#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dxb s MET 344 N 0.00 3.29 0.00 0.54 1.00 -1.26 -5.10 119.30 117.77 3dxb s MET 344 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 55.69 55.49 3dxb s MET 344 Cb 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 34.83 30.71 3dxb s MET 344 CO 0.00 -1.85 0.00 -1.13 0.00 0.00 0.00 175.02 172.04 3dxb n SER 345 N 8.52 0.96 -4.63 3.03 3.41 -1.26 -5.08 113.62 118.57 3dxb n SER 345 Ca 0.03 -0.15 -0.42 0.00 -0.26 0.00 0.00 58.87 58.06 3dxb n SER 345 Cb 0.48 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.40 3dxb n SER 345 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dxb s ASP 346 N -0.19 6.80 0.00 4.04 -1.08 -1.26 -4.92 116.67 120.07 3dxb s ASP 346 Ca 0.00 0.88 0.25 0.00 -0.52 0.00 0.00 52.55 53.15 3dxb s ASP 346 Cb 0.00 -2.47 0.62 0.00 -1.46 0.00 0.00 42.92 39.61 3dxb s ASP 346 CO 0.00 -0.72 1.50 0.29 0.52 0.00 0.00 175.17 176.76 3dxb n LYS 347 N 6.46 2.02 -3.17 4.34 4.01 -1.26 -4.92 118.16 125.64 3dxb n LYS 347 Ca 0.08 -1.51 -0.39 0.00 -0.51 0.00 0.00 58.31 55.98 3dxb n LYS 347 Cb 0.48 -1.46 -0.06 0.00 -0.51 0.00 0.00 35.03 33.47 3dxb n LYS 347 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3dxb s ILE 348 N -1.88 4.76 -0.24 -0.18 1.01 -1.26 -4.49 121.20 118.92 3dxb s ILE 348 Ca 0.34 1.34 -0.22 0.00 0.00 0.00 0.00 60.65 62.11 3dxb s ILE 348 Cb 0.20 -3.97 -0.01 0.00 0.01 0.00 0.00 42.46 38.69 3dxb s ILE 348 CO 0.31 0.47 0.72 -0.63 0.00 0.00 0.00 174.94 175.80 3dxb s ILE 349 N -0.60 4.93 -0.46 2.92 1.01 0.43 -4.97 121.20 124.46 3dxb s ILE 349 Ca 0.32 1.33 -0.18 0.00 0.00 0.00 0.00 60.65 62.12 3dxb s ILE 349 Cb -0.20 -4.02 0.04 0.00 0.01 0.00 0.00 42.46 38.30 3dxb s ILE 349 CO 0.20 0.00 0.52 -1.00 0.00 0.00 0.00 174.94 174.66 3dxb s HIS 350 N 2.53 3.12 0.46 3.97 3.76 -1.26 -0.54 115.29 127.34 3dxb s HIS 350 Ca 0.30 -0.44 -0.09 0.00 -0.15 0.00 0.00 55.06 54.68 3dxb s HIS 350 Cb -0.16 -3.19 -0.05 0.00 1.11 0.00 0.00 32.58 30.29 3dxb s HIS 350 CO 0.08 -0.84 0.82 -0.51 -0.85 0.00 0.00 174.74 173.44 3dxb s LEU 351 N 2.34 3.68 0.37 0.89 1.43 0.75 -4.96 118.68 123.18 3dxb s LEU 351 Ca 0.14 1.14 0.04 0.00 -1.03 0.00 0.00 54.13 54.41 3dxb s LEU 351 Cb -0.18 -4.07 -0.05 0.00 0.03 0.00 0.00 46.19 41.92 3dxb s LEU 351 CO 0.13 -0.53 0.08 0.42 0.23 0.00 0.00 176.35 176.68 3dxb s THR 352 N -2.60 1.01 0.19 5.49 -4.23 -1.26 -4.60 115.64 109.63 3dxb s THR 352 Ca 0.51 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.91 3dxb s THR 352 Cb -0.10 -2.60 0.11 0.00 1.34 0.00 0.00 72.50 71.25 3dxb s THR 352 CO 0.38 0.00 1.78 0.44 -0.54 0.00 0.00 174.62 176.68 3dxb h ASP 353 N 1.94 0.89 0.54 3.99 3.45 -1.92 -2.48 116.42 122.82 3dxb h ASP 353 Ca -0.39 -0.13 -0.09 0.00 0.43 0.00 0.00 57.03 56.85 3dxb h ASP 353 Cb 1.26 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.79 3dxb h ASP 353 CO 0.66 0.77 -0.41 0.44 -1.57 0.00 0.00 179.24 179.13 3dxb h ASP 354 N 0.94 0.00 0.33 6.45 3.45 -2.01 -3.21 116.42 122.37 3dxb h ASP 354 Ca 0.23 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.69 3dxb h ASP 354 Cb 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.89 3dxb h ASP 354 CO -0.03 0.41 -0.66 -1.54 -1.57 0.00 0.00 179.24 175.85 3dxb n SER 355 N -3.85 0.67 -0.23 6.45 3.41 -1.15 -4.56 113.62 114.36 3dxb n SER 355 Ca -0.01 -0.50 -0.05 0.00 -0.26 0.00 0.00 58.87 58.05 3dxb n SER 355 Cb 0.46 0.49 0.06 0.00 -0.26 0.00 0.00 64.21 64.97 3dxb n SER 355 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3dxb h PHE 356 N 0.01 0.78 0.48 7.33 3.57 -1.45 -1.30 116.94 126.37 3dxb h PHE 356 Ca 0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 3dxb h PHE 356 Cb 0.50 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.99 3dxb h PHE 356 CO 0.00 0.47 -0.24 0.22 -2.23 0.00 0.00 178.31 176.53 3dxb h ASP 357 N 0.83 -0.57 -0.40 0.41 1.82 -1.81 -0.78 116.42 115.92 3dxb h ASP 357 Ca 0.25 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.90 3dxb h ASP 357 Cb -0.03 0.15 -0.02 0.00 0.68 0.00 0.00 39.33 40.11 3dxb h ASP 357 CO -0.08 -0.40 0.19 0.74 -1.61 0.00 0.00 179.24 178.07 3dxb h THR 358 N -0.66 1.18 -0.01 2.25 2.02 -1.86 -0.60 112.91 115.23 3dxb h THR 358 Ca -0.07 -0.51 -0.16 0.00 0.77 0.00 0.00 66.41 66.45 3dxb h THR 358 Cb 0.51 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 3dxb h THR 358 CO 0.10 0.19 -0.73 0.44 0.37 0.00 0.00 175.52 175.89 3dxb h ASP 359 N 0.50 0.07 0.00 4.18 3.32 -1.17 -3.32 116.42 120.01 3dxb h ASP 359 Ca 0.14 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 3dxb h ASP 359 Cb 0.13 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3dxb h ASP 359 CO -0.02 0.78 -1.00 0.52 -1.72 0.00 0.00 179.24 177.80 3dxb n VAL 360 N -3.70 0.82 0.08 -1.35 0.31 -0.30 -4.54 118.33 109.65 3dxb n VAL 360 Ca -0.01 0.06 -0.08 0.00 -0.01 0.00 0.00 64.34 64.30 3dxb n VAL 360 Cb 0.71 -1.70 -0.05 0.00 -0.91 0.00 0.00 33.84 31.89 3dxb n VAL 360 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3dxb h LEU 361 N -0.31 0.14 -3.64 7.52 3.38 -1.26 -3.15 115.31 117.99 3dxb h LEU 361 Ca -0.13 -0.13 -0.35 0.00 0.09 0.00 0.00 57.88 57.37 3dxb h LEU 361 Cb 0.83 -0.04 -0.20 0.00 0.09 0.00 0.00 40.66 41.33 3dxb h LEU 361 CO -0.08 1.00 0.21 0.29 0.09 0.00 0.00 178.44 179.95 3dxb n LYS 362 N -3.54 2.08 -3.49 1.13 5.02 -0.35 -3.15 118.16 115.86 3dxb n LYS 362 Ca -0.02 -3.17 -0.29 0.00 -2.02 0.00 0.00 58.31 52.80 3dxb n LYS 362 Cb 0.86 -1.99 -0.04 0.00 -0.02 0.00 0.00 35.03 33.84 3dxb n LYS 362 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dxb s ALA 363 N -3.32 3.69 -0.05 7.82 0.00 -1.19 -4.90 121.76 123.81 3dxb s ALA 363 Ca 0.50 -0.57 -0.28 0.00 0.00 0.00 0.00 51.96 51.62 3dxb s ALA 363 Cb 0.44 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 3dxb s ALA 363 CO 0.04 0.41 0.91 -0.51 0.00 0.00 0.00 175.76 176.61 3dxb s ASP 364 N -2.88 7.23 0.18 0.00 1.01 -1.26 -4.63 116.67 116.31 3dxb s ASP 364 Ca 0.43 1.49 0.00 0.00 0.71 0.00 0.00 52.55 55.18 3dxb s ASP 364 Cb -0.11 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.30 3dxb s ASP 364 CO 0.27 -0.28 0.00 0.61 0.21 0.00 0.00 175.17 175.99 3dxb n GLY 365 N 3.03 -1.98 3.73 0.21 0.00 -1.26 -4.87 105.19 104.06 3dxb n GLY 365 Ca 0.05 -1.35 -0.42 0.00 0.00 0.00 0.00 46.02 44.30 3dxb n GLY 365 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dxb s ALA 366 N -2.15 3.70 -0.11 4.61 0.00 -1.26 -4.59 121.76 121.96 3dxb s ALA 366 Ca 0.00 1.37 0.02 0.00 0.00 0.00 0.00 51.96 53.35 3dxb s ALA 366 Cb 0.00 -3.59 0.01 0.00 0.00 0.00 0.00 23.12 19.54 3dxb s ALA 366 CO 0.00 -0.78 -0.18 0.42 0.00 0.00 0.00 175.76 175.22 3dxb s ILE 367 N 0.47 1.70 -0.37 0.00 -1.09 -0.13 -1.22 121.20 120.56 3dxb s ILE 367 Ca 0.64 -0.77 -0.14 0.00 -2.23 0.00 0.00 60.65 58.14 3dxb s ILE 367 Cb -0.43 -1.52 0.00 0.00 -1.58 0.00 0.00 42.46 38.92 3dxb s ILE 367 CO 0.39 0.48 0.30 -0.22 -1.23 0.00 0.00 174.94 174.66 3dxb s LEU 368 N 0.84 4.76 -0.21 2.97 2.96 0.15 -0.46 118.68 129.68 3dxb s LEU 368 Ca -0.09 -0.59 -0.13 0.00 -0.22 0.00 0.00 54.13 53.11 3dxb s LEU 368 Cb -0.15 -2.20 -0.05 0.00 0.50 0.00 0.00 46.19 44.28 3dxb s LEU 368 CO -0.00 -0.37 0.25 -0.69 -1.32 0.00 0.00 176.35 174.22 3dxb s VAL 369 N 1.80 5.31 -0.30 1.68 1.01 0.48 -0.46 120.40 129.91 3dxb s VAL 369 Ca 0.07 0.40 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 3dxb s VAL 369 Cb -0.18 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.63 3dxb s