 433 N -5.23 4.39 -4.46 4.18 3.02 -1.26 -4.90 115.26 111.00 3ibc n ASN 433 Ca 0.14 -2.82 -0.33 0.00 -0.03 0.00 0.00 54.58 51.55 3ibc n ASN 433 Cb 0.48 -0.67 -0.13 0.00 -0.61 0.00 0.00 39.78 38.85 3ibc n ASN 433 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ibc s ALA 434 N -2.37 2.67 0.36 5.41 0.00 -0.54 -1.58 121.76 125.71 3ibc s ALA 434 Ca 0.42 -0.96 0.12 0.00 0.00 0.00 0.00 51.96 51.54 3ibc s ALA 434 Cb 0.33 -1.03 0.67 0.00 0.00 0.00 0.00 23.12 23.09 3ibc s ALA 434 CO 0.11 0.50 1.80 0.00 0.00 0.00 0.00 175.76 178.17 3ibc h ALA 435 N 5.58 1.33 -1.74 0.00 0.00 -0.39 -3.48 119.26 120.56 3ibc h ALA 435 Ca -0.43 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.20 3ibc h ALA 435 Cb 1.16 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3ibc h ALA 435 CO 0.51 0.50 0.26 0.00 0.00 0.00 0.00 179.25 180.52 3ibc s PHE 437 N -3.78 0.74 -0.01 0.00 5.36 -0.80 -4.04 117.98 115.45 3ibc s PHE 437 Ca 0.09 -0.28 0.00 0.00 -0.96 0.00 0.00 56.93 55.78 3ibc s PHE 437 Cb -0.01 -0.45 0.01 0.00 -0.34 0.00 0.00 43.02 42.24 3ibc s PHE 437 CO 0.01 -0.02 0.01 0.00 -1.46 0.00 0.00 175.22 173.75 3ibc s ALA 438 N -0.68 0.09 -0.03 11.12 0.00 -0.78 -0.34 121.76 131.14 3ibc s ALA 438 Ca -0.02 0.13 0.03 0.00 0.00 0.00 0.00 51.96 52.10 3ibc s ALA 438 Cb -0.06 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.92 3ibc s ALA 438 CO 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 175.76 175.60 3ibc s ILE 440 N 0.12 1.93 -0.15 0.00 1.01 0.24 -0.82 121.20 123.53 3ibc s ILE 440 Ca -0.03 -1.02 0.01 0.00 0.00 0.00 0.00 60.65 59.62 3ibc s ILE 440 Cb -0.09 -1.63 0.02 0.00 0.01 0.00 0.00 42.46 40.77 3ibc s ILE 440 CO 0.01 0.54 -0.18 -0.76 0.00 0.00 0.00 174.94 174.55 3ibc s LEU 441 N -0.29 1.94 -0.32 2.97 1.43 0.68 -1.33 118.68 123.76 3ibc s LEU 441 Ca 0.01 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 3ibc s LEU 441 Cb -0.12 -1.33 0.09 0.00 0.03 0.00 0.00 46.19 44.86 3ibc s LEU 441 CO 0.02 0.00 0.03 -0.76 0.23 0.00 0.00 176.35 175.88 3ibc s LEU 442 N 1.21 4.04 0.00 1.79 1.43 -0.57 0.23 118.68 126.80 3ibc s LEU 442 Ca 0.01 -1.92 0.00 0.00 -1.03 0.00 0.00 54.13 51.19 3ibc s LEU 442 Cb -0.14 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.63 3ibc s LEU 442 CO -0.08 -0.36 0.00 -0.24 0.23 0.00 0.00 176.35 175.90 3ibc n SER 443 N 4.40 0.00 -4.86 2.29 2.88 -0.75 -1.20 113.62 116.38 3ibc n SER 443 Ca 0.00 -0.74 -0.31 0.00 -1.33 0.00 0.00 58.87 56.49 3ibc n SER 443 Cb 0.42 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.84 3ibc n SER 443 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3ibc s HIS 444 N -5.27 3.45 0.29 0.66 3.76 -1.26 -4.08 115.29 112.84 3ibc s HIS 444 Ca 0.00 1.19 -0.13 0.00 -0.15 0.00 0.00 55.06 55.97 3ibc s HIS 