#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dxr n THR 343 N 0.00 0.00 -4.06 -0.72 -1.04 -1.26 -4.90 114.28 102.30 2dxr n THR 343 Ca 0.00 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.69 2dxr n THR 343 Cb 0.00 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.35 2dxr n THR 343 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2dxr s ARG 344 N 0.00 2.57 -0.13 -2.82 3.52 -1.26 -4.94 118.95 115.88 2dxr s ARG 344 Ca 0.00 -0.77 -0.13 0.00 -0.13 0.00 0.00 55.73 54.71 2dxr s ARG 344 Cb 0.00 -2.40 -0.05 0.00 -1.56 0.00 0.00 34.95 30.94 2dxr s ARG 344 CO 0.00 -0.27 0.28 0.08 -0.81 0.00 0.00 175.30 174.57 2dxr s VAL 345 N 1.36 5.30 -0.27 7.11 1.01 -0.87 -4.99 120.40 129.05 2dxr s VAL 345 Ca 0.03 0.52 -0.10 0.00 0.00 0.00 0.00 61.98 62.43 2dxr s VAL 345 Cb -0.14 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 2dxr s VAL 345 CO -0.11 0.45 0.15 -0.69 0.00 0.00 0.00 175.10 174.90 2dxr s VAL 346 N 0.02 4.99 -0.07 2.92 1.01 -1.26 -0.61 120.40 127.41 2dxr s VAL 346 Ca 0.17 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 62.17 2dxr s VAL 346 Cb -0.13 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2dxr s VAL 346 CO 0.05 0.28 0.13 0.86 0.00 0.00 0.00 175.10 176.41 2dxr s TRP 347 N 1.70 3.48 -0.22 5.22 -0.11 0.35 0.10 118.94 129.47 2dxr s TRP 347 Ca 0.07 0.39 -0.06 0.00 1.22 0.00 0.00 56.10 57.71 2dxr s TRP 347 Cb -0.16 -1.86 -0.03 0.00 -1.50 0.00 0.00 33.47 29.93 2dxr s TRP 347 CO 0.09 0.65 0.04 0.00 -4.62 0.00 0.00 176.95 173.10 2dxr s ALA 349 N 1.16 3.31 -0.55 0.00 0.00 0.13 -4.77 121.76 121.03 2dxr s ALA 349 Ca 0.04 -0.80 -0.18 0.00 0.00 0.00 0.00 51.96 51.02 2dxr s ALA 349 Cb -0.14 -1.52 0.09 0.00 0.00 0.00 0.00 23.12 21.54 2dxr s ALA 349 CO 0.02 0.56 0.63 0.08 0.00 0.00 0.00 175.76 177.05 2dxr s VAL 350 N -0.81 4.92 0.00 0.00 1.01 -1.26 -1.77 120.40 122.50 2dxr s VAL 350 Ca 0.12 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2dxr s VAL 350 Cb -0.11 -4.37 0.00 0.00 0.00 0.00 0.00 36.38 31.89 2dxr s VAL 350 CO 0.02 -0.94 0.00 0.61 0.00 0.00 0.00 175.10 174.79 2dxr n GLY 351 N 5.24 -0.52 0.36 4.51 0.00 -0.33 -4.36 105.19 110.09 2dxr n GLY 351 Ca -0.09 -1.71 0.09 0.00 0.00 0.00 0.00 46.02 44.31 2dxr n GLY 351 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dxr h PRO 352 N 0.00 0.65 0.08 1.61 0.13 -1.92 -2.10 132.00 130.44 2dxr h PRO 352 Ca 0.00 -0.04 -0.29 0.00 -0.87 0.00 0.00 66.00 64.80 2dxr h PRO 352 Cb 0.00 -0.15 0.03 0.00 0.13 0.00 0.00 31.00 31.01 2dxr h PRO 352 CO 0.00 0.43 -1.18 0.93 -0.23 0.00 0.00 178.00 177.95 2dxr h GLU 353 N 0.67 0.65 -0.19 0.86 5.08 -1.97 -2.65 114.58 117.03 2dxr h GLU 353 Ca 0.33 -0.80 -0.13 0.00 -1.00 0.00 0.00 59.36 57.75 2dxr h GLU 353 Cb 0.40 0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2dxr h GLU 353 CO -0.11 1.36 -0.44 0.93 -1.00 0.00 0.00 179.01 179.74 2dxr h GLU 354 N 0.31 0.46 -0.92 2.33 5.08 -1.75 -2.88 114.58 117.22 2dxr h GLU 354 Ca -0.17 -0.25 0.06 0.00 -1.00 0.00 0.00 59.36 58.01 2dxr h GLU 354 Cb 1.84 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 31.04 2dxr h GLU 354 CO 0.23 0.82 0.58 0.37 -1.00 0.00 0.00 179.01 180.01 2dxr h GLN 355 N 0.38 1.03 -0.22 2.33 4.15 -1.35 -2.06 115.11 119.35 2dxr h GLN 355 Ca 0.03 -0.06 -0.18 0.00 0.77 0.00 0.00 58.65 59.21 2dxr h GLN 355 Cb 0.93 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 28.39 2dxr h GLN 355 CO 0.08 0.68 -0.56 1.57 -1.93 0.00 0.00 178.83 178.67 2dxr h LYS 356 N 1.06 0.70 0.00 1.69 5.09 -1.27 -0.63 116.57 123.21 2dxr h LYS 356 Ca 0.40 -0.45 -0.05 0.00 0.09 0.00 0.00 60.65 60.64 2dxr h LYS 356 Cb 0.18 0.06 -0.01 0.00 0.10 0.00 0.00 32.23 32.56 2dxr h LYS 356 CO -0.18 1.07 -0.23 -0.22 -2.09 0.00 0.00 179.45 177.80 2dxr h LYS 357 N 0.53 0.00 0.03 0.07 3.64 -1.44 -2.46 116.57 116.95 2dxr h LYS 357 Ca 0.01 