VAL 369 CO 0.11 0.34 0.10 -0.62 0.00 0.00 0.00 175.10 175.03 3dxb s ASP 370 N 0.86 5.24 -0.26 3.32 3.68 0.42 -1.09 116.67 128.83 3dxb s ASP 370 Ca 0.12 -0.71 -0.19 0.00 2.13 0.00 0.00 52.55 53.90 3dxb s ASP 370 Cb -0.13 -1.91 -0.02 0.00 -1.45 0.00 0.00 42.92 39.41 3dxb s ASP 370 CO 0.04 -0.21 0.57 -0.36 0.13 0.00 0.00 175.17 175.35 3dxb s PHE 371 N 1.52 3.27 0.30 -5.34 0.40 -0.57 -0.84 117.98 116.71 3dxb s PHE 371 Ca 0.03 0.69 -0.03 0.00 -0.60 0.00 0.00 56.93 57.02 3dxb s PHE 371 Cb -0.17 -2.80 -0.01 0.00 0.51 0.00 0.00 43.02 40.55 3dxb s PHE 371 CO 0.03 -0.32 0.39 1.67 0.70 0.00 0.00 175.22 177.69 3dxb s TRP 372 N 2.42 1.04 0.07 0.36 1.48 -0.88 -2.94 118.94 120.48 3dxb s TRP 372 Ca 0.24 -1.25 -0.19 0.00 -1.06 0.00 0.00 56.10 53.84 3dxb s TRP 372 Cb -0.15 -0.19 0.04 0.00 -1.16 0.00 0.00 33.47 32.00 3dxb s TRP 372 CO 0.09 -0.99 0.44 0.00 -4.06 0.00 0.00 176.95 172.43 3dxb s ALA 373 N -3.46 -1.08 0.35 2.67 0.00 -1.26 -0.83 121.76 118.14 3dxb s ALA 373 Ca 0.32 0.30 0.10 0.00 0.00 0.00 0.00 51.96 52.68 3dxb s ALA 373 Cb 0.01 0.45 0.66 0.00 0.00 0.00 0.00 23.12 24.23 3dxb s ALA 373 CO 0.18 -0.52 1.81 0.93 0.00 0.00 0.00 175.76 178.16 3dxb h GLU 374 N 2.78 0.14 0.00 0.00 4.39 -2.01 -2.23 114.58 117.65 3dxb h GLU 374 Ca -0.32 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.33 3dxb h GLU 374 Cb 1.22 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 3dxb h GLU 374 CO 0.44 0.45 0.00 -2.67 -1.16 0.00 0.00 179.01 176.06 3dxb n TRP 375 N -4.12 0.00 -2.66 4.33 4.27 -1.26 -4.75 117.44 113.25 3dxb n TRP 375 Ca -0.01 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.17 3dxb n TRP 375 Cb 0.39 -0.48 -0.03 0.00 -1.36 0.00 0.00 31.31 29.84 3dxb n TRP 375 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3dxb h GLY 377 N 11.15 -0.49 2.00 0.00 0.00 -1.86 -2.97 103.07 110.89 3dxb h GLY 377 Ca -0.24 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3dxb h GLY 377 CO 1.11 -0.18 0.00 -0.56 0.00 0.00 0.00 176.54 176.91 3dxb h PRO 378 N -0.59 0.00 -0.42 4.80 0.13 -1.92 -2.06 132.00 131.94 3dxb h PRO 378 Ca -0.05 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.94 3dxb h PRO 378 Cb 0.44 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.55 3dxb h PRO 378 CO 0.08 0.00 -0.28 0.00 -0.23 0.00 0.00 178.00 177.57 3dxb h LYS 380 N 0.76 0.06 -0.42 0.00 1.57 -1.30 -2.19 116.57 115.06 3dxb h LYS 380 Ca 0.09 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 3dxb h LYS 380 Cb 0.85 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 33.08 3dxb h LYS 380 CO 0.07 0.75 -0.48 0.52 -0.57 0.00 0.00 179.45 179.74 3dxb h MET 381 N 0.04 -0.34 -0.00 3.15 2.86 -1.35 -2.94 114.93 116.35 3dxb h MET 381 Ca -0.01 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3dxb h MET 381 Cb 1.26 0.08 0.00 0.00 0.06 0.00 0.00 31.60 33.00 3dxb h MET 381 CO 0.10 -0.23 -0.17 0.44 1.06 0.00 0.00 176.91 178.11 3dxb n ILE 382 N -5.40 0.00 -0.04 -1.22 -5.35 -1.14 -4.21 119.36 102.00 3dxb n ILE 382 Ca -0.02 -0.02 -0.08 0.00 -0.27 0.00 0.00 62.75 62.36 3dxb n ILE 382 Cb 0.35 -0.15 -0.02 0.00 -1.74 0.00 0.00 39.64 38.08 3dxb n ILE 382 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dxb h ALA 383 N 3.25 -0.08 0.00 -1.28 0.00 -1.20 0.68 119.26 120.62 3dxb h ALA 383 Ca 0.00 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 3dxb h ALA 383 Cb 0.44 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3dxb h ALA 383 CO 0.00 -0.64 -0.49 -1.35 0.00 0.00 0.00 179.25 176.77 3dxb h PRO 384 N -0.22 0.00 -0.47 0.00 0.11 -1.75 -2.78 132.00 126.90 3dxb h PRO 384 Ca 0.13 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 3dxb h PRO 384 Cb 0.42 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 3dxb h PRO 384 CO -0.36 0.49 0.23 0.82 -0.21 0.00 0.00 178.00 178.98 3dxb h ILE 385 N 0.00 1.18 -0.52 4.15 2.04 -1.64 -2.58 117.51 120.14 3dxb h ILE 385 Ca -0.00 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.37 3dxb h ILE 385 Cb 0.89 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 3dxb h ILE 385 CO 0.06 0.20 0.34 -0.07 0.00 0.00 0.00 178.15 178.69 3dxb h LEU 386 N 0.61 0.57 -0.37 1.44 4.07 -0.68 -0.92 115.31 120.03 3dxb h LEU 386 Ca 0.16 -0.01 -0.04 0.00 0.08 0.00 0.00 57.88 58.07 3dxb h LEU 386 Cb 0.10 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.69 3dxb h LEU 386 CO -0.02 0.41 0.09 0.44 -1.08 0.00 0.00 178.44 178.27 3dxb h ASP 387 N 0.67 0.57 -0.01 -0.43 3.45 -1.22 -0.10 116.42 119.33 3dxb h ASP 387 Ca 0.20 -0.24 -0.00 0.00 0.43 0.00 0.00 57.03 57.42 3dxb h ASP 387 Cb -0.03 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 38.59 3dxb h ASP 387 CO -0.05 0.65 0.00 -0.33 -1.57 0.00 0.00 179.24 177.95 3dxb h GLU 388 N 0.45 0.02 -0.93 3.56 5.08 -1.07 -2.26 114.58 119.42 3dxb h GLU 388 Ca 0.12 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.56 3dxb h GLU 388 Cb 0.31 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 3dxb h GLU 388 CO 0.00 0.19 0.58 0.82 -1.00 0.00 0.00 179.01 179.60 3dxb h ILE 389 N -0.15 1.00 -0.49 3.13 1.08 -1.17 0.22 117.51 121.12 3dxb h ILE 389 Ca 0.00 -0.34 -0.02 0.00 -0.39 0.00 0.00 64.86 64.11 3dxb h ILE 389 Cb 0.17 -0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 33.81 3dxb h ILE 389 CO -0.00 0.18 0.22 0.00 -0.69 0.00 0.00 178.15 177.87 3dxb h ALA 390 N 1.47 1.48 0.19 1.87 0.00 -0.83 0.61 119.26 124.04 3dxb h ALA 390 Ca 0.43 -0.11 -0.32 0.00 0.00 0.00 0.00 54.91 54.91 3dxb h ALA 390 Cb 0.29 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 17.90 3dxb h ALA 390 CO -0.21 0.41 -1.49 -0.44 0.00 0.00 0.00 179.25 177.52 3dxb h ASP 391 N 0.69 0.64 1.28 0.00 3.32 -0.70 -3.28 116.42 118.37 3dxb h ASP 391 Ca 0.17 -0.75 0.00 0.00 0.02 0.00 0.00 57.03 56.47 3dxb h ASP 391 Cb 0.09 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.43 3dxb h ASP 391 CO -0.02 1.60 -0.51 -0.33 -1.72 0.00 0.00 179.24 178.26 3dxb h GLU 392 N 0.11 0.00 -0.36 3.56 5.08 -0.42 -3.20 114.58 119.36 3dxb h GLU 392 Ca -0.24 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.05 3dxb h GLU 392 Cb 2.09 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 31.30 3dxb h GLU 392 CO 0.22 0.00 0.03 0.66 -1.00 0.00 0.00 179.01 178.92 3dxb n TYR 393 N -2.57 1.23 -1.67 4.33 4.02 0.19 -5.00 117.16 117.68 3dxb n TYR 393 Ca 0.03 -1.07 -0.49 0.00 -0.01 0.00 0.00 57.90 56.36 3dxb n TYR 393 Cb 0.50 -0.41 -0.05 0.00 -0.02 0.00 0.00 39.34 39.36 3dxb n TYR 393 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3dxb n GLN 394 N -0.56 1.97 0.00 -0.72 6.02 -1.21 -1.14 117.38 121.74 3dxb n GLN 394 Ca 0.27 0.72 0.00 0.00 -0.01 0.00 0.00 57.00 57.97 3dxb n GLN 394 Cb 1.01 -2.50 0.00 0.00 1.02 0.00 0.00 30.24 29.77 3dxb n GLN 394 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dxb n GLY 395 N 3.82 3.11 0.00 1.08 0.00 -1.26 -4.80 105.19 107.14 3dxb n GLY 395 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3dxb n GLY 395 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3dxb n LYS 396 N -0.89 6.62 -3.68 1.61 2.85 -0.76 -5.04 118.16 118.88 3dxb n LYS 396 Ca 0.00 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 57.14 3dxb n LYS 396 Cb 0.00 -0.52 -0.09 0.00 -0.65 0.00 0.00 35.03 33.78 3dxb n LYS 396 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 3dxb s LEU 397 N -2.02 -0.28 -0.12 -5.58 2.96 -0.29 -4.19 118.68 109.16 3dxb s LEU 397 Ca 0.00 1.16 -0.01 0.00 -0.22 0.00 0.00 54.13 55.06 3dxb s LEU 397 Cb 0.00 1.92 -0.03 0.00 0.50 0.00 0.00 46.19 48.58 3dxb s LEU 397 CO 0.00 -0.20 -0.07 -0.89 -1.32 0.00 0.00 176.35 173.87 3dxb s THR 398 N 0.69 3.65 -0.12 3.68 2.01 -0.36 -4.38 115.64 120.82 3dxb s THR 398 Ca -0.03 -0.46 -0.15 0.00 0.31 0.00 0.00 61.69 61.36 3dxb s THR 398 Cb -0.05 -2.