444 Cb 0.00 -2.56 0.01 0.00 1.11 0.00 0.00 32.58 31.14 3ibc s HIS 444 CO 0.00 -0.15 0.58 0.20 -0.85 0.00 0.00 174.74 174.52 3ibc s GLY 445 N -3.00 0.55 0.15 -2.22 0.00 -1.26 -0.69 107.32 100.85 3ibc s GLY 445 Ca 0.54 -0.85 -0.14 0.00 0.00 0.00 0.00 44.72 44.26 3ibc s GLY 445 CO 0.29 -0.53 0.39 -0.54 0.00 0.00 0.00 173.10 172.71 3ibc s GLU 446 N -3.53 1.14 -0.36 2.90 2.02 -0.62 -4.10 118.70 116.15 3ibc s GLU 446 Ca 0.20 -0.87 -0.41 0.00 0.02 0.00 0.00 54.97 53.91 3ibc s GLU 446 Cb -0.02 0.45 -0.16 0.00 0.10 0.00 0.00 34.13 34.49 3ibc s GLU 446 CO 0.11 -0.45 1.82 -1.91 0.02 0.00 0.00 175.26 174.85 3ibc n GLU 447 N -0.24 0.78 -0.54 1.61 2.13 -1.10 -0.32 120.64 122.96 3ibc n GLU 447 Ca -0.13 0.27 0.00 0.00 0.66 0.00 0.00 57.16 57.96 3ibc n GLU 447 Cb 0.63 -1.96 0.00 0.00 0.27 0.00 0.00 31.44 30.38 3ibc n GLU 447 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3ibc n ASN 448 N 5.93 0.00 -4.40 4.31 5.03 -1.26 -4.98 115.26 119.90 3ibc n ASN 448 Ca 0.33 0.00 -0.26 0.00 0.87 0.00 0.00 54.58 55.52 3ibc n ASN 448 Cb 0.08 -0.58 -0.12 0.00 -1.02 0.00 0.00 39.78 38.15 3ibc n ASN 448 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3ibc s VAL 449 N -2.91 2.20 -0.02 2.41 1.01 0.57 -1.25 120.40 122.41 3ibc s VAL 449 Ca 0.00 -1.97 0.01 0.00 0.00 0.00 0.00 61.98 60.02 3ibc s VAL 449 Cb 0.00 -2.03 0.01 0.00 0.00 0.00 0.00 36.38 34.36 3ibc s VAL 449 CO 0.00 -0.15 -0.04 -0.51 0.00 0.00 0.00 175.10 174.40 3ibc s ILE 450 N -1.71 0.39 0.49 2.22 1.10 0.16 -2.42 121.20 121.44 3ibc s ILE 450 Ca 0.19 -0.13 -0.18 0.00 -0.51 0.00 0.00 60.65 60.02 3ibc s ILE 450 Cb -0.08 -0.39 -0.09 0.00 0.15 0.00 0.00 42.46 42.06 3ibc s ILE 450 CO 0.09 0.15 0.99 -0.31 -2.11 0.00 0.00 174.94 173.75 3ibc s TYR 451 N 0.42 3.32 0.35 3.50 1.51 0.14 -1.57 117.35 125.02 3ibc s TYR 451 Ca -0.05 1.53 0.06 0.00 -1.01 0.00 0.00 57.07 57.60 3ibc s TYR 451 Cb -0.08 -2.86 -0.07 0.00 -0.11 0.00 0.00 41.96 38.84 3ibc s TYR 451 CO -0.00 -0.40 0.02 0.20 -1.11 0.00 0.00 175.55 174.25 3ibc s GLY 452 N -2.65 2.23 0.37 0.71 0.00 0.15 -4.67 107.32 103.46 3ibc s GLY 452 Ca 0.61 -2.14 0.09 0.00 0.00 0.00 0.00 44.72 43.28 3ibc s GLY 452 CO 0.25 -1.94 1.89 0.07 0.00 0.00 0.00 173.10 173.36 3ibc h LYS 453 N 1.99 0.26 0.47 2.90 2.10 -1.36 -2.85 116.57 120.07 3ibc h LYS 453 Ca -0.42 -0.06 -0.01 0.00 -2.00 0.00 0.00 60.65 58.15 3ibc h LYS 453 Cb 1.24 -0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 32.52 3ibc h LYS 453 CO 0.74 0.42 -0.47 0.22 -2.00 0.00 0.00 179.45 178.35 3ibc h ASP 454 N 0.24 -1.29 0.00 7.07 1.82 -1.90 -2.49 116.42 119.86 3ibc h ASP 454 Ca 0.05 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.79 3ibc h ASP 454 Cb 0.43 0.43 0.00 0.00 0.68 0.00 0.00 39.33 40.86 