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.19 2dxr h LYS 357 Cb 1.14 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.98 2dxr h LYS 357 CO 0.11 0.23 -0.80 0.00 -2.27 0.00 0.00 179.45 176.73 2dxr h GLN 359 N 0.01 0.44 -0.24 0.00 4.20 -0.95 0.29 115.11 118.85 2dxr h GLN 359 Ca -0.11 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 2dxr h GLN 359 Cb 1.51 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 29.18 2dxr h GLN 359 CO 0.16 0.29 0.13 1.96 -0.67 0.00 0.00 178.83 180.70 2dxr h GLN 360 N 0.45 0.34 -0.96 1.46 4.20 -1.33 0.15 115.11 119.42 2dxr h GLN 360 Ca 0.34 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 59.04 2dxr h GLN 360 Cb 0.43 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 2dxr h GLN 360 CO -0.32 0.31 0.63 2.35 -0.67 0.00 0.00 178.83 181.12 2dxr h TRP 361 N 0.28 1.18 -0.09 2.96 7.01 -0.67 -2.22 115.95 124.39 2dxr h TRP 361 Ca 0.08 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 2dxr h TRP 361 Cb 0.07 -0.39 -0.00 0.00 -2.10 0.00 0.00 29.16 26.74 2dxr h TRP 361 CO -0.03 0.69 0.04 1.03 -2.79 0.00 0.00 178.44 177.38 2dxr h SER 362 N 1.23 0.12 -0.19 2.65 0.87 0.14 -2.58 113.55 115.79 2dxr h SER 362 Ca 0.38 -0.12 0.04 0.00 -1.23 0.00 0.00 61.79 60.85 2dxr h SER 362 Cb -0.03 -0.03 -0.07 0.00 -0.44 0.00 0.00 62.40 61.83 2dxr h SER 362 CO -0.11 0.21 -0.50 -0.61 -0.53 0.00 0.00 176.83 175.29 2dxr h GLN 363 N 0.02 -0.50 0.00 2.24 4.15 -0.73 -2.64 115.11 117.66 2dxr h GLN 363 Ca 0.03 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.49 2dxr h GLN 363 Cb 0.12 0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.93 2dxr h GLN 363 CO -0.00 -0.33 0.00 1.04 -1.93 0.00 0.00 178.83 177.61 2dxr n GLN 364 N -5.43 0.05 0.00 1.69 1.13 -0.86 -2.16 117.38 111.79 2dxr n GLN 364 Ca -0.05 0.35 0.12 0.00 -1.94 0.00 0.00 57.00 55.48 2dxr n GLN 364 Cb 0.37 -1.60 0.05 0.00 0.11 0.00 0.00 30.24 29.17 2dxr n GLN 364 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2dxr n SER 365 N -1.68 2.55 -3.47 1.08 3.41 -0.97 -4.98 113.62 109.55 2dxr n SER 365 Ca 0.02 -1.77 -0.19 0.00 -0.26 0.00 0.00 58.87 56.68 2dxr n SER 365 Cb 0.14 0.22 0.07 0.00 -0.26 0.00 0.00 64.21 64.38 2dxr n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dxr n GLY 366 N 1.38 -0.59 2.69 5.00 0.00 -0.92 -2.66 105.19 110.09 2dxr n GLY 366 Ca 0.12 0.25 -0.13 0.00 0.00 0.00 0.00 46.02 46.26 2dxr n GLY 366 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dxr n GLN 367 N -3.94 -1.52 0.24 1.61 3.00 -1.05 -4.84 117.38 110.87 2dxr n GLN 367 Ca -0.22 0.95 0.12 0.00 -0.01 0.00 0.00 57.00 57.84 2dxr n GLN 367 Cb 0.65 -5.30 0.53 0.00 0.00 0.00 0.00 30.24 26.12 2dxr n GLN 367 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.06 176.15 2dxr h ASN 368 N 0.00 0.00 -3.64 1.08 2.35 -1.74 -3.42 115.58 110.20 2dxr h ASN 368 Ca -0.27 0.00 -0.44 0.00 -0.55 0.00 0.00 56.30 55.04 2dxr h ASN 368 Cb 1.16 0.00 -0.32 0.00 0.05 0.00 0.00 38.32 39.21 2dxr h ASN 368 CO 0.39 0.16 -0.79 -0.69 -1.65 0.00 0.00 177.43 174.85 2dxr s VAL 369 N -3.68 0.79 0.23 2.81 1.01 -1.26 -2.06 120.40 118.25 2dxr s VAL 369 Ca 0.01 -0.32 0.10 0.00 0.00 0.00 0.00 61.98 61.76 2dxr s VAL 369 Cb 0.10 -0.73 -0.05 0.00 0.00 0.00 0.00 36.38 35.70 2dxr s VAL 369 CO 0.61 0.26 -0.17 -0.89 0.00 0.00 0.00 175.10 174.91 2dxr s THR 370 N 0.48 2.06 -0.08 3.92 2.01 0.22 -4.33 115.64 119.91 2dxr s THR 370 Ca -0.08 -2.27 0.03 0.00 0.31 0.00 0.00 61.69 59.68 2dxr s THR 370 Cb -0.12 -2.14 -0.01 0.00 0.01 0.00 0.00 72.50 70.24 2dxr s THR 370 CO 0.01 -0.49 -0.19 0.00 -0.69 0.00 0.00 174.62 173.26 2dxr s ALA 372 N -0.05 2.69 0.04 0.00 0.00 0.33 -4.91 121.76 119.86 2dxr s ALA 372 Ca -0.05 -1.36 0.07 0.00 0.00 0.00 0.00 51.96 50.62 2dxr s ALA 372 Cb -0.14 -0.65 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 2dxr s ALA 372 CO 0.04 0.59 -0.20 0.99 0.00 0.00 0.00 175.76 177.18 2dxr s THR 373 N -1.17 1.64 0.09 0.00 2.01 -1.26 -0.70 115.64 116.26 2dxr s THR 373 Ca 0.18 -1.18 -0.05 0.00 0.31 0.00 0.00 61.69 60.96 2dxr s THR 373 Cb -0.10 -1.