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.87 3dxb s THR 398 CO -0.05 0.54 0.35 -0.69 -0.69 0.00 0.00 174.62 174.08 3dxb s VAL 399 N -0.05 5.24 0.04 3.82 1.01 -1.26 -0.68 120.40 128.52 3dxb s VAL 399 Ca 0.00 0.68 0.04 0.00 0.00 0.00 0.00 61.98 62.70 3dxb s VAL 399 Cb -0.13 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 3dxb s VAL 399 CO 0.03 0.43 -0.13 0.00 0.00 0.00 0.00 175.10 175.43 3dxb s ALA 400 N 0.11 1.03 -0.04 5.51 0.00 0.39 -0.43 121.76 128.34 3dxb s ALA 400 Ca 0.20 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.42 3dxb s ALA 400 Cb -0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 3dxb s ALA 400 CO 0.07 0.17 -0.18 0.15 0.00 0.00 0.00 175.76 175.98 3dxb s LYS 401 N -1.18 1.78 -0.18 0.00 1.02 0.30 -0.44 119.74 121.04 3dxb s LYS 401 Ca -0.00 -0.64 0.00 0.00 0.02 0.00 0.00 55.97 55.35 3dxb s LYS 401 Cb -0.08 -1.57 0.04 0.00 -0.52 0.00 0.00 37.83 35.70 3dxb s LYS 401 CO 0.01 0.28 -0.10 -1.17 -0.92 0.00 0.00 175.35 173.46 3dxb s LEU 402 N -0.07 2.03 -0.37 3.17 2.96 -0.02 -0.18 118.68 126.21 3dxb s LEU 402 Ca -0.02 -0.77 -0.29 0.00 -0.22 0.00 0.00 54.13 52.83 3dxb s LEU 402 Cb -0.11 -1.15 0.01 0.00 0.50 0.00 0.00 46.19 45.44 3dxb s LEU 402 CO 0.02 -0.14 1.29 0.21 -1.32 0.00 0.00 176.35 176.41 3dxb s ASN 403 N 1.47 6.57 0.41 3.68 3.84 -1.26 -2.08 114.94 127.57 3dxb s ASN 403 Ca 0.00 0.94 0.28 0.00 0.21 0.00 0.00 52.86 54.30 3dxb s ASN 403 Cb -0.15 -2.54 1.05 0.00 -0.55 0.00 0.00 41.25 39.05 3dxb s ASN 403 CO -0.08 -1.21 1.83 0.16 -2.79 0.00 0.00 177.10 175.00 3dxb h ILE 404 N 6.16 0.00 -0.06 -5.21 3.07 -1.19 0.94 117.51 121.22 3dxb h ILE 404 Ca -0.26 -0.49 -0.07 0.00 1.55 0.00 0.00 64.86 65.60 3dxb h ILE 404 Cb 1.09 1.41 0.00 0.00 -0.27 0.00 0.00 36.82 39.05 3dxb h ILE 404 CO 1.07 0.00 -0.22 0.44 -1.05 0.00 0.00 178.15 178.38 3dxb h ASP 405 N 0.00 0.30 1.35 2.16 3.45 -1.92 -3.12 116.42 118.65 3dxb h ASP 405 Ca 0.00 -0.63 -0.11 0.00 0.43 0.00 0.00 57.03 56.72 3dxb h ASP 405 Cb 0.56 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 39.22 3dxb h ASP 405 CO 0.00 0.88 -0.67 1.56 -1.57 0.00 0.00 179.24 179.44 3dxb h GLN 406 N -0.26 0.00 -2.66 3.56 4.20 -1.89 -3.39 115.11 114.67 3dxb h GLN 406 Ca -0.01 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 58.10 3dxb h GLN 406 Cb 0.86 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.24 3dxb h GLN 406 CO 0.05 0.44 -0.80 0.09 -0.67 0.00 0.00 178.83 177.94 3dxb n ASN 407 N -3.15 1.12 -0.08 1.46 4.13 0.31 -4.94 115.26 114.12 3dxb n ASN 407 Ca -0.00 -2.76 0.14 0.00 1.68 0.00 0.00 54.58 53.63 3dxb n ASN 407 Cb 0.74 -0.64 0.54 0.00 -1.54 0.00 0.00 39.78 38.88 3dxb n ASN 407 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 3dxb n PRO 408 N 2.39 0.46 0.05 3.52 -0.04 -1.18 -4.10 135.00 136.10 3dxb n PRO 408 Ca 0.25 -0.16 -0.16 0.00 -0.04 0.00 0.00 63.50 63.39 3dxb n PRO 408 Cb 0.42 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.32 3dxb n PRO 408 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3dxb h GLY 409 N 4.98 0.60 0.39 0.55 0.00 -1.94 -3.40 103.07 104.25 3dxb h GLY 409 Ca 0.00 -1.03 -0.00 0.00 0.00 0.00 0.00 47.33 46.30 3dxb h GLY 409 CO 0.00 0.91 -0.02 -0.84 0.00 0.00 0.00 176.54 176.59 3dxb h THR 410 N 0.31 1.36 -0.63 4.70 2.02 -1.94 -3.37 112.91 115.35 3dxb h THR 410 Ca -0.10 -1.37 0.12 0.00 0.77 0.00 0.00 66.41 65.84 3dxb h THR 410 Cb 1.61 2.25 -0.09 0.00 -1.74 0.00 0.00 68.15 70.18 3dxb h THR 410 CO 0.18 0.34 0.16 0.00 0.37 0.00 0.00 175.52 176.57 3dxb h ALA 411 N 0.25 0.78 0.00 6.16 0.00 -1.81 -1.87 119.26 122.77 3dxb h ALA 411 Ca -0.00 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3dxb h ALA 411 Cb 0.59 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3dxb h ALA 411 CO 0.01 -0.29 -0.05 -1.35 0.00 0.00 0.00 179.25 177.57 3dxb h PRO 412 N 0.30 0.00 0.00 0.00 0.11 -1.79 -1.90 132.00 128.71 3dxb h PRO 412 Ca 0.34 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.42 3dxb h PRO 412 Cb 0.50 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 3dxb h PRO 412 CO -0.40 0.05 -0.10 0.87 -0.21 0.00 0.00 178.00 178.21 3dxb h LYS 413 N 0.00 0.00 -0.32 1.05 1.57 -1.52 -3.03 116.57 114.32 3dxb h LYS 413 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dxb h LYS 413 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3dxb h LYS 413 CO 0.01 0.10 0.00 0.66 -0.57 0.00 0.00 179.45 179.65 3dxb n TYR 414 N -3.26 0.54 -2.76 -1.35 4.02 -0.75 -4.98 117.16 108.62 3dxb n TYR 414 Ca 0.00 -0.57 -0.16 0.00 -0.01 0.00 0.00 57.90 57.16 3dxb n TYR 414 Cb 0.34 -0.08 0.02 0.00 -0.02 0.00 0.00 39.34 39.60 3dxb n TYR 414 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dxb n GLY 415 N 0.29 -0.20 3.72 2.72 0.00 -1.14 -4.97 105.19 105.60 3dxb n GLY 415 Ca 0.13 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3dxb n GLY 415 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dxb s ILE 416 N -2.98 3.38 0.00 -0.61 -1.09 -0.96 -4.94 121.20 114.00 3dxb s ILE 416 Ca 0.20 1.01 0.00 0.00 -2.23 0.00 0.00 60.65 59.64 3dxb s ILE 416 Cb -0.09 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.14 3dxb s ILE 416 CO 0.25 0.09 0.00 0.54 -1.23 0.00 0.00 174.94 174.59 3dxb n ARG 417 N 3.70 0.00 -2.21 2.79 1.74 -1.26 -4.73 116.66 116.68 3dxb n ARG 417 Ca 0.10 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.88 3dxb n ARG 417 Cb 0.43 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.87 3dxb n ARG 417 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3dxb s GLY 418 N -1.36 1.71 0.06 -0.13 0.00 -1.26 -5.10 107.32 101.25 3dxb s GLY 418 Ca 0.00 -0.15 0.07 0.00 0.00 0.00 0.00 44.72 44.65 3dxb s GLY 418 CO 0.00 0.09 -0.20 -0.26 0.00 0.00 0.00 173.10 172.73 3dxb s ILE 419 N -2.92 1.62 0.50 0.90 -4.36 -1.26 -4.09 121.20 111.58 3dxb s ILE 419 Ca 0.54 -1.30 -0.18 0.00 -0.26 0.00 0.00 60.65 59.45 3dxb s ILE 419 Cb -0.11 -1.44 -0.08 0.00 1.25 0.00 0.00 42.46 42.08 3dxb s ILE 419 CO 0.46 0.09 1.00 -2.16 0.24 0.00 0.00 174.94 174.57 3dxb s PRO 420 N -1.43 3.89 -0.04 0.37 0.04 -1.26 -4.76 135.00 131.81 3dxb s PRO 420 Ca 0.06 1.12 0.04 0.00 0.04 0.00 0.00 61.00 62.26 3dxb s PRO 420 Cb -0.09 -2.12 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 3dxb s PRO 420 CO 0.03 -0.33 -0.15 0.99 0.04 0.00 0.00 177.00 177.58 3dxb s THR 421 N -2.35 1.25 -0.24 1.26 2.01 -1.15 0.14 115.64 116.56 3dxb s THR 421 Ca 0.62 -0.61 -0.08 0.00 0.31 0.00 0.00 61.69 61.93 3dxb s THR 421 Cb -0.12 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.27 3dxb s THR 421 CO 0.25 0.37 0.08 -0.76 -0.69 0.00 0.00 174.62 173.87 3dxb s LEU 422 N 0.13 3.55 -0.18 4.42 1.43 0.20 -1.51 118.68 126.71 3dxb s LEU 422 Ca -0.05 -0.14 -0.06 0.00 -1.03 0.00 0.00 54.13 52.86 3dxb s LEU 422 Cb -0.11 -1.95 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 3dxb s LEU 422 CO 0.02 0.00 0.02 -0.76 0.23 0.00 0.00 176.35 175.86 3dxb s LEU 423 N 1.41 3.48 -0.29 1.79 1.43 -0.25 -0.36 118.68 125.89 3dxb s LEU 423 Ca 0.05 -0.07 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 3dxb s LEU 423 Cb -0.15 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 3dxb s LEU 423 