3ibc h ASP 454 CO 0.03 -0.63 0.00 0.61 -1.61 0.00 0.00 179.24 177.63 3ibc n GLY 455 N -1.55 -0.26 3.23 -0.78 0.00 -1.08 -4.86 105.19 99.89 3ibc n GLY 455 Ca -0.11 0.47 -0.26 0.00 0.00 0.00 0.00 46.02 46.11 3ibc n GLY 455 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ibc s VAL 456 N 0.00 1.62 -0.06 1.61 1.01 -1.26 0.34 120.40 123.66 3ibc s VAL 456 Ca 0.00 -0.98 -0.06 0.00 0.00 0.00 0.00 61.98 60.94 3ibc s VAL 456 Cb 0.00 -1.37 0.02 0.00 0.00 0.00 0.00 36.38 35.03 3ibc s VAL 456 CO 0.00 0.37 0.17 0.28 0.00 0.00 0.00 175.10 175.92 3ibc s THR 457 N -0.58 0.01 0.13 3.92 -1.32 -0.61 -4.97 115.64 112.21 3ibc s THR 457 Ca 0.08 -0.06 -0.31 0.00 -1.21 0.00 0.00 61.69 60.18 3ibc s THR 457 Cb -0.08 -0.26 -0.10 0.00 -1.51 0.00 0.00 72.50 70.55 3ibc s THR 457 CO 0.00 -0.03 1.64 -2.84 -2.21 0.00 0.00 174.62 171.18 3ibc s PRO 458 N -0.04 4.19 0.52 7.08 0.02 -1.26 -0.67 135.00 144.85 3ibc s PRO 458 Ca -0.01 2.40 0.19 0.00 0.02 0.00 0.00 61.00 63.59 3ibc s PRO 458 Cb -0.02 -3.36 1.32 0.00 0.02 0.00 0.00 34.50 32.46 3ibc s PRO 458 CO 0.00 -0.69 2.10 0.82 -0.33 0.00 0.00 177.00 178.91 3ibc h ILE 459 N 4.36 0.91 -0.15 2.83 2.04 -1.49 -1.37 117.51 124.65 3ibc h ILE 459 Ca -0.43 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.33 3ibc h ILE 459 Cb 1.20 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 3ibc h ILE 459 CO 0.93 0.00 -0.36 0.50 0.00 0.00 0.00 178.15 179.21 3ibc h LYS 460 N 0.00 0.31 -0.09 2.37 3.64 -1.90 -2.69 116.57 118.20 3ibc h LYS 460 Ca 0.08 -0.14 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 3ibc h LYS 460 Cb 0.31 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 3ibc h LYS 460 CO -0.00 0.64 -0.38 -0.44 -2.27 0.00 0.00 179.45 176.99 3ibc h ASP 461 N 0.26 0.20 -0.17 4.20 3.32 -1.63 -0.42 116.42 122.18 3ibc h ASP 461 Ca 0.03 -0.08 -0.11 0.00 0.02 0.00 0.00 57.03 56.90 3ibc h ASP 461 Cb 0.77 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.26 3ibc h ASP 461 CO 0.06 0.57 -0.30 -0.07 -1.72 0.00 0.00 179.24 177.78 3ibc h LEU 462 N 0.17 0.56 0.00 1.55 3.38 -1.46 -3.27 115.31 116.24 3ibc h LEU 462 Ca 0.02 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.45 3ibc h LEU 462 Cb 0.76 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3ibc h LEU 462 CO 0.06 1.00 -0.04 0.71 0.09 0.00 0.00 178.44 180.25 3ibc h THR 463 N 0.15 0.00 -0.08 0.22 1.35 -1.39 -3.28 112.91 109.88 3ibc h THR 463 Ca 0.01 -1.00 0.01 0.00 -0.55 0.00 0.00 66.41 64.89 3ibc h THR 463 Cb 0.89 1.98 -0.00 0.00 -1.73 0.00 0.00 68.15 69.29 3ibc h THR 463 CO 0.07 0.00 0.05 0.00 -0.25 0.00 0.00 175.52 175.39 3ibc h ALA 464 N 2.00 2.03 -0.10 6.62 0.00 -1.12 -1.65 119.26 127.05 3ibc h ALA 464 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3ibc h ALA 464 Cb 1.