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.96 2dxr s THR 373 CO 0.10 0.21 0.11 0.00 -0.69 0.00 0.00 174.62 174.35 2dxr s ALA 374 N -0.79 0.20 -1.73 7.40 0.00 -0.73 -4.95 121.76 121.18 2dxr s ALA 374 Ca 0.07 -0.97 0.29 0.00 0.00 0.00 0.00 51.96 51.35 2dxr s ALA 374 Cb -0.09 0.50 1.32 0.00 0.00 0.00 0.00 23.12 24.85 2dxr s ALA 374 CO 0.02 -0.47 1.91 0.43 0.00 0.00 0.00 175.76 177.64 2dxr n SER 375 N -0.02 0.45 -3.63 0.00 7.64 -1.26 -1.18 113.62 115.62 2dxr n SER 375 Ca -0.13 -0.65 -0.10 0.00 1.01 0.00 0.00 58.87 59.00 2dxr n SER 375 Cb 0.62 -0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.71 2dxr n SER 375 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2dxr s THR 376 N -2.39 0.04 0.17 0.44 -4.23 -1.26 -4.62 115.64 103.79 2dxr s THR 376 Ca 0.32 -0.53 -0.14 0.00 -1.18 0.00 0.00 61.69 60.15 2dxr s THR 376 Cb 0.20 -1.26 0.06 0.00 1.34 0.00 0.00 72.50 72.84 2dxr s THR 376 CO 0.45 -0.20 1.84 0.74 -0.54 0.00 0.00 174.62 176.91 2dxr h THR 377 N 2.25 1.13 -0.50 3.99 2.02 -1.90 -2.10 112.91 117.79 2dxr h THR 377 Ca -0.32 -0.24 0.07 0.00 0.77 0.00 0.00 66.41 66.68 2dxr h THR 377 Cb 1.27 0.36 -0.06 0.00 -1.74 0.00 0.00 68.15 67.98 2dxr h THR 377 CO 0.42 0.13 0.18 0.44 0.37 0.00 0.00 175.52 177.07 2dxr h ASP 378 N 0.70 0.19 -0.73 4.18 3.32 -1.97 -1.50 116.42 120.62 2dxr h ASP 378 Ca 0.19 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 2dxr h ASP 378 Cb -0.07 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 2dxr h ASP 378 CO -0.05 0.14 0.36 0.44 -1.72 0.00 0.00 179.24 178.41 2dxr h ASP 379 N 0.36 0.96 -0.75 6.45 3.32 -1.89 -1.07 116.42 123.79 2dxr h ASP 379 Ca 0.24 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.19 2dxr h ASP 379 Cb 0.25 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 2dxr h ASP 379 CO -0.24 0.81 0.50 0.00 -1.72 0.00 0.00 179.24 178.59 2dxr h ILE 381 N 1.02 1.29 -0.37 0.00 2.04 -0.28 -2.06 117.51 119.15 2dxr h ILE 381 Ca 0.28 -1.31 0.07 0.00 1.00 0.00 0.00 64.86 64.90 2dxr h ILE 381 Cb -0.12 1.40 -0.07 0.00 -0.74 0.00 0.00 36.82 37.29 2dxr h ILE 381 CO -0.06 0.43 -0.10 0.58 0.00 0.00 0.00 178.15 179.00 2dxr h VAL 382 N 0.51 0.62 -0.99 1.67 2.07 -1.07 -1.28 116.25 117.78 2dxr h VAL 382 Ca 0.07 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.70 2dxr h VAL 382 Cb 0.73 0.62 -0.08 0.00 -1.52 0.00 0.00 31.29 31.04 2dxr h VAL 382 CO 0.05 0.00 0.63 -0.07 0.02 0.00 0.00 177.57 178.21 2dxr h LEU 383 N -0.01 0.94 -0.38 2.57 3.38 -0.83 -0.87 115.31 120.11 2dxr h LEU 383 Ca 0.18 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2dxr h LEU 383 Cb 0.28 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2dxr h LEU 383 CO -0.39 0.54 -0.16 0.58 0.09 0.00 0.00 178.44 179.10 2dxr h VAL 384 N 1.03 1.28 -0.20 1.22 2.07 -0.76 -1.45 116.25 119.44 2dxr h VAL 384 Ca 0.47 -1.28 0.04 0.00 0.82 0.00 0.00 66.70 66.74 2dxr h VAL 384 Cb 0.39 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 2dxr h VAL 384 CO -0.23 0.43 -0.03 -0.07 0.02 0.00 0.00 177.57 177.69 2dxr h LEU 385 N 0.58 -0.15 -1.71 2.57 3.38 -0.69 -2.75 115.31 116.55 2dxr h LEU 385 Ca 0.09 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.16 2dxr h LEU 385 Cb 0.71 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2dxr h LEU 385 CO 0.05 -0.05 0.29 0.11 0.09 0.00 0.00 178.44 178.94 2dxr h LYS 386 N 0.02 0.36 0.00 1.13 1.57 -0.97 -3.45 116.57 115.23 2dxr h LYS 386 Ca 0.09 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2dxr h LYS 386 Cb 0.14 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2dxr h LYS 386 CO -0.19 0.24 0.00 0.41 -0.57 0.00 0.00 179.45 179.34 2dxr n GLY 387 N -1.52 0.87 0.05 3.86 