CO 0.04 0.14 0.25 -0.22 0.23 0.00 0.00 176.35 176.78 3dxb s LEU 424 N 0.57 4.15 -0.08 1.79 2.96 0.31 -0.39 118.68 127.99 3dxb s LEU 424 Ca 0.00 -0.05 -0.02 0.00 -0.22 0.00 0.00 54.13 53.84 3dxb s LEU 424 Cb -0.14 -2.20 -0.03 0.00 0.50 0.00 0.00 46.19 44.32 3dxb s LEU 424 CO 0.02 -0.13 0.03 -0.36 -1.32 0.00 0.00 176.35 174.58 3dxb s PHE 425 N 1.83 3.23 -0.17 5.38 0.08 0.39 0.74 117.98 129.46 3dxb s PHE 425 Ca 0.09 0.24 -0.05 0.00 0.12 0.00 0.00 56.93 57.33 3dxb s PHE 425 Cb -0.16 -1.81 0.06 0.00 -0.57 0.00 0.00 43.02 40.54 3dxb s PHE 425 CO 0.11 0.51 0.09 0.15 -0.10 0.00 0.00 175.22 175.98 3dxb s LYS 426 N -0.96 0.07 -1.26 0.44 1.02 0.92 -0.95 119.74 119.02 3dxb s LYS 426 Ca 0.14 -0.08 -0.02 0.00 0.02 0.00 0.00 55.97 56.02 3dxb s LYS 426 Cb -0.11 -1.82 0.01 0.00 -0.52 0.00 0.00 37.83 35.38 3dxb s LYS 426 CO 0.03 -0.66 1.00 0.09 -0.92 0.00 0.00 175.35 174.89 3dxb n ASN 427 N 5.27 -2.95 0.00 2.83 3.02 -1.26 -2.33 115.26 119.84 3dxb n ASN 427 Ca -0.07 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.85 3dxb n ASN 427 Cb 0.49 -4.93 0.00 0.00 -0.61 0.00 0.00 39.78 34.73 3dxb n ASN 427 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dxb n GLY 428 N -1.39 0.62 3.47 7.41 0.00 -1.19 -5.01 105.19 109.10 3dxb n GLY 428 Ca -0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 3dxb n GLY 428 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dxb s GLU 429 N -0.28 2.95 -0.32 1.61 2.02 -0.98 -4.97 118.70 118.73 3dxb s GLU 429 Ca 0.00 -0.64 -0.29 0.00 0.02 0.00 0.00 54.97 54.06 3dxb s GLU 429 Cb 0.00 -2.56 -0.01 0.00 0.10 0.00 0.00 34.13 31.66 3dxb s GLU 429 CO 0.00 0.47 1.67 0.08 0.02 0.00 0.00 175.26 177.50 3dxb s VAL 430 N -0.31 3.63 -0.12 2.63 1.01 -1.26 -0.05 120.40 125.91 3dxb s VAL 430 Ca 0.03 0.65 0.16 0.00 0.00 0.00 0.00 61.98 62.83 3dxb s VAL 430 Cb -0.13 -3.79 -0.24 0.00 0.00 0.00 0.00 36.38 32.23 3dxb s VAL 430 CO 0.03 -0.46 0.39 0.00 0.00 0.00 0.00 175.10 175.05 3dxb n ALA 431 N 9.50 1.60 -3.44 5.51 0.00 0.23 -4.95 120.51 128.96 3dxb n ALA 431 Ca 0.20 -1.01 -0.12 0.00 0.00 0.00 0.00 53.44 52.52 3dxb n ALA 431 Cb 0.47 -0.54 -0.02 0.00 0.00 0.00 0.00 19.45 19.36 3dxb n ALA 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dxb s ALA 432 N -2.62 -1.65 0.03 0.00 0.00 -1.12 -5.00 121.76 111.40 3dxb s ALA 432 Ca -0.07 0.62 0.02 0.00 0.00 0.00 0.00 51.96 52.53 3dxb s ALA 432 Cb 0.07 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 3dxb s ALA 432 CO 0.83 -0.74 -0.07 0.95 0.00 0.00 0.00 175.76 176.73 3dxb s THR 433 N -3.52 0.54 -0.05 0.00 -4.23 -1.26 -0.53 115.64 106.59 3dxb s THR 433 Ca 0.01 -0.88 -0.01 0.00 -1.18 0.00 0.00 61.69 59.63 3dxb s THR 433 Cb -0.01 -0.57 0.03 0.00 1.34 0.00 0.00 72.50 73.29 3dxb s THR 433 CO -0.11 -0.25 0.02 -0.75 -0.54 0.00 0.00 174.62 172.99 3dxb s LYS 434 N -1.23 0.29 -0.21 3.99 2.47 0.51 -5.00 119.74 120.56 3dxb s LYS 434 Ca -0.07 0.21 -0.09 0.00 -1.56 0.00 0.00 55.97 54.46 3dxb s LYS 434 Cb -0.08 -0.71 -0.05 0.00 -1.46 0.00 0.00 37.83 35.53 3dxb s LYS 434 CO 0.00 -0.28 0.12 0.08 0.16 0.00 0.00 175.35 175.43 3dxb s VAL 435 N 1.89 5.21 0.00 4.02 1.01 -1.26 0.59 120.40 131.85 3dxb s VAL 435 Ca 0.02 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.13 3dxb s VAL 435 Cb -0.12 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.87 3dxb s VAL 435 CO -0.04 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.08 3dxb n GLY 436 N 3.85 -0.43 3.81 4.51 0.00 0.12 -4.98 105.19 112.06 3dxb n GLY 436 Ca -0.16 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.76 3dxb n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dxb s ALA 437 N -1.42 2.70 0.01 4.61 0.00 -1.26 -4.82 121.76 121.58 3dxb s ALA 437 Ca 0.00 0.22 -0.28 0.00 0.00 0.00 0.00 51.96 51.91 3dxb s ALA 437 Cb 0.00 -3.20 0.09 0.00 0.00 0.00 0.00 23.12 20.01 3dxb s ALA 437 CO 0.00 -1.06 0.76 -0.48 0.00 0.00 0.00 175.76 174.98 3dxb s LEU 438 N -5.10 -0.51 1.03 0.00 2.34 -1.26 -5.14 118.68 110.05 3dxb s LEU 438 Ca 0.60 0.24 -0.12 0.00 0.06 0.00 0.00 54.13 54.91 3dxb s LEU 438 Cb -0.15 2.32 0.21 0.00 -0.56 0.00 0.00 46.19 48.01 3dxb s LEU 438 CO 0.47 -0.69 1.08 -0.94 -1.06 0.00 0.00 176.35 175.21 3dxb s SER 439 N -2.04 2.25 0.27 1.48 1.04 -1.26 -4.79 113.70 110.65 3dxb s SER 439 Ca -0.01 1.32 -0.04 0.00 0.48 0.00 0.00 55.95 57.70 3dxb s SER 439 Cb -0.01 -2.01 0.34 0.00 0.10 0.00 0.00 66.02 64.44 3dxb s SER 439 CO -0.04 -3.38 1.90 0.50 0.98 0.00 0.00 173.24 173.20 3dxb h LYS 440 N -2.06 1.13 -0.50 4.02 3.11 -1.99 -1.70 116.57 118.57 3dxb h LYS 440 Ca -0.56 -0.11 -0.09 0.00 -2.81 0.00 0.00 60.65 57.08 3dxb h LYS 440 Cb 1.33 -0.23 -0.02 0.00 -1.00 0.00 0.00 32.23 32.31 3dxb h LYS 440 CO 0.55 0.81 -0.05 0.78 -2.81 0.00 0.00 179.45 178.73 3dxb h GLY 441 N 1.16 0.99 1.59 5.01 0.00 -1.99 -1.80 103.07 108.03 3dxb h GLY 441 Ca 0.29 -0.77 -0.09 0.00 0.00 0.00 0.00 47.33 46.76 3dxb h GLY 441 CO -0.05 0.71 -0.21 1.46 0.00 0.00 0.00 176.54 178.44 3dxb h GLN 442 N 0.78 0.48 -0.20 4.80 4.20 -1.86 -1.06 115.11 122.25 3dxb h GLN 442 Ca 0.13 -0.17 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 3dxb h GLN 442 Cb 0.59 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.34 3dxb h GLN 442 CO 0.04 0.67 -0.44 1.25 -0.67 0.00 0.00 178.83 179.68 3dxb h LEU 443 N 0.43 0.74 -0.32 1.46 5.85 -1.22 -1.75 115.31 120.50 3dxb h LEU 443 Ca 0.07 -0.55 0.01 0.00 0.84 0.00 0.00 57.88 58.25 3dxb h LEU 443 Cb 0.62 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3dxb h LEU 443 CO 0.04 1.16 0.19 0.11 -0.34 0.00 0.00 178.44 179.60 3dxb h LYS 444 N 0.35 0.37 -0.84 1.25 1.57 -1.24 0.22 116.57 118.25 3dxb h LYS 444 Ca 0.00 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.82 3dxb h LYS 444 Cb 1.04 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.21 3dxb h LYS 444 CO 0.10 0.25 0.52 0.93 -0.57 0.00 0.00 179.45 180.67 3dxb h GLU 445 N 0.38 0.91 -0.42 3.15 5.08 -1.18 0.60 114.58 123.10 3dxb h GLU 445 Ca 0.13 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 3dxb h GLU 445 Cb 0.00 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 3dxb h GLU 445 CO -0.06 0.61 -0.13 0.35 -1.00 0.00 0.00 179.01 178.77 3dxb h PHE 446 N 0.94 0.95 -0.16 4.33 3.04 -0.96 -2.69 116.94 122.39 3dxb h PHE 446 Ca 0.37 -0.21 -0.05 0.00 3.98 0.00 0.00 57.97 62.05 3dxb h PHE 446 Cb 0.17 -0.23 -0.00 0.00 2.56 0.00 0.00 35.95 38.45 3dxb h PHE 446 CO -0.04 0.96 -0.10 -0.07 -2.02 0.00 0.00 178.31 177.05 3dxb h LEU 447 N 0.66 0.37 -1.33 0.59 4.07 -0.03 -2.88 115.31 116.77 3dxb h LEU 447 Ca 0.10 -0.43 0.02 0.00 0.08 0.00 0.00 57.88 57.66 3dxb h LEU 447 Cb 0.67 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 42.27 3dxb h LEU 447 CO 0.05 0.72 0.47 0.44 -1.08 0.00 0.00 178.44 179.03 3dxb h ASP 448 N 0.02 0.77 1.67 -0.43 3.32 0.14 -0.70 116.42 121.21 3dxb h ASP 448 Ca 0.03 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3dxb h ASP 448 Cb 0.58 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3dxb h ASP 448 CO 0.03 0.54 0.00 0.00 -1.72 0.00 0.00 179.24 178.09 3dxb h ALA 449 N 1.58 1.00 -0.00 3.45 0.00 -1.48 -3.33 119.26 120.47 3dxb h ALA 449 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3dxb h ALA 449 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3dxb h ALA 449 CO -0.07 0.00 -0.02 0.09 0.00 0.00 0.00 179.25 179.24 3dxb n ASN 450 N -2.84 1.20 -4.81 0.00 3.02 -0.84 -4.97 115.26 106.02 3dxb n ASN 450 Ca 0.04 -1.10 -0.32 0.00 -0.03 0.00 0.00 54.58 53.17 3dxb n ASN 450 Cb 0.46 0.13 -0.06 0.00 -0.61 0.00 0.00 39.78 39.70 3dxb n ASN 450 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dxb s LEU 451 N -0.60 3.98 0.00 3.41 1.43 -0.33 -4.99 118.68 121.58 3dxb s LEU 451 Ca 0.05 0.13 -0.31 0.00 -1.03 0.00 0.00 54.13 52.97 3dxb s LEU 451 Cb 0.04 -2.49 -0.09 0.00 0.03 0.00 0.00 46.19 43.67 3dxb s LEU 451 CO 0.07 0.22 1.98 0.00 0.23 0.00 0.00 176.35 178.85 3dxb n ALA 452 N 0.75 1.49 -2.84 4.21 0.00 -1.26 -4.91 120.51 117.95 3dxb n ALA 452 Ca -0.10 0.19 -0.24 0.00 0.00 0.00 0.00 53.44 53.30 3dxb n ALA 452 Cb 0.52 -2.67 -0.04 0.00 0.00 0.00 0.00 19.45 17.26 3dxb n ALA 452 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3dxb s GLY 453 N 4.65 1.53 -1.33 0.00 0.00 -1.26 -4.62 107.32 106.29 3dxb s GLY 453 Ca 0.90 -1.28 -0.01 0.00 0.00 0.00 0.00 44.72 44.33 3dxb s GLY 453 CO 0.43 -1.30 0.73 1.44 0.00 0.00 0.00 173.10 174.40 3dxb n SER 454 N -0.82 -1.53 -4.65 1.64 7.64 -1.26 -4.91 113.62 109.73 3dxb n SER 454 Ca -0.08 -0.81 -0.43 0.00 1.01 0.00 0.00 58.87 58.55 3dxb n SER 454 Cb 0.56 -4.05 -0.01 0.00 -1.01 0.00 0.00 64.21 59.70 3dxb n SER 454 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dxb n ALA 455 N -4.32 0.62 -3.63 -0.43 0.00 -1.26 -4.98 120.51 106.50 3dxb n ALA 455 Ca -0.27 0.38 -0.12 0.00 0.00 0.00 0.00 53.44 53.43 3dxb n ALA 455 Cb 0.66 -2.15 -0.07 0.00 0.00 0.00 0.00 19.45 17.89 3dxb n ALA 455 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3dxb s MET 456 N -1.69 0.70 -0.15 0.00 1.75 -1.26 -5.13 119.30 113.53 3dxb s MET 456 Ca 0.57 0.84 -0.29 0.00 -1.25 0.00 0.00 55.69 55.56 3dxb s MET 456 Cb -0.63 0.34 -0.02 0.00 2.84 0.00 0.00 34.83 37.36 3dxb s MET 456 CO 0.61 -0.08 1.23 -1.21 -0.65 0.00 0.00 175.02 174.92 3dxb s GLU 457 N 0.34 4.26 0.39 4.11 0.41 -1.26 -4.94 118.70 122.02 3dxb s GLU 457 Ca 0.01 1.64 -0.18 0.00 -0.41 0.00 0.00 54.97 56.03 3dxb s GLU 457 Cb -0.05 -3.71 -0.10 0.00 -1.78 0.00 0.00 34.13 28.49 3dxb s GLU 457 CO -0.02 -0.64 0.87 0.45 -0.49 0.00 0.00 175.26 175.42 3dxb s SER 458 N 1.81 6.85 0.04 -0.19 0.15 -1.26 -4.77 113.70 116.32 3dxb s SER 458 Ca 0.54 1.51 0.28 0.00 0.70 0.00 0.00 55.95 58.99 3dxb s SER 458 Cb -0.22 -2.47 1.11 0.00 -1.71 0.00 0.00 66.02 62.73 3dxb s SER 458 CO 0.16 -0.32 1.86 0.35 1.20 0.00 0.00 173.24 176.49 3dxb n THR 459 N -0.61 0.10 -3.50 6.45 -2.24 -1.26 -4.60 114.28 108.61 3dxb n THR 459 Ca 0.06 -0.05 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 3dxb n THR 459 Cb 0.54 -0.46 -0.08 0.00 -2.10 0.00 0.00 70.33 68.23 3dxb n THR 459 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3dxb s VAL 460 N -3.02 5.27 -0.08 2.28 1.01 -1.26 -0.41 120.40 124.19 3dxb s VAL 460 Ca 0.13 0.48 -0.02 0.00 0.00 0.00 0.00 61.98 62.56 3dxb s VAL 460 Cb 0.18 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 3dxb s VAL 460 CO 0.56 0.28 0.04 -0.32 0.00 0.00 0.00 175.10 175.66 3dxb s MET 461 N 1.25 3.07 -0.17 2.72 1.75 0.59 -1.29 119.30 127.22 3dxb s MET 461 Ca 0.14 -0.38 -0.00 0.00 -1.25 0.00 0.00 55.69 54.20 3dxb s MET 461 Cb -0.14 -2.87 0.00 0.00 2.84 0.00 0.00 34.83 34.66 3dxb s MET 461 CO 0.07 0.71 -0.15 0.54 -0.65 0.00 0.00 175.02 175.53 3dxb s VAL 462 N -0.97 2.60 -0.26 10.11 0.11 0.77 -0.32 120.40 132.44 3dxb s VAL 462 Ca 0.15 -0.77 -0.13 0.00 -2.93 0.00 0.00 61.98 58.30 3dxb s VAL 462 Cb -0.12 -2.11 -0.04 0.00 -1.53 0.00 0.00 36.38 32.58 3dxb s VAL 462 CO 0.05 0.51 0.29 -0.76 -3.33 0.00 0.00 175.10 171.86 3dxb s LEU 463 N 1.07 4.06 0.18 2.54 1.43 0.18 -2.35 118.68 125.79 3dxb s LEU 463 Ca -0.00 0.21 0.10 0.00 -1.03 0.00 0.00 54.13 53.40 3dxb s LEU 463 Cb -0.14 -2.30 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 3dxb s LEU 463 CO -0.04 -0.09 -0.14 -0.13 0.23 0.00 0.00 176.35 176.17 3dxb s ARG 464 N 1.72 1.89 -1.32 1.70 0.52 0.05 -0.94 118.95 122.58 3dxb s ARG 464 Ca 0.12 -1.33 -0.02 0.00 -0.52 0.00 0.00 55.73 53.98 3dxb s ARG 464 Cb -0.15 -2.07 0.01 0.00 0.52 0.00 0.00 34.95 33.26 3dxb s ARG 464 CO 0.09 0.43 0.83 -1.71 0.02 0.00 0.00 175.30 174.96 3dxb n ASN 465 N 0.16 -2.18 0.00 0.23 5.15 -1.26 -1.80 115.26 115.55 3dxb n ASN 465 Ca -0.12 -0.75 0.00 0.00 -0.60 0.00 0.00 54.58 53.11 3dxb n ASN 465 Cb 0.55 -4.33 0.00 0.00 -0.53 0.00 0.00 39.78 35.47 3dxb n ASN 465 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 3dxb n MET 466 N -4.35 0.00 -4.17 1.20 1.56 -1.26 -4.15 117.12 105.95 3dxb n MET 466 Ca -0.23 0.00 -0.19 0.00 -0.27 0.00 0.00 57.70 57.01 3dxb n MET 466 Cb 0.65 -0.98 -0.16 0.00 2.15 0.00 0.00 33.22 34.88 3dxb n MET 466 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 3dxb s VAL 467 N -1.97 0.51 0.33 1.12 1.01 -1.26 -4.77 120.40 115.36 3dxb s VAL 467 Ca 0.00 -0.14 -0.26 0.00 0.00 0.00 0.00 61.98 61.59 3dxb s VAL 467 Cb 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 36.38 35.76 3dxb s VAL 467 CO 0.00 0.21 0.94 -1.81 0.00 0.00 0.00 175.10 174.44 3dxb s ASP 468 N 0.75 7.30 0.43 3.32 1.11 -1.26 -4.17 116.67 124.16 3dxb s ASP 468 Ca -0.10 1.81 0.20 0.00 0.18 0.00 0.00 52.55 54.65 3dxb s ASP 468 Cb -0.13 -2.57 1.16 0.00 1.07 0.00 0.00 42.92 42.45 3dxb s ASP 468 CO 0.00 -0.09 1.83 -0.65 1.18 0.00 0.00 175.17 177.45 3dxb h PRO 469 N 3.08 0.33 0.00 8.23 0.11 -1.92 0.41 132.00 142.24 3dxb h PRO 469 Ca -0.47 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 3dxb h PRO 469 Cb 1.19 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3dxb h PRO 469 CO 0.65 0.22 -0.36 1.57 -0.21 0.00 0.00 178.00 179.87 3dxb h LYS 470 N 0.34 0.00 0.00 1.05 2.10 -1.96 -3.03 116.57 115.07 3dxb h LYS 470 Ca 0.51 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 59.13 3dxb h LYS 470 Cb 1.38 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.71 3dxb h LYS 470 CO -0.18 0.36 -0.14 -0.44 -2.00 0.00 0.00 179.45 177.05 3dxb h ASP 471 N 0.00 0.00 -2.57 7.07 3.32 -0.54 -3.45 116.42 120.24 3dxb h ASP 471 Ca -0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.51 3dxb h ASP 471 Cb 0.67 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.28 3dxb h ASP 471 CO 0.05 0.14 1.00 -0.38 -1.72 0.00 0.00 179.24 178.32 3dxb n ILE 472 N -3.23 0.05 -4.15 0.35 5.41 -1.15 -5.00 119.36 111.65 3dxb n ILE 472 Ca 0.01 -0.01 -0.10 0.00 1.00 0.00 0.00 62.75 63.66 3dxb n ILE 472 Cb 0.43 -1.94 -0.04 0.00 -0.71 0.00 0.00 39.64 37.38 3dxb n ILE 472 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3dxb n ASP 473 N 4.13 -0.17 0.29 4.38 5.68 -1.26 -5.04 116.55 124.56 3dxb n ASP 473 Ca 0.16 -2.04 0.19 0.00 -0.50 0.00 0.00 54.79 52.61 3dxb n ASP 473 Cb 0.34 0.76 0.92 0.00 -1.14 0.00 0.00 41.12 42.00 3dxb n ASP 473 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3dxb h ASP 474 N 0.94 0.00 1.00 -1.12 3.32 -2.03 -2.93 116.42 115.60 3dxb h ASP 474 Ca -0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.93 3dxb h ASP 474 Cb 0.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.12 3dxb h ASP 474 CO 0.17 0.00 -0.85 0.44 -1.72 0.00 0.00 179.24 177.28 3dxb h ASP 475 N 0.00 0.00 -0.20 6.45 3.32 -1.98 -3.41 116.42 120.60 3dxb h ASP 475 Ca 0.00 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 3dxb h ASP 475 Cb 0.