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 3ibc h ALA 464 CO 0.00 -0.04 0.29 0.45 0.00 0.00 0.00 179.25 179.94 3ibc h HIS 465 N 0.04 0.00 -0.63 0.00 3.86 -1.70 -1.10 115.15 115.61 3ibc h HIS 465 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 3ibc h HIS 465 Cb 0.09 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.56 3ibc h HIS 465 CO -0.00 0.00 0.00 1.19 0.86 0.00 0.00 177.93 179.98 3ibc n PHE 466 N -3.21 0.98 -1.44 2.45 3.01 -0.62 -4.28 117.46 114.35 3ibc n PHE 466 Ca 0.00 -0.53 -0.36 0.00 1.01 0.00 0.00 57.45 57.57 3ibc n PHE 466 Cb 0.37 -0.06 0.07 0.00 -0.01 0.00 0.00 39.48 39.85 3ibc n PHE 466 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3ibc n ARG 467 N 1.28 0.61 -0.28 -1.08 1.74 -0.42 -4.48 116.66 114.04 3ibc n ARG 467 Ca 0.22 0.26 0.04 0.00 -0.77 0.00 0.00 57.85 57.61 3ibc n ARG 467 Cb 0.65 -2.17 0.14 0.00 -1.02 0.00 0.00 32.46 30.05 3ibc n ARG 467 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3ibc h GLY 468 N -0.03 0.72 1.86 -0.13 0.00 -1.91 0.12 103.07 103.71 3ibc h GLY 468 Ca -0.48 0.20 -0.10 0.00 0.00 0.00 0.00 47.33 46.96 3ibc h GLY 468 CO 0.48 -0.32 -0.39 1.29 0.00 0.00 0.00 176.54 177.60 3ibc h ASP 469 N 0.03 0.17 -0.02 0.19 2.03 -1.97 -3.19 116.42 113.66 3ibc h ASP 469 Ca 0.41 -0.06 0.00 0.00 -0.73 0.00 0.00 57.03 56.65 3ibc h ASP 469 Cb 0.69 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.14 3ibc h ASP 469 CO -0.78 0.55 -0.00 0.54 -1.03 0.00 0.00 179.24 178.52 3ibc n ARG 470 N -4.05 2.01 -2.94 4.15 1.74 0.17 -4.51 116.66 113.23 3ibc n ARG 470 Ca -0.01 -1.47 -0.15 0.00 -0.77 0.00 0.00 57.85 55.45 3ibc n ARG 470 Cb 0.45 -1.47 0.01 0.00 -1.02 0.00 0.00 32.46 30.43 3ibc n ARG 470 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ibc h LYS 472 N 3.75 0.29 0.00 0.00 1.79 -1.79 -0.33 116.57 120.28 3ibc h LYS 472 Ca -0.04 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 3ibc h LYS 472 Cb 0.98 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 3ibc h LYS 472 CO 0.36 0.19 0.00 1.79 -1.08 0.00 0.00 179.45 180.72 3ibc h THR 473 N 0.30 0.00 -0.49 -0.16 1.35 -1.91 -1.45 112.91 110.55 3ibc h THR 473 Ca 0.51 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 66.20 3ibc h THR 473 Cb 0.95 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 3ibc h THR 473 CO -0.56 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 174.89 3ibc n LEU 474 N -2.49 4.05 -4.76 3.87 4.77 -0.14 -4.15 117.00 118.14 3ibc n LEU 474 Ca 0.00 -2.43 -0.38 0.00 -0.03 0.00 0.00 56.01 53.17 3ibc n LEU 474 Cb 0.16 -0.47 0.01 0.00 -2.33 0.00 0.00 43.42 40.79 3ibc n LEU 474 CO 0.18 0.77 0.92 -0.22 -1.33 0.00 0.00 177.39 177.71 3ibc s LEU 475 N -1.78 4.01 0.00 2.23 2.96 -0.55 -2.21 