0.00 -0.72 -4.98 105.19 102.76 2dxr n GLY 387 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 2dxr n GLY 387 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dxr n GLU 388 N -1.34 0.27 -3.83 1.61 1.02 -0.63 -4.83 120.64 112.92 2dxr n GLU 388 Ca 0.00 -0.11 -0.11 0.00 -0.02 0.00 0.00 57.16 56.92 2dxr n GLU 388 Cb 0.00 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.84 2dxr n GLU 388 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dxr s ALA 389 N -2.80 -0.43 -0.17 0.62 0.00 -1.18 -4.89 121.76 112.91 2dxr s ALA 389 Ca 0.18 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 52.00 2dxr s ALA 389 Cb 0.19 0.25 -0.22 0.00 0.00 0.00 0.00 23.12 23.33 2dxr s ALA 389 CO 0.57 -0.34 0.17 -0.25 0.00 0.00 0.00 175.76 175.92 2dxr n ASP 390 N 0.82 1.54 -3.52 0.00 8.00 0.29 -4.21 116.55 119.47 2dxr n ASP 390 Ca -0.20 0.10 -0.11 0.00 0.71 0.00 0.00 54.79 55.29 2dxr n ASP 390 Cb 0.58 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 41.36 2dxr n ASP 390 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dxr s ALA 391 N -2.54 -1.82 0.14 2.24 0.00 -1.16 -4.12 121.76 114.50 2dxr s ALA 391 Ca -0.22 1.15 -0.19 0.00 0.00 0.00 0.00 51.96 52.70 2dxr s ALA 391 Cb 0.08 0.12 0.05 0.00 0.00 0.00 0.00 23.12 23.36 2dxr s ALA 391 CO 0.73 -0.56 0.49 -0.48 0.00 0.00 0.00 175.76 175.94 2dxr s LEU 392 N -1.98 -0.01 0.04 0.00 2.34 -1.15 -2.22 118.68 115.69 2dxr s LEU 392 Ca 0.01 -0.19 -0.26 0.00 0.06 0.00 0.00 54.13 53.75 2dxr s LEU 392 Cb -0.01 2.16 -0.05 0.00 -0.56 0.00 0.00 46.19 47.73 2dxr s LEU 392 CO -0.04 -0.91 0.80 0.21 -1.06 0.00 0.00 176.35 175.35 2dxr s ASN 393 N -2.78 7.24 0.01 1.48 2.47 -1.26 -0.85 114.94 121.25 2dxr s ASN 393 Ca 0.02 1.48 0.03 0.00 0.42 0.00 0.00 52.86 54.81 2dxr s ASN 393 Cb 0.01 -2.49 -0.01 0.00 -1.45 0.00 0.00 41.25 37.31 2dxr s ASN 393 CO -0.12 -0.02 -0.08 -0.76 -3.72 0.00 0.00 177.10 172.39 2dxr s LEU 394 N 0.10 2.07 0.60 3.21 1.43 0.26 -4.93 118.68 121.42 2dxr s LEU 394 Ca 0.40 -0.23 -0.20 0.00 -1.03 0.00 0.00 54.13 53.07 2dxr s LEU 394 Cb -0.21 -0.39 -0.03 0.00 0.03 0.00 0.00 46.19 45.60 2dxr s LEU 394 CO 0.24 0.05 1.32 -0.67 0.23 0.00 0.00 176.35 177.51 2dxr n ASP 395 N 2.57 2.34 -0.32 2.29 2.03 -1.26 -0.86 116.55 123.34 2dxr n ASP 395 Ca -0.15 0.89 0.18 0.00 0.52 0.00 0.00 54.79 56.23 2dxr n ASP 395 Cb 0.57 -1.57 0.37 0.00 -0.72 0.00 0.00 41.12 39.77 2dxr n ASP 395 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2dxr h GLY 396 N 0.92 1.69 0.26 0.27 0.00 -1.79 -1.31 103.07 103.12 2dxr h GLY 396 Ca -0.51 -0.14 0.18 0.00 0.00 0.00 0.00 47.33 46.85 2dxr h GLY 396 CO 0.55 -0.40 0.61 -1.33 0.00 0.00 0.00 176.54 175.97 2dxr h GLY 397 N 0.30 1.51 1.42 4.60 0.00 -1.90 -0.89 103.07 108.12 2dxr h GLY 397 Ca 0.63 -0.33 -0.18 0.00 0.00 0.00 0.00 47.33 47.45 2dxr h GLY 397 CO -0.61 0.01 -1.17 -0.97 0.00 0.00 0.00 176.54 173.79 2dxr h TYR 398 N 0.73 0.00 -0.48 5.60 0.05 -1.38 -3.21 116.97 118.28 2dxr h TYR 398 Ca 0.53 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.30 2dxr h TYR 398 Cb 0.86 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.58 2dxr h TYR 398 CO -0.00 0.72 0.27 0.82 -1.05 0.00 0.00 178.16 178.91 2dxr h ILE 399 N 0.00 1.15 -0.07 -2.88 2.04 -0.83 0.38 117.51 117.29 2dxr h ILE 399 Ca -0.12 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 2dxr h ILE 399 Cb 1.65 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.22 2dxr h ILE 399 CO 0.07 0.16 0.03 0.22 0.00 0.00 0.00 178.15 178.63 2dxr h TYR 400 N 0.66 0.11 0.34 1.37 3.20 -1.43 0.27 116.97 121.49 2dxr h TYR 400 Ca 0.17 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 2dxr h TYR 400 Cb 0.01 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2dxr h TYR 400 CO 0.00 0.22 -0.48 1.15 -1.64 0.00 0.00 178.16 177.41 2dxr h THR 401 N -0.03 0.00 -0.58 1.81 2.02 -1.26 -2.61 112.91 