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3dxb h ASP 475 CO 0.00 0.04 0.08 0.25 -1.72 0.00 0.00 179.24 177.89 3dxb h LEU 476 N 0.00 0.27 -0.15 1.55 5.85 -1.90 -0.84 115.31 120.09 3dxb h LEU 476 Ca 0.00 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.60 3dxb h LEU 476 Cb 0.92 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 3dxb h LEU 476 CO 0.00 0.36 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.31 3dxb h GLU 477 N 0.17 -0.05 -0.91 1.25 4.81 -1.80 -1.15 114.58 116.90 3dxb h GLU 477 Ca 0.07 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3dxb h GLU 477 Cb 0.17 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 3dxb h GLU 477 CO -0.01 -0.04 0.57 0.78 -0.73 0.00 0.00 179.01 179.58 3dxb h GLY 478 N -0.06 1.30 1.04 1.92 0.00 -1.78 -1.67 103.07 103.84 3dxb h GLY 478 Ca 0.08 -0.52 -0.08 0.00 0.00 0.00 0.00 47.33 46.81 3dxb h GLY 478 CO -0.18 0.51 0.04 0.83 0.00 0.00 0.00 176.54 177.73 3dxb h GLU 479 N 1.24 0.99 -0.06 4.80 5.08 -0.86 -2.00 114.58 123.78 3dxb h GLU 479 Ca 0.33 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3dxb h GLU 479 Cb -0.08 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.06 3dxb h GLU 479 CO -0.06 0.97 0.01 0.28 -1.00 0.00 0.00 179.01 179.20 3dxb h VAL 480 N 0.88 1.23 -0.66 3.13 2.07 -0.90 -1.31 116.25 120.70 3dxb h VAL 480 Ca 0.17 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3dxb h VAL 480 Cb 0.50 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 3dxb h VAL 480 CO 0.02 0.19 0.39 0.00 0.02 0.00 0.00 177.57 178.19 3dxb h THR 481 N -0.17 1.19 -0.24 2.57 1.03 -1.32 0.98 112.91 116.95 3dxb h THR 481 Ca 0.02 -0.43 -0.05 0.00 -0.01 0.00 0.00 66.41 65.94 3dxb h THR 481 Cb 0.30 0.27 -0.01 0.00 -1.07 0.00 0.00 68.15 67.64 3dxb h THR 481 CO 0.00 0.20 -0.04 -0.08 -0.01 0.00 0.00 175.52 175.59 3dxb h GLU 482 N 0.91 0.45 -0.08 0.00 4.22 -1.28 -1.71 114.58 117.09 3dxb h GLU 482 Ca 0.24 -0.16 -0.17 0.00 0.08 0.00 0.00 59.36 59.35 3dxb h GLU 482 Cb -0.02 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3dxb h GLU 482 CO -0.04 0.66 -0.68 0.93 -2.18 0.00 0.00 179.01 177.70 3dxb h GLU 483 N 0.20 0.33 0.00 1.92 4.39 -0.94 -3.05 114.58 117.43 3dxb h GLU 483 Ca 0.06 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.51 3dxb h GLU 483 Cb 0.48 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 3dxb h GLU 483 CO 0.02 0.89 -0.06 0.00 -1.16 0.00 0.00 179.01 178.70 3dxb n GLY 485 N 1.35 -0.88 0.18 0.00 0.00 -0.65 -1.98 105.19 103.22 3dxb n GLY 485 Ca 0.06 -0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.18 3dxb n GLY 485 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3dxb n LYS 486 N -1.48 0.94 -0.00 1.61 2.85 -1.23 -3.44 118.16 117.41 3dxb n LYS 486 Ca 0.03 -0.36 0.08 0.00 -1.05 0.00 0.00 58.31 57.02 3dxb n LYS 486 Cb 0.13 -1.49 -0.12 0.00 -0.65 0.00 0.00 35.03 32.90 3dxb n LYS 486 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3dxb n PHE 487 N -0.72 0.00 -3.18 5.58 3.72 -0.84 -5.09 117.46 116.94 3dxb n PHE 487 Ca 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.57 3dxb n PHE 487 Cb 0.27 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 3dxb n PHE 487 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dxb n GLY 488 N 1.49 -1.23 3.67 1.37 0.00 -1.22 -4.66 105.19 104.60 3dxb n GLY 488 Ca -0.01 -1.32 -0.43 0.00 0.00 0.00 0.00 46.02 44.27 3dxb n GLY 488 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dxb s ALA 489 N -1.08 3.60 -0.27 4.61 0.00 -1.26 -4.24 121.76 123.12 3dxb s ALA 489 Ca 0.00 0.54 -0.17 0.00 0.00 0.00 0.00 51.96 52.33 3dxb s ALA 489 Cb 0.00 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 3dxb s ALA 489 CO 0.00 -1.02 0.46 0.08 0.00 0.00 0.00 175.76 175.27 3dxb s VAL 490 N 3.02 5.11 -0.09 0.00 1.01 -1.26 -1.30 120.40 126.88 3dxb s VAL 490 Ca 0.56 0.73 -0.13 0.00 0.00 0.00 0.00 61.98 63.15 3dxb s VAL 490 Cb -0.23 -3.78 -0.10 0.00 0.00 0.00 0.00 36.38 32.26 3dxb s VAL 490 CO 0.18 0.10 0.42 0.78 0.00 0.00 0.00 175.10 176.58 3dxb h ASN 491 N 8.10 -0.09 -4.60 3.32 4.21 -0.84 -3.48 115.58 122.21 3dxb h ASN 491 Ca -0.30 -0.30 -0.12 0.00 1.21 0.00 0.00 56.30 56.78 3dxb h ASN 491 Cb 1.15 0.02 -0.22 0.00 -1.12 0.00 0.00 38.32 38.15 3dxb h ASN 491 CO 0.69 0.54 -0.29 -0.60 -1.29 0.00 0.00 177.43 176.48 3dxb s ARG 492 N -2.26 0.58 -0.10 0.81 3.52 -1.21 -5.03 118.95 115.27 3dxb s ARG 492 Ca -0.08 0.04 0.03 0.00 -0.13 0.00 0.00 55.73 55.60 3dxb s ARG 492 Cb -0.01 0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.65 3dxb s ARG 492 CO 0.28 -0.14 -0.21 0.08 -0.81 0.00 0.00 175.30 174.50 3dxb s VAL 493 N -0.81 1.83 -0.17 7.11 1.01 -1.26 -1.52 120.40 126.60 3dxb s VAL 493 Ca -0.09 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.02 3dxb s VAL 493 Cb -0.04 -1.60 0.01 0.00 0.00 0.00 0.00 36.38 34.75 3dxb s VAL 493 CO 0.03 0.51 -0.18 -0.63 0.00 0.00 0.00 175.10 174.83 3dxb s ILE 494 N 0.49 2.32 -0.48 2.22 1.01 0.10 -4.98 121.20 121.88 3dxb s ILE 494 Ca -0.16 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 59.42 3dxb s ILE 494 Cb -0.17 -1.97 0.04 0.00 0.01 0.00 0.00 42.46 40.37 3dxb s ILE 494 CO 0.06 0.53 0.63 -0.63 0.00 0.00 0.00 174.94 175.53 3dxb s ILE 495 N 1.06 4.85 -0.16 2.92 -1.09 -1.26 -0.71 121.20 126.81 3dxb s ILE 495 Ca -0.01 -0.26 -0.01 0.00 -2.23 0.00 0.00 60.65 58.14 3dxb s ILE 495 Cb -0.14 -4.26 -0.01 0.00 -1.58 0.00 0.00 42.46 36.46 3dxb s ILE 495 CO -0.06 -0.73 -0.11 -0.47 -1.23 0.00 0.00 174.94 172.34 3dxb s TYR 496 N 2.72 2.85 -0.18 3.97 5.04 -0.28 -5.00 117.35 126.47 3dxb s TYR 496 Ca 0.18 -0.77 -0.06 0.00 -2.44 0.00 0.00 57.07 53.97 3dxb s TYR 496 Cb -0.17 -1.92 -0.04 0.00 0.35 0.00 0.00 41.96 40.19 3dxb s TYR 496 CO 0.15 -0.33 0.03 -0.65 -1.34 0.00 0.00 175.55 173.41 3dxb s GLN 497 N 0.69 3.88 -0.12 4.97 -0.21 -1.26 -0.38 119.66 127.22 3dxb s GLN 497 Ca -0.06 -0.40 0.00 0.00 0.02 0.00 0.00 55.36 54.93 3dxb s GLN 497 Cb -0.15 -3.13 0.02 0.00 1.00 0.00 0.00 33.01 30.74 3dxb s GLN 497 CO 0.02 0.24 -0.11 -2.00 -2.12 0.00 0.00 175.29 171.32 3dxb s GLU 498 N 0.42 1.89 -0.11 2.91 2.12 0.26 -4.95 118.70 121.24 3dxb s GLU 498 Ca 0.01 -0.41 -0.30 0.00 0.36 0.00 0.00 54.97 54.63 3dxb s GLU 498 Cb -0.13 -1.77 -0.02 0.00 0.26 0.00 0.00 34.13 32.46 3dxb s GLU 498 CO 0.01 -0.20 1.23 0.21 -0.54 0.00 0.00 175.26 175.97 3dxb s LYS 499 N 1.42 4.30 -0.27 4.30 2.20 -1.26 -1.31 119.74 129.12 3dxb s LYS 499 Ca 0.01 1.66 0.01 0.00 -0.36 0.00 0.00 55.97 57.30 3dxb s LYS 499 Cb -0.13 -3.65 0.31 0.00 -1.51 0.00 0.00 37.83 32.85 3dxb s LYS 499 CO -0.07 -0.56 1.64 1.04 -0.36 0.00 0.00 175.35 177.04 3dxb n GLN 500 N 5.83 1.72 0.00 4.03 1.13 0.62 -4.89 117.38 125.82 3dxb n GLN 500 Ca 0.12 -1.61 0.00 0.00 -1.94 0.00 0.00 57.00 53.58 3dxb n GLN 500 Cb 0.46 -1.63 0.00 0.00 0.11 0.00 0.00 30.24 29.18 3dxb n GLN 500 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dxb n GLY 501 N -0.18 1.13 0.06 1.08 0.00 -1.26 -4.78 105.19 101.24 3dxb n GLY 501 Ca 0.32 -0.98 0.08 0.00 0.00 0.00 0.00 46.02 45.44 3dxb n GLY 501 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dxb n GLU 502 N -0.52 0.64 -1.72 1.61 1.02 -1.26 -4.83 120.64 115.59 3dxb n GLU 502 Ca 0.00 -0.04 -0.40 0.00 -0.02 0.00 0.00 57.16 56.70 3dxb n GLU 502 Cb 0.00 -1.65 0.02 0.00 -0.02 0.00 0.00 31.44 29.79 3dxb n GLU 502 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3dxb n GLU 503 N -2.50 1.98 -0.27 3.49 0.00 -1.26 -4.90 120.64 117.18 3dxb n GLU 503 Ca -0.06 0.71 0.08 0.00 0.00 0.00 0.00 57.16 57.89 3dxb n GLU 503 Cb 0.65 -2.46 0.23 0.00 0.00 0.00 0.00 31.44 29.86 3dxb n GLU 503 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 3dxb h GLU 504 N 2.06 0.32 -0.84 