118.68 123.33 3ibc s LEU 475 Ca 0.42 2.56 0.00 0.00 -0.22 0.00 0.00 54.13 56.89 3ibc s LEU 475 Cb 0.27 -4.16 0.00 0.00 0.50 0.00 0.00 46.19 42.80 3ibc s LEU 475 CO 0.19 -1.13 0.00 -0.62 -1.32 0.00 0.00 176.35 173.48 3ibc n GLU 476 N -0.50 -1.93 -4.57 1.98 1.02 -1.26 -4.95 120.64 110.43 3ibc n GLU 476 Ca 0.07 0.48 -0.31 0.00 -0.02 0.00 0.00 57.16 57.39 3ibc n GLU 476 Cb 0.46 -4.98 -0.12 0.00 -0.02 0.00 0.00 31.44 26.77 3ibc n GLU 476 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3ibc s LYS 477 N -1.97 2.06 0.08 3.49 1.02 -0.94 -4.94 119.74 118.54 3ibc s LYS 477 Ca 0.00 -1.00 -0.31 0.00 0.02 0.00 0.00 55.97 54.69 3ibc s LYS 477 Cb 0.00 -2.20 -0.08 0.00 -0.52 0.00 0.00 37.83 35.02 3ibc s LYS 477 CO 0.00 0.53 1.62 -1.25 -0.92 0.00 0.00 175.35 175.33 3ibc s PRO 478 N -1.59 4.21 -0.38 -1.68 0.04 -1.26 -4.91 135.00 129.42 3ibc s PRO 478 Ca 0.16 2.31 -0.06 0.00 0.04 0.00 0.00 61.00 63.45 3ibc s PRO 478 Cb -0.11 -3.52 0.07 0.00 0.04 0.00 0.00 34.50 30.99 3ibc s PRO 478 CO 0.07 -0.70 0.18 0.15 0.04 0.00 0.00 177.00 176.73 3ibc s LYS 479 N 2.36 2.45 -0.15 4.56 1.02 -1.26 -1.90 119.74 126.82 3ibc s LYS 479 Ca 0.73 -1.45 -0.07 0.00 0.02 0.00 0.00 55.97 55.19 3ibc s LYS 479 Cb -0.40 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.29 3ibc s LYS 479 CO 0.32 -0.87 0.10 -0.51 -0.92 0.00 0.00 175.35 173.46 3ibc s LEU 480 N 1.33 4.10 -0.10 3.17 1.43 0.53 -5.01 118.68 124.13 3ibc s LEU 480 Ca 0.02 0.28 -0.01 0.00 -1.03 0.00 0.00 54.13 53.39 3ibc s LEU 480 Cb -0.22 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 44.01 3ibc s LEU 480 CO 0.00 0.30 -0.06 -0.36 0.23 0.00 0.00 176.35 176.46 3ibc s PHE 481 N -0.37 1.31 -0.12 0.29 0.40 -1.26 0.10 117.98 118.33 3ibc s PHE 481 Ca 0.10 -0.61 -0.02 0.00 -0.60 0.00 0.00 56.93 55.80 3ibc s PHE 481 Cb -0.12 -1.13 -0.03 0.00 0.51 0.00 0.00 43.02 42.25 3ibc s PHE 481 CO 0.01 -0.47 -0.03 -0.06 0.70 0.00 0.00 175.22 175.38 3ibc s PHE 482 N 1.72 3.05 -0.10 0.36 0.40 -0.00 -4.99 117.98 118.41 3ibc s PHE 482 Ca 0.04 -0.09 -0.01 0.00 -0.60 0.00 0.00 56.93 56.27 3ibc s PHE 482 Cb -0.13 -1.87 0.03 0.00 0.51 0.00 0.00 43.02 41.56 3ibc s PHE 482 CO -0.07 0.17 -0.06 0.42 0.70 0.00 0.00 175.22 176.39 3ibc s ILE 483 N -0.19 0.85 -0.63 0.64 1.01 -1.26 -0.23 121.20 121.39 3ibc s ILE 483 Ca 0.04 -0.18 -0.06 0.00 0.00 0.00 0.00 60.65 60.46 3ibc s ILE 483 Cb -0.13 -0.91 0.16 0.00 0.01 0.00 0.00 42.46 41.60 3ibc s ILE 483 CO 0.02 0.34 0.47 -1.58 0.00 0.00 0.00 174.94 174.20 3ibc s GLN 484 N 1.77 2.71 0.10 2.79 2.00 0.13 -4.98 119.66 124.19 3ibc s GLN 484 Ca 0.05 -2.39 -0.26 0.00 -2.00 0.00 0.00 55.36 50.76 3ibc s GLN 484 Cb -0.12 -3.87 0.08 0.00 0.80 0.00 0.00 33.01 29.89 3ibc s GLN 484 CO -0.07 -1.19 0.82 0.00 -0.50 0.00 0.00 175.29 174.35 3ibc s ALA 485 N 0.21 -1.66 0.58 1.58 0.00 -1.26 -1.81 121.76 119.40 3ibc s ALA 485 Ca 0.15 0.52 -0.14 0.00 0.00 0.00 0.00 51.96 52.50 3ibc s ALA 485 Cb -0.19 0.63 -0.05 0.00 0.00 0.00 0.00 23.12 23.51 3ibc s ALA 485 CO -0.04 -0.84 1.02 0.00 0.00 0.00 0.00 175.76 175.90 3ibc n ARG 487 N -2.25 0.90 -2.33 0.00 1.74 -1.26 -1.59 116.66 111.87 3ibc n ARG 487 Ca 0.07 -2.31 0.00 0.00 -0.77 0.00 0.00 57.85 54.84 3ibc n ARG 487 Cb 0.54 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.86 3ibc n ARG 487 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ibc n GLY 488 N -0.81 -0.05 0.07 -0.13 0.00 -1.26 -2.71 105.19 100.29 3ibc n GLY 488 Ca 0.12 -1.46 0.01 0.00 0.00 0.00 0.00 46.02 44.68 3ibc n GLY 488 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ibc n THR 489 N 9.00 0.00 -1.58 2.61 -2.24 -1.26 -4.93 114.28 115.88 3ibc n THR 489 Ca 0.00 -0.50 -0.34 0.00 -2.27 0.00 0.00 64.05 60.94 3ibc n THR 489 Cb 0.00 1.04 0.08 0.00 -2.10 0.00 0.00 70.33 69.34 3ibc n THR 489 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3ibc s GLU 490 N -0.27 2.38 -0.06 -0.78 2.02 -1.26 -5.04 118.70 115.69 3ibc s GLU 490 Ca 0.02 1.74 0.05 0.00 0.02 0.00 0.00 54.97 56.80 3ibc s GLU 490 Cb 0.02 -1.86 -0.00 0.00 0.10 0.00 0.00 34.13 32.38 3ibc s GLU 490 CO 0.03 -1.65 -0.20 -0.51 0.02 0.00 0.00 175.26 172.95 3ibc s LEU 491 N -4.90 1.97 -0.52 1.80 1.43 -1.26 -5.09 118.68 112.11 3ibc s LEU 491 Ca 0.74 -0.43 -0.21 0.00 -1.03 0.00 0.00 54.13 53.21 3ibc s LEU 491 Cb -0.29 -1.15 0.05 0.00 0.03 0.00 0.00 46.19 44.84 3ibc s LEU 491 CO 0.42 0.18 0.72 -0.62 0.23 0.00 0.00 176.35 177.28 3ibc s ASP 492 N 0.04 6.26 0.23 2.29 -1.08 -1.26 -4.90 116.67 118.25 3ibc s ASP 492 Ca -0.06 -0.71 -0.03 0.00 -0.52 0.00 0.00 52.55 51.22 3ibc s ASP 492 Cb -0.13 -2.33 0.23 0.00 -1.46 0.00 0.00 42.92 39.22 3ibc s ASP 492 CO 0.03 -0.98 1.66 0.44 0.52 0.00 0.00 175.17 176.84 3ibc h ASP 493 N 9.08 0.76 -3.50 -0.34 3.32 -2.06 -3.49 116.42 120.19 3ibc h ASP 493 Ca -0.27 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.53 3ibc h ASP 493 Cb 1.09 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.43 3ibc h ASP 493 CO 1.00 0.94 0.00 0.61 -1.72 0.00 0.00 179.24 180.06 3ibc n GLY 494 N -0.33 -1.57 3.58 2.75 0.00 -1.26 -5.08 105.19 103.28 3ibc n GLY 494 Ca 0.01 -2.07 -0.09 0.00 0.00 0.00 0.00 46.02 43.87 3ibc n GLY 494 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3ibc s ILE 495 N 0.00 0.00 0.00 -0.61 1.10 -1.26 -5.31 121.20 115.12 3ibc s ILE 495 Ca 0.00 -0.29 0.00 0.00 -0.51 0.00 0.00 60.65 59.85 3ibc s ILE 495 Cb 0.00 -1.34 0.00 0.00 0.15 0.00 0.00 42.46 41.27 3ibc s ILE 495 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 174.94 174.50