112.26 2dxr h THR 401 Ca 0.02 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.31 2dxr h THR 401 Cb 0.16 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.53 2dxr h THR 401 CO -0.00 0.00 0.39 0.00 0.37 0.00 0.00 175.52 176.28 2dxr h ALA 402 N -0.84 2.10 0.03 6.16 0.00 -0.24 -2.79 119.26 123.68 2dxr h ALA 402 Ca -0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2dxr h ALA 402 Cb 0.77 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2dxr h ALA 402 CO -0.13 -0.24 -0.01 0.78 0.00 0.00 0.00 179.25 179.64 2dxr h GLY 403 N 0.33 -0.04 1.28 0.00 0.00 -0.11 -1.42 103.07 103.11 2dxr h GLY 403 Ca 0.27 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.62 2dxr h GLY 403 CO -0.07 -0.01 0.36 0.50 0.00 0.00 0.00 176.54 177.32 2dxr h LYS 404 N -0.37 0.00 -0.32 4.80 1.57 -1.19 0.07 116.57 121.14 2dxr h LYS 404 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dxr h LYS 404 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2dxr h LYS 404 CO 0.01 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.89 2dxr n GLY 406 N 1.47 0.52 3.81 0.00 0.00 0.01 -5.05 105.19 105.96 2dxr n GLY 406 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 2dxr n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dxr s LEU 407 N 0.00 3.71 0.02 0.99 1.43 -0.92 -3.82 118.68 120.10 2dxr s LEU 407 Ca 0.00 1.77 0.04 0.00 -1.03 0.00 0.00 54.13 54.91 2dxr s LEU 407 Cb 0.00 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.67 2dxr s LEU 407 CO 0.00 -0.78 -0.13 0.68 0.23 0.00 0.00 176.35 176.35 2dxr s VAL 408 N -2.30 1.02 0.47 -1.59 -7.23 0.96 -4.38 120.40 107.35 2dxr s VAL 408 Ca 0.63 -0.84 -0.23 0.00 -1.81 0.00 0.00 61.98 59.74 2dxr s VAL 408 Cb -0.13 -0.91 -0.07 0.00 0.56 0.00 0.00 36.38 35.83 2dxr s VAL 408 CO 0.26 0.07 1.18 -2.16 -0.31 0.00 0.00 175.10 174.14 2dxr s PRO 409 N -0.88 3.71 0.08 4.82 0.04 -1.26 -2.18 135.00 139.33 2dxr s PRO 409 Ca 0.02 1.81 -0.01 0.00 0.04 0.00 0.00 61.00 62.86 2dxr s PRO 409 Cb -0.07 -2.39 -0.00 0.00 0.04 0.00 0.00 34.50 32.08 2dxr s PRO 409 CO 0.01 -0.60 -0.02 0.28 0.04 0.00 0.00 177.00 176.71 2dxr n VAL 410 N -0.53 1.20 -4.06 -0.36 0.31 0.33 -4.95 118.33 110.27 2dxr n VAL 410 Ca 0.08 0.38 -0.09 0.00 -0.01 0.00 0.00 64.34 64.70 2dxr n VAL 410 Cb 0.48 -1.60 -0.10 0.00 -0.91 0.00 0.00 33.84 31.70 2dxr n VAL 410 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2dxr s LEU 411 N -6.96 2.39 0.17 7.52 1.43 -1.24 -4.37 118.68 117.63 2dxr s LEU 411 Ca -0.02 -0.80 0.11 0.00 -1.03 0.00 0.00 54.13 52.39 2dxr s LEU 411 Cb 0.00 0.10 -0.04 0.00 0.03 0.00 0.00 46.19 46.28 2dxr s LEU 411 CO 0.02 -0.45 -0.23 0.00 0.23 0.00 0.00 176.35 175.92 2dxr s ALA 412 N -2.85 2.39 0.15 4.21 0.00 -0.40 -0.54 121.76 124.72 2dxr s ALA 412 Ca -0.01 -1.57 -0.31 0.00 0.00 0.00 0.00 51.96 50.07 2dxr s ALA 412 Cb 0.00 -0.31 -0.08 0.00 0.00 0.00 0.00 23.12 22.73 2dxr s ALA 412 CO -0.05 0.41 1.37 -1.21 0.00 0.00 0.00 175.76 176.27 2dxr s GLU 413 N -2.56 4.34 -0.11 0.00 2.02 -0.49 0.14 118.70 122.04 2dxr s GLU 413 Ca 0.18 2.09 0.03 0.00 0.02 0.00 0.00 54.97 57.29 2dxr s GLU 413 Cb -0.08 -3.22 0.01 0.00 0.10 0.00 0.00 34.13 30.94 2dxr s GLU 413 CO 0.08 -0.37 -0.21 1.21 0.02 0.00 0.00 175.26 175.99 2dxr s ASN 414 N 0.78 2.84 0.20 -0.19 3.04 0.45 -4.75 114.94 117.31 2dxr s ASN 414 Ca 0.61 -0.52 0.04 0.00 0.04 0.00 0.00 52.86 53.04 2dxr s ASN 414 Cb -0.37 -1.30 -0.03 0.00 -1.54 0.00 0.00 41.25 38.00 2dxr s ASN 414 CO 0.34 0.10 0.28 0.00 -3.04 0.00 0.00 177.10 174.79 2dxr s ARG 415 N 0.59 3.30 -0.08 0.43 1.70 -1.26 0.63 118.95 124.26 2dxr s ARG 415 Ca -0.14 -0.76 -0.29 0.00 -0.47 0.00 0.00 55.73 54.07 2dxr s ARG 415 Cb -0.17 -2.84 -0.06 0.00 -0.57 0.00 0.00 34.95 31.31 2dxr s ARG 415 CO 0.04 0.46 1.90 -1.59 -1.08 0.00 0.00 175.30 175.03 2dxr s LYS 416 N -3.61 3.87 0.38 3.89 -2.85 -1.26 -4.81 119.74 