3.44 5.08 -2.05 -1.63 114.58 120.96 3dxb h GLU 504 Ca -0.49 -0.02 -0.58 0.00 -1.00 0.00 0.00 59.36 57.28 3dxb h GLU 504 Cb 1.29 -0.07 -0.33 0.00 0.50 0.00 0.00 28.75 30.14 3dxb h GLU 504 CO 0.60 0.21 0.12 -0.25 -1.00 0.00 0.00 179.01 178.69 3dxb n ASP 505 N -5.11 5.96 -4.76 1.42 8.00 -1.26 -5.01 116.55 115.79 3dxb n ASP 505 Ca 0.17 -3.77 -0.39 0.00 0.71 0.00 0.00 54.79 51.51 3dxb n ASP 505 Cb 0.53 -0.69 0.02 0.00 -0.02 0.00 0.00 41.12 40.95 3dxb n ASP 505 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dxb s ALA 506 N -3.66 3.15 0.29 2.24 0.00 -0.62 -4.94 121.76 118.23 3dxb s ALA 506 Ca 0.57 1.41 -0.30 0.00 0.00 0.00 0.00 51.96 53.64 3dxb s ALA 506 Cb 0.46 -3.57 -0.11 0.00 0.00 0.00 0.00 23.12 19.90 3dxb s ALA 506 CO 0.01 -1.18 1.52 -2.00 0.00 0.00 0.00 175.76 174.12 3dxb s GLU 507 N -2.52 4.18 -0.21 0.00 2.12 -1.26 -4.68 118.70 116.33 3dxb s GLU 507 Ca 0.63 2.48 -0.09 0.00 0.36 0.00 0.00 54.97 58.34 3dxb s GLU 507 Cb -0.42 -3.05 -0.05 0.00 0.26 0.00 0.00 34.13 30.88 3dxb s GLU 507 CO 0.53 -0.53 0.11 0.42 -0.54 0.00 0.00 175.26 175.25 3dxb s ILE 508 N -0.20 5.11 0.37 -3.70 1.01 -1.26 -0.27 121.20 122.26 3dxb s ILE 508 Ca 0.60 0.09 0.08 0.00 0.00 0.00 0.00 60.65 61.42 3dxb s ILE 508 Cb -0.45 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 3dxb s ILE 508 CO 0.49 0.42 0.17 0.27 0.00 0.00 0.00 174.94 176.29 3dxb s ILE 509 N 0.60 2.79 -0.14 2.92 -5.25 -0.43 -4.64 121.20 117.05 3dxb s ILE 509 Ca 0.06 -1.67 -0.01 0.00 -0.99 0.00 0.00 60.65 58.04 3dxb s ILE 509 Cb -0.12 -2.98 -0.01 0.00 2.95 0.00 0.00 42.46 42.29 3dxb s ILE 509 CO 0.01 -0.12 -0.12 -0.69 -1.79 0.00 0.00 174.94 172.23 3dxb s VAL 510 N -2.48 3.11 -0.16 8.37 1.01 -1.26 -0.58 120.40 128.42 3dxb s VAL 510 Ca 0.39 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.72 3dxb s VAL 510 Cb -0.01 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.03 3dxb s VAL 510 CO 0.23 0.51 -0.07 -0.54 0.00 0.00 0.00 175.10 175.23 3dxb s LYS 511 N 0.51 3.51 -0.32 2.72 1.02 0.48 -4.26 119.74 123.40 3dxb s LYS 511 Ca -0.08 -0.60 -0.10 0.00 0.02 0.00 0.00 55.97 55.21 3dxb s LYS 511 Cb -0.16 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.32 3dxb s LYS 511 CO 0.04 0.14 0.16 0.42 -0.92 0.00 0.00 175.35 175.19 3dxb s ILE 512 N 0.59 4.59 -0.15 2.17 1.01 -0.11 -1.13 121.20 128.16 3dxb s ILE 512 Ca -0.05 -0.51 -0.15 0.00 0.00 0.00 0.00 60.65 59.94 3dxb s ILE 512 Cb -0.15 -3.38 -0.05 0.00 0.01 0.00 0.00 42.46 38.89 3dxb s ILE 512 CO 0.03 0.01 0.33 -0.36 0.00 0.00 0.00 174.94 174.95 3dxb s PHE 513 N 1.60 3.47 -0.22 3.97 0.08 0.11 0.52 117.98 127.50 3dxb s PHE 513 Ca 0.04 0.66 0.01 0.00 0.12 0.00 0.00 56.93 57.75 3dxb s PHE 513 Cb -0.17 -2.39 0.05 0.00 -0.57 0.00 0.00 43.02 39.94 3dxb s PHE 513 CO 0.06 0.22 -0.07 0.08 -0.10 0.00 0.00 175.22 175.41 3dxb s VAL 514 N 0.50 1.57 -0.25 -0.44 1.01 0.56 -0.72 120.40 122.63 3dxb s VAL 514 Ca 0.18 -1.15 -0.18 0.00 0.00 0.00 0.00 61.98 60.84 3dxb s VAL 514 Cb -0.13 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 3dxb s VAL 514 CO 0.05 -0.01 0.50 -0.70 0.00 0.00 0.00 175.10 174.94 3dxb s GLU 515 N 1.39 4.08 0.57 2.72 2.12 -0.57 -0.30 118.70 128.71 3dxb s GLU 515 Ca -0.04 0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.60 3dxb s GLU 515 Cb -0.18 -3.64 0.04 0.00 0.26 0.00 0.00 34.13 30.61 3dxb s GLU 515 CO -0.07 -0.31 0.80 -0.06 -0.54 0.00 0.00 175.26 175.08 3dxb s PHE 516 N 2.18 2.87 0.26 5.30 0.40 0.45 -0.18 117.98 129.26 3dxb s PHE 516 Ca 0.21 0.05 0.09 0.00 -0.60 0.00 0.00 56.93 56.68 3dxb s PHE 516 Cb -0.16 -2.80 0.32 0.00 0.51 0.00 0.00 43.02 40.89 3dxb s PHE 516 CO 0.09 -0.93 1.59 0.66 0.70 0.00 0.00 175.22 177.33 3dxb h SER 517 N -0.00 0.06 -5.00 1.36 4.64 -1.50 -3.43 113.55 109.68 3dxb h SER 517 Ca -0.42 -0.03 -0.11 0.00 -0.47 0.00 0.00 61.79 60.75 3dxb h SER 517 Cb 1.30 -0.02 -0.20 0.00 -0.31 0.00 0.00 62.40 63.18 3dxb h SER 517 CO 0.53 0.67 -0.23 -0.51 -0.87 0.00 0.00 176.83 176.43 3dxb s ILE 518 N -3.61 0.05 0.53 0.95 2.07 -1.26 -5.05 121.20 114.88 3dxb s ILE 518 Ca -0.02 -0.45 0.18 0.00 -1.41 0.00 0.00 60.65 58.95 3dxb s ILE 518 Cb 0.12 -0.69 0.28 0.00 0.13 0.00 0.00 42.46 42.31 3dxb s ILE 518 CO 0.77 -0.25 2.16 0.00 -1.91 0.00 0.00 174.94 175.72 3dxb h ALA 519 N 3.70 1.93 -0.72 1.50 0.00 -1.86 -1.81 119.26 122.00 3dxb h ALA 519 Ca -0.30 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.64 3dxb h ALA 519 Cb 1.18 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 3dxb h ALA 519 CO 0.41 0.00 0.47 0.66 0.00 0.00 0.00 179.25 180.79 3dxb h SER 520 N 0.00 0.75 -0.21 0.00 4.64 -1.94 -1.20 113.55 115.58 3dxb h SER 520 Ca -0.00 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 3dxb h SER 520 Cb 0.00 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 61.92 3dxb h SER 520 CO 0.00 0.52 -0.31 -0.33 -0.87 0.00 0.00 176.83 175.84 3dxb h GLU 521 N 0.87 0.58 -0.81 4.77 5.08 -1.59 -2.90 114.58 120.58 3dxb h GLU 521 Ca 0.28 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3dxb h GLU 521 Cb 0.05 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 3dxb h GLU 521 CO -0.08 0.95 0.53 1.15 -1.00 0.00 0.00 179.01 180.55 3dxb h THR 522 N 0.26 1.21 -0.48 1.13 2.02 -1.46 -2.18 112.91 113.41 3dxb h THR 522 Ca 0.02 -0.41 -0.07 0.00 0.77 0.00 0.00 66.41 66.72 3dxb h THR 522 Cb 0.89 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3dxb h THR 522 CO 0.07 0.21 0.03 -0.74 0.37 0.00 0.00 175.52 175.46 3dxb h HIS 523 N 1.10 0.90 -0.04 3.16 -0.00 -1.20 -1.34 115.15 117.73 3dxb h HIS 523 Ca 0.30 -0.15 -0.00 0.00 -0.00 0.00 0.00 60.37 60.52 3dxb h HIS 523 Cb -0.11 -0.24 -0.00 0.00 -0.00 0.00 0.00 27.41 27.06 3dxb h HIS 523 CO 0.00 0.85 0.02 0.87 -0.00 0.00 0.00 177.93 179.67 3dxb h LYS 524 N 0.69 0.05 -0.16 5.26 1.57 -1.29 -2.01 116.57 120.69 3dxb h LYS 524 Ca 0.14 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.95 3dxb h LYS 524 Cb 0.47 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 3dxb h LYS 524 CO 0.02 0.09 -0.08 0.00 -0.57 0.00 0.00 179.45 178.91 3dxb h ALA 525 N 0.96 0.06 -0.14 3.86 0.00 -1.32 -1.05 119.26 121.62 3dxb h ALA 525 Ca 0.01 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3dxb h ALA 525 Cb 0.05 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3dxb h ALA 525 CO -0.00 -0.52 0.04 0.82 0.00 0.00 0.00 179.25 179.59 3dxb h ILE 526 N -0.06 0.96 -0.88 0.00 2.04 -1.21 0.05 117.51 118.39 3dxb h ILE 526 Ca 0.09 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.94 3dxb h ILE 526 Cb 0.19 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.07 3dxb h ILE 526 CO -0.20 0.02 0.58 1.56 0.00 0.00 0.00 178.15 180.12 3dxb h GLN 527 N 0.11 1.10 0.01 2.37 1.08 -1.19 -0.47 115.11 118.11 3dxb h GLN 527 Ca 0.06 -0.07 -0.19 0.00 -1.45 0.00 0.00 58.65 57.00 3dxb h GLN 527 Cb 0.04 -0.25 -0.02 0.00 -0.05 0.00 0.00 27.48 27.20 3dxb h GLN 527 CO -0.07 0.73 -0.91 0.00 -0.95 0.00 0.00 178.83 177.63 3dxb h ALA 528 N 1.47 0.50 0.00 3.87 0.00 -0.83 -3.38 119.26 120.90 3dxb h ALA 528 Ca 0.34 -0.81 -0.37 0.00 0.00 0.00 0.00 54.91 54.08 3dxb h ALA 528 Cb -0.03 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.57 3dxb h ALA 528 CO -0.09 1.09 -2.34 1.28 0.00 0.00 0.00 179.25 179.18 3dxb n LEU 529 N -3.50 0.35 -4.70 0.00 4.77 -0.03 -4.84 117.00 109.05 3dxb n LEU 529 Ca -0.01 0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.57 3dxb n LEU 529 Cb 0.85 