115.34 2dxr s LYS 416 Ca 0.34 2.24 0.08 0.00 -1.00 0.00 0.00 55.97 57.62 2dxr s LYS 416 Cb -0.10 -4.15 -0.02 0.00 -2.06 0.00 0.00 37.83 31.50 2dxr s LYS 416 CO 0.28 -1.24 0.33 -1.54 0.10 0.00 0.00 175.35 173.27 2dxr s SER 417 N 5.02 5.15 -0.15 0.03 1.04 -1.26 -5.06 113.70 118.48 2dxr s SER 417 Ca 0.85 -0.63 -0.18 0.00 0.48 0.00 0.00 55.95 56.47 2dxr s SER 417 Cb -0.36 -0.76 -0.24 0.00 0.10 0.00 0.00 66.02 64.76 2dxr s SER 417 CO 0.36 -0.50 0.43 0.77 0.98 0.00 0.00 173.24 175.28 2dxr h SER 418 N 1.15 0.20 -3.72 7.02 4.64 -2.03 -3.46 113.55 117.34 2dxr h SER 418 Ca -0.43 -0.75 -0.49 0.00 -0.47 0.00 0.00 61.79 59.65 2dxr h SER 418 Cb 1.26 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2dxr h SER 418 CO 0.58 1.53 0.11 -0.75 -0.87 0.00 0.00 176.83 177.43 2dxr s LYS 419 N -2.42 3.90 -0.63 4.77 2.36 -1.26 -4.09 119.74 122.37 2dxr s LYS 419 Ca -0.23 0.58 -0.00 0.00 -2.55 0.00 0.00 55.97 53.76 2dxr s LYS 419 Cb 0.04 -2.41 -0.00 0.00 -1.05 0.00 0.00 37.83 34.41 2dxr s LYS 419 CO 0.69 0.06 0.52 0.72 1.55 0.00 0.00 175.35 178.90 2dxr n HIS 420 N -0.82 -1.17 0.04 4.03 8.25 -1.26 -4.98 115.22 119.31 2dxr n HIS 420 Ca 0.03 0.49 -0.03 0.00 -0.26 0.00 0.00 57.72 57.95 2dxr n HIS 420 Cb 0.54 -3.61 -0.09 0.00 1.12 0.00 0.00 29.99 27.95 2dxr n HIS 420 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2dxr h SER 421 N -0.97 0.00 -0.96 0.41 4.64 -1.89 -3.35 113.55 111.43 2dxr h SER 421 Ca -0.31 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.02 2dxr h SER 421 Cb 1.18 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.22 2dxr h SER 421 CO 0.26 0.77 0.63 0.77 -0.87 0.00 0.00 176.83 178.39 2dxr h SER 422 N 0.00 1.11 -3.89 4.97 4.64 -1.93 -3.44 113.55 115.01 2dxr h SER 422 Ca -0.15 -0.03 -0.47 0.00 -0.47 0.00 0.00 61.79 60.67 2dxr h SER 422 Cb 1.72 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 63.51 2dxr h SER 422 CO 0.07 0.81 0.24 -0.76 -0.87 0.00 0.00 176.83 176.33 2dxr s LEU 423 N -10.11 4.07 0.47 5.97 1.43 -1.26 -5.05 118.68 114.21 2dxr s LEU 423 Ca -0.13 1.56 -0.21 0.00 -1.03 0.00 0.00 54.13 54.32 2dxr s LEU 423 Cb 0.17 -4.24 -0.08 0.00 0.03 0.00 0.00 46.19 42.07 2dxr s LEU 423 CO 0.81 -0.24 1.05 -0.62 0.23 0.00 0.00 176.35 177.59 2dxr s ASP 424 N -2.09 6.38 0.29 2.29 2.15 -1.26 -4.79 116.67 119.64 2dxr s ASP 424 Ca 0.56 1.97 0.03 0.00 0.43 0.00 0.00 52.55 55.55 2dxr s ASP 424 Cb -0.11 -2.57 0.66 0.00 -0.30 0.00 0.00 42.92 40.60 2dxr s ASP 424 CO 0.16 -0.76 1.76 0.00 -0.17 0.00 0.00 175.17 176.17 2dxr h VAL 426 N 0.66 1.27 0.00 0.00 2.07 -1.92 -2.95 116.25 115.38 2dxr h VAL 426 Ca 0.54 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.79 2dxr h VAL 426 Cb 0.84 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 2dxr h VAL 426 CO -0.40 0.37 -1.29 0.18 0.02 0.00 0.00 177.57 176.45 2dxr n LEU 427 N -4.10 0.64 -4.73 2.57 4.77 -0.59 -1.27 117.00 114.30 2dxr n LEU 427 Ca -0.02 -0.28 -0.42 0.00 -0.03 0.00 0.00 56.01 55.27 2dxr n LEU 427 Cb 0.40 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 2dxr n LEU 427 CO 0.39 0.15 1.05 -0.60 -1.33 0.00 0.00 177.39 177.05 2dxr s ARG 428 N -3.18 4.33 0.46 3.23 3.52 -0.11 -4.96 118.95 122.24 2dxr s ARG 428 Ca 0.03 2.15 -0.25 0.00 -0.13 0.00 0.00 55.73 57.53 2dxr s ARG 428 Cb 0.15 -3.18 -0.08 0.00 -1.56 0.00 0.00 34.95 30.29 2dxr s ARG 428 CO 0.87 -0.36 1.38 -2.14 -0.81 0.00 0.00 175.30 174.24 2dxr s PRO 429 N 0.13 3.65 0.35 5.12 0.02 -1.26 -4.90 135.00 138.10 2dxr s PRO 429 Ca 0.60 2.32 -0.26 0.00 0.02 0.00 0.00 61.00 63.67 2dxr s PRO 429 Cb -0.39 -2.60 -0.09 0.00 0.02 0.00 0.00 34.50 31.44 2dxr s PRO 429 CO 0.38 -0.81 1.06 0.95 -0.33 0.00 0.00 177.00 178.24 2dxr s THR 430 N -1.24 3.67 -0.34 0.99 -4.23 -1.26 -4.99 115.64 108.23 2dxr s THR 430 Ca 0.62 1.44 0.21 0.00 -1.18 0.00 0.00 61.69 62.79 2dxr s THR 430 Cb -0.42 -3.82 -0.30 0.00 1.34 0.00 0.00 72.50 69.30 2dxr s THR 430 CO 0.53 0.16 0.61 -0.62 -0.54 0.00 0.00 174.62 174.76 2dxr n GLU 431 N 0.48 0.46 -0.27 3.99 1.02 -1.26 -5.04 120.64 120.02 2dxr n GLU 431 Ca 0.02 -0.13 0.03 0.00 -0.02 0.00 0.00 57.16 57.06 2dxr n GLU 431 Cb 0.48 -1.51 -0.01 0.00 -0.02 0.00 0.00 31.44 30.38 2dxr n GLU 431 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dxr n GLY 432 N 1.34 -2.22 3.49 0.62 0.00 -1.26 -4.95 105.19 102.21 2dxr n GLY 432 Ca -0.01 -1.41 -0.23 0.00 0.00 0.00 0.00 46.02 44.36 2dxr n GLY 432 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dxr s TYR 433 N -2.45 2.12 -0.35 1.61 -0.85 0.37 -4.85 117.35 112.96 2dxr s TYR 433 Ca 0.00 -0.74 -0.17 0.00 -0.52 0.00 0.00 57.07 55.63 2dxr s TYR 433 Cb 0.00 -1.33 -0.01 0.00 0.38 0.00 0.00 41.96 41.01 2dxr s TYR 433 CO 0.00 0.27 0.48 -0.51 -1.52 0.00 0.00 175.55 174.27 2dxr s LEU 434 N -3.53 4.37 0.21 -3.49 1.43 -1.26 0.91 118.68 117.32 2dxr s LEU 434 Ca 0.33 -0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 53.06 2dxr s LEU 434 Cb 0.06 -2.52 -0.09 0.00 0.03 0.00 0.00 46.19 43.67 2dxr s LEU 434 CO 0.15 -0.44 1.31 0.00 0.23 0.00 0.00 176.35 177.60 2dxr s ALA 435 N 2.30 3.53 0.10 4.21 0.00 0.48 -1.89 121.76 130.48 2dxr s ALA 435 Ca 0.17 1.12 -0.00 0.00 0.00 0.00 0.00 51.96 53.25 2dxr s ALA 435 Cb -0.16 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 2dxr s ALA 435 CO 0.13 -0.54 0.01 0.14 0.00 0.00 0.00 175.76 175.49 2dxr s VAL 436 N 0.01 0.27 -0.16 0.00 -7.23 -0.10 -1.95 120.40 111.25 2dxr s VAL 436 Ca 0.56 -1.89 -0.01 0.00 -1.81 0.00 0.00 61.98 58.83 2dxr s VAL 436 Cb -0.37 -1.84 -0.01 0.00 0.56 0.00 0.00 36.38 34.72 2dxr s VAL 436 CO 0.39 -0.69 -0.10 0.00 -0.31 0.00 0.00 175.10 174.39 2dxr s ALA 437 N -3.92 2.71 0.13 1.32 0.00 -1.26 -2.04 121.76 118.70 2dxr s ALA 437 Ca 0.17 -0.95 0.09 0.00 0.00 0.00 0.00 51.96 51.27 2dxr s ALA 437 Cb 0.07 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 2dxr s ALA 437 CO -0.03 0.07 -0.19 0.08 0.00 0.00 0.00 175.76 175.69 2dxr s VAL 438 N 0.63 2.77 0.19 0.00 1.01 0.17 -1.34 120.40 123.82 2dxr s VAL 438 Ca -0.06 -1.57 -0.06 0.00 0.00 0.00 0.00 61.98 60.29 2dxr s VAL 438 Cb -0.15 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 2dxr s VAL 438 CO 0.03 0.08 0.24 0.68 0.00 0.00 0.00 175.10 176.12 2dxr s VAL 439 N -1.19 0.04 0.12 2.92 -7.23 -0.61 -1.12 120.40 113.33 2dxr s VAL 439 Ca 0.18 -1.67 -0.30 0.00 -1.81 0.00 0.00 61.98 58.38 2dxr s VAL 439 Cb -0.10 -2.15 -0.07 0.00 0.56 0.00 0.00 36.38 34.62 2dxr s VAL 439 CO 0.10 -0.18 1.15 -0.54 -0.31 0.00 0.00 175.10 175.32 2dxr s LYS 440 N -4.05 4.51 0.22 4.82 3.01 -1.26 -1.79 119.74 125.19 2dxr s LYS 440 Ca 0.26 1.75 -0.09 0.00 -1.01 0.00 0.00 55.97 56.88 2dxr s LYS 440 Cb 0.04 -3.31 0.22 0.00 -1.01 0.00 0.00 37.83 33.77 2dxr s LYS 440 CO 0.06 -0.10 1.87 -0.22 0.51 0.00 0.00 175.35 177.47 2dxr h LYS 441 N 5.95 0.98 -0.19 1.68 3.64 -1.49 -1.31 116.57 125.83 2dxr h LYS 441 Ca -0.43 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 58.95 2dxr h LYS 441 Cb 1.21 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 2dxr h LYS 441 CO 0.77 0.65 0.20 0.00 -2.27 0.00 0.00 179.45 178.79 2dxr h ALA 442 N 1.32 1.82 -0.25 5.00 0.00 -1.93 -3.20 119.26 122.03 2dxr h ALA 442 Ca 0.31 -0.01 -0.72 0.00 0.00 0.00 0.00 54.91 54.50 2dxr h ALA 442 Cb -0.02 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 2dxr h ALA 442 CO -0.10 -0.30 2.90 -1.71 0.00 0.00 0.00 179.25 180.04 2dxr n ASN 443 N -3.83 4.78 -4.74 0.00 2.85 -0.49 -4.96 115.26 108.87 2dxr n ASN 443 Ca 0.02 -2.89 -0.33 0.00 -0.11 0.00 0.00 54.58 51.26 2dxr n ASN 443 Cb 0.33 -1.59 0.08 0.00 1.24 0.00 0.00 39.78 39.83 2dxr n ASN 443 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2dxr s GLU 444 N 2.23 2.32 0.00 1.20 2.02 -1.21 -3.02 118.70 122.25 2dxr s GLU 444 