0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 42.25 3dxb n LEU 529 CO 0.46 0.53 1.43 -3.20 -1.33 0.00 0.00 177.39 175.29 3dxb n ASN 530 N -2.82 4.03 0.00 -1.43 5.15 -0.20 -1.70 115.26 118.29 3dxb n ASN 530 Ca -0.33 1.02 0.00 0.00 -0.60 0.00 0.00 54.58 54.67 3dxb n ASN 530 Cb 1.14 -1.56 0.00 0.00 -0.53 0.00 0.00 39.78 38.83 3dxb n ASN 530 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dxb n GLY 531 N 4.11 1.03 3.90 8.20 0.00 -0.16 -4.91 105.19 117.36 3dxb n GLY 531 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 3dxb n GLY 531 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dxb s ARG 532 N -0.10 3.65 -0.25 1.61 3.00 -0.69 -4.72 118.95 121.44 3dxb s ARG 532 Ca 0.00 0.08 -0.13 0.00 0.00 0.00 0.00 55.73 55.68 3dxb s ARG 532 Cb 0.00 -2.60 -0.05 0.00 0.00 0.00 0.00 34.95 32.31 3dxb s ARG 532 CO 0.00 0.16 0.26 -1.58 0.00 0.00 0.00 175.30 174.13 3dxb s TRP 533 N -2.16 3.28 -0.26 -0.53 0.52 -1.26 -1.28 118.94 117.25 3dxb s TRP 533 Ca 0.45 0.29 -0.04 0.00 0.02 0.00 0.00 56.10 56.83 3dxb s TRP 533 Cb -0.11 -2.42 0.09 0.00 -1.15 0.00 0.00 33.47 29.88 3dxb s TRP 533 CO 0.31 -0.09 0.10 -0.06 0.02 0.00 0.00 176.95 177.23 3dxb s PHE 534 N 1.57 0.61 -0.19 -1.98 0.40 -0.39 -4.71 117.98 113.29 3dxb s PHE 534 Ca 0.11 -0.89 -0.03 0.00 -0.60 0.00 0.00 56.93 55.51 3dxb s PHE 534 Cb -0.15 -1.00 -0.02 0.00 0.51 0.00 0.00 43.02 42.36 3dxb s PHE 534 CO 0.08 -0.74 -0.05 0.00 0.70 0.00 0.00 175.22 175.21 3dxb s ALA 535 N 2.00 2.84 0.00 5.36 0.00 -1.26 -4.17 121.76 126.52 3dxb s ALA 535 Ca 0.06 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.00 3dxb s ALA 535 Cb -0.16 -1.59 0.00 0.00 0.00 0.00 0.00 23.12 21.37 3dxb s ALA 535 CO -0.25 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 175.78 3dxb n GLY 536 N 4.24 2.28 3.46 0.00 0.00 -1.26 -5.07 105.19 108.84 3dxb n GLY 536 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 3dxb n GLY 536 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dxb s ARG 537 N -0.14 3.08 -0.26 1.61 0.52 -1.26 -5.09 118.95 117.42 3dxb s ARG 537 Ca 0.00 -0.63 -0.27 0.00 -0.52 0.00 0.00 55.73 54.31 3dxb s ARG 537 Cb 0.00 -2.61 0.01 0.00 0.52 0.00 0.00 34.95 32.87 3dxb s ARG 537 CO 0.00 0.42 0.95 0.21 0.02 0.00 0.00 175.30 176.89 3dxb s LYS 538 N -0.16 4.17 -0.15 3.54 2.20 -1.26 -1.27 119.74 126.81 3dxb s LYS 538 Ca 0.01 1.08 -0.13 0.00 -0.36 0.00 0.00 55.97 56.57 3dxb s LYS 538 Cb -0.13 -3.67 -0.05 0.00 -1.51 0.00 0.00 37.83 32.47 3dxb s LYS 538 CO 0.03 -0.64 0.27 0.08 -0.36 0.00 0.00 175.35 174.73 3dxb s VAL 539 N 3.13 5.31 -0.34 4.02 1.01 -0.41 -4.77 120.40 128.35 3dxb s VAL 539 Ca 0.40 0.50 -0.21 0.00 0.00 0.00 0.00 61.98 62.67 3dxb s VAL 539 Cb -0.15 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.64 3dxb s VAL 539 CO 0.09 0.43 0.65 -0.69 0.00 0.00 0.00 175.10 175.58 3dxb s VAL 540 N 0.18 4.88 -0.15 2.92 1.01 -0.75 -0.98 120.40 127.51 3dxb s VAL 540 Ca 0.16 0.71 -0.05 0.00 0.00 0.00 0.00 61.98 62.80 3dxb s VAL 540 Cb -0.13 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 3dxb s VAL 540 CO 0.04 -0.28 0.01 0.00 0.00 0.00 0.00 175.10 174.87 3dxb s ALA 541 N 2.73 3.20 -0.01 5.51 0.00 -1.26 -0.77 121.76 131.16 3dxb s ALA 541 Ca 0.26 -0.79 -0.24 0.00 0.00 0.00 0.00 51.96 51.19 3dxb s ALA 541 Cb -0.14 -1.68 0.05 0.00 0.00 0.00 0.00 23.12 21.35 3dxb s ALA 541 CO 0.14 0.27 0.53 -2.00 0.00 0.00 0.00 175.76 174.70 3dxb s GLU 542 N 0.14 0.95 0.41 0.00 2.12 -0.99 -4.61 118.70 116.72 3dxb s GLU 542 Ca 0.01 -0.04 -0.25 0.00 0.36 0.00 0.00 54.97 55.06 3dxb s GLU 542 Cb -0.13 0.44 -0.08 0.00 0.26 0.00 0.00 34.13 34.61 3dxb s GLU 542 CO 0.02 -0.31 1.23 0.14 -0.54 0.00 0.00 175.26 175.80 3dxb s VAL 543 N -1.68 2.90 -0.05 3.70 -7.23 -1.26 -0.17 120.40 116.62 3dxb s VAL 543 Ca -0.10 0.77 0.04 0.00 -1.81 0.00 0.00 61.98 60.89 3dxb s VAL 543 Cb -0.02 -3.44 -0.00 0.00 0.56 0.00 0.00 36.38 33.48 3dxb s VAL 543 CO 0.04 0.08 -0.18 -0.47 -0.31 0.00 0.00 175.10 174.26 3dxb s TYR 544 N -1.35 1.84 -0.16 2.82 5.04 -0.41 -4.71 117.35 120.42 3dxb s TYR 544 Ca 0.58 -0.55 -0.39 0.00 -2.44 0.00 0.00 57.07 54.26 3dxb s TYR 544 Cb -0.34 -1.24 -0.16 0.00 0.35 0.00 0.00 41.96 40.57 3dxb s TYR 544 CO 0.43 -0.19 1.59 -3.47 -1.34 0.00 0.00 175.55 172.57 3dxb n ASP 545 N 3.17 2.04 -0.08 4.32 2.03 -1.26 -4.43 116.55 122.33 3dxb n ASP 545 Ca -0.18 1.10 -0.14 0.00 0.52 0.00 0.00 54.79 56.08 3dxb n ASP 545 Cb 0.53 -1.14 -0.03 0.00 -0.72 0.00 0.00 41.12 39.76 3dxb n ASP 545 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 3dxb h GLN 546 N 6.15 0.87 -0.53 -0.67 4.15 -1.93 -2.16 115.11 120.99 3dxb h GLN 546 Ca -0.47 -0.53 -0.04 0.00 0.77 0.00 0.00 58.65 58.38 3dxb h GLN 546 Cb 1.33 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 29.05 3dxb h GLN 546 CO 0.89 1.17 0.19 1.49 -1.93 0.00 0.00 178.83 180.64 3dxb h GLU 547 N 0.68 0.81 -0.23 1.69 4.81 -1.98 0.81 114.58 121.17 3dxb h GLU 547 Ca 0.03 -0.16 0.04 0.00 -0.13 0.00 0.00 59.36 59.13 3dxb h GLU 547 Cb 1.11 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 3dxb h GLU 547 CO 0.11 0.73 -0.00 0.00 -0.73 0.00 0.00 179.01 179.12 3dxb h ARG 548 N 0.73 0.07 -0.41 1.92 3.08 -1.84 -2.09 114.38 115.83 3dxb h ARG 548 Ca 0.18 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 3dxb h ARG 548 Cb 0.24 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3dxb h ARG 548 CO -0.01 0.05 0.23 0.35 -1.07 0.00 0.00 179.97 179.51 3dxb h PHE 549 N 0.07 0.57 0.00 3.04 3.57 -1.17 0.11 116.94 123.13 3dxb h PHE 549 Ca 0.11 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 3dxb h PHE 549 Cb 0.14 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.70 3dxb h PHE 549 CO -0.19 0.44 -0.02 -0.44 -2.23 0.00 0.00 178.31 175.87 3dxb h ASP 550 N 0.54 0.00 -0.33 0.41 3.32 -0.69 -2.21 116.42 117.45 3dxb h ASP 550 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3dxb h ASP 550 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3dxb h ASP 550 CO -0.02 0.02 0.00 0.59 -1.72 0.00 0.00 179.24 178.11 3dxb n ASN 551 N -3.30 4.02 -2.09 6.45 3.02 -0.80 -4.97 115.26 117.59 3dxb n ASN 551 Ca -0.02 -2.82 -0.18 0.00 -0.03 0.00 0.00 54.58 51.53 3dxb n ASN 551 Cb 0.14 -0.52 -0.00 0.00 -0.61 0.00 0.00 39.78 38.79 3dxb n ASN 551 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3dxb n SER 552 N -0.12 -5.22 -4.31 6.41 7.64 -0.83 -4.97 113.62 112.22 3dxb n SER 552 Ca 0.21 -0.05 -0.41 0.00 1.01 0.00 0.00 58.87 59.63 3dxb n SER 552 Cb 0.86 -4.26 -0.09 0.00 -1.01 0.00 0.00 64.21 59.70 3dxb n SER 552 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3dxb s ASP 553 N -2.27 5.79 -0.18 6.43 2.15 0.34 -4.93 116.67 124.01 3dxb s ASP 553 Ca 0.03 -1.45 0.17 0.00 0.43 0.00 0.00 52.55 51.73 3dxb s ASP 553 Cb -0.01 -2.05 0.53 0.00 -0.30 0.00 0.00 42.92 41.09 3dxb s ASP 553 CO 0.04 -0.57 1.42 0.18 -0.17 0.00 0.00 175.17 176.07 3dxb n LEU 554 N 5.00 3.89 0.12 -1.34 4.77 -1.26 -3.81 117.00 124.37 3dxb n LEU 554 Ca -0.11 -3.00 0.12 0.00 -0.03 0.00 0.00 56.01 52.99 3dxb n LEU 554 Cb 0.43 -0.54 0.13 0.00 -2.33 0.00 0.00 43.42 41.11 3dxb n LEU 554 CO 0.41 0.67 0.38 0.77 -1.33 0.00 0.00 177.39 178.30 3dxb h SER 555 N 1.83 0.00 0.00 -1.43 4.64 -1.96 -3.51 113.55 113.12 3dxb h SER 555 Ca 0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3dxb h SER 555 Cb 1.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 3dxb h SER 555 CO 0.22 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 176.21