Ca 0.47 1.53 0.00 0.00 0.02 0.00 0.00 54.97 57.00 2dxr s GLU 444 Cb 0.13 -1.88 0.00 0.00 0.10 0.00 0.00 34.13 32.49 2dxr s GLU 444 CO -0.06 -1.65 0.00 0.41 0.02 0.00 0.00 175.26 173.98 2dxr n GLY 445 N -0.15 0.35 3.54 -1.39 0.00 -1.26 -4.95 105.19 101.32 2dxr n GLY 445 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2dxr n GLY 445 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dxr s LEU 446 N 0.00 4.10 0.47 0.99 2.96 -1.17 -4.90 118.68 121.13 2dxr s LEU 446 Ca 0.00 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 53.75 2dxr s LEU 446 Cb 0.00 -2.96 -0.03 0.00 0.50 0.00 0.00 46.19 43.71 2dxr s LEU 446 CO 0.00 -1.13 0.02 0.42 -1.32 0.00 0.00 176.35 174.34 2dxr s THR 447 N 3.80 1.24 0.59 3.68 -4.23 -1.26 -5.02 115.64 114.43 2dxr s THR 447 Ca 0.32 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.12 2dxr s THR 447 Cb -0.12 -2.36 0.37 0.00 1.34 0.00 0.00 72.50 71.74 2dxr s THR 447 CO 0.22 0.00 2.01 -0.25 -0.54 0.00 0.00 174.62 176.06 2dxr h TRP 448 N 1.51 0.00 -0.00 3.99 2.91 -1.83 -2.07 115.95 120.46 2dxr h TRP 448 Ca -0.43 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.59 2dxr h TRP 448 Cb 1.29 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.94 2dxr h TRP 448 CO 1.35 0.00 -0.32 0.09 -1.03 0.00 0.00 178.44 178.53 2dxr n ASN 449 N -3.80 0.68 -1.17 2.65 3.02 -1.26 -3.68 115.26 111.69 2dxr n ASN 449 Ca 0.05 -0.51 0.01 0.00 -0.03 0.00 0.00 54.58 54.10 2dxr n ASN 449 Cb 0.48 0.12 0.12 0.00 -0.61 0.00 0.00 39.78 39.88 2dxr n ASN 449 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2dxr n SER 450 N -1.08 1.93 0.21 6.41 3.41 -0.79 -4.76 113.62 118.95 2dxr n SER 450 Ca 0.10 -3.25 0.10 0.00 -0.26 0.00 0.00 58.87 55.55 2dxr n SER 450 Cb 0.33 -0.44 0.34 0.00 -0.26 0.00 0.00 64.21 64.18 2dxr n SER 450 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2dxr h LEU 451 N 1.26 0.00 -9.65 1.04 3.38 -1.61 -3.44 115.31 106.29 2dxr h LEU 451 Ca -0.02 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.41 2dxr h LEU 451 Cb 1.33 0.00 0.07 0.00 0.09 0.00 0.00 40.66 42.15 2dxr h LEU 451 CO 0.14 0.19 0.93 1.17 0.09 0.00 0.00 178.44 180.96 2dxr n LYS 452 N -3.23 2.63 -1.12 1.13 4.81 -1.26 -1.95 118.16 119.16 2dxr n LYS 452 Ca 0.02 0.94 -0.04 0.00 -0.87 0.00 0.00 58.31 58.36 2dxr n LYS 452 Cb 0.50 -2.76 -0.02 0.00 0.02 0.00 0.00 35.03 32.77 2dxr n LYS 452 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2dxr n ASP 453 N 3.45 -4.12 -4.82 3.14 10.43 -0.32 -4.99 116.55 119.31 2dxr n ASP 453 Ca 0.15 0.10 -0.22 0.00 2.57 0.00 0.00 54.79 57.39 2dxr n ASP 453 Cb 0.34 -1.99 0.09 0.00 1.84 0.00 0.00 41.12 41.40 2dxr n ASP 453 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2dxr s LYS 454 N -1.75 1.94 -0.25 -1.24 -0.14 -0.82 -4.27 119.74 113.21 2dxr s LYS 454 Ca 0.00 -1.34 -0.09 0.00 -1.36 0.00 0.00 55.97 53.18 2dxr s LYS 454 Cb 0.00 -2.47 -0.04 0.00 -1.68 0.00 0.00 37.83 33.64 2dxr s LYS 454 CO 0.00 -1.20 0.12 0.15 -0.76 0.00 0.00 175.35 173.66 2dxr s LYS 455 N -4.94 3.84 0.00 1.68 1.02 -1.26 -2.12 119.74 117.96 2dxr s LYS 455 Ca 0.64 -0.39 0.01 0.00 0.02 0.00 0.00 55.97 56.26 2dxr s LYS 455 Cb -0.05 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 2dxr s LYS 455 CO 0.42 -0.11 0.01 -1.54 -0.92 0.00 0.00 175.35 173.22 2dxr s SER 456 N 1.47 5.20 -0.24 2.83 1.04 -0.87 0.15 113.70 123.27 2dxr s SER 456 Ca 0.06 0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.50 2dxr s SER 456 Cb -0.15 -1.37 0.03 0.00 0.10 0.00 0.00 66.02 64.63 2dxr s SER 456 CO 0.06 0.28 -0.09 0.00 0.98 0.00 0.00 173.24 174.47 2dxr s HIS 458 N 1.28 2.87 0.11 0.00 3.76 -0.48 -1.69 115.29 121.15 2dxr s HIS 458 Ca -0.01 -0.07 -0.28 0.00 -0.15 0.00 0.00 55.06 54.56 2dxr s HIS 458 Cb -0.17 -1.54 -0.08 0.00 1.11 0.00 0.00 32.58 31.91 2dxr s HIS 458 CO -0.06 0.42 1.63 1.79 -0.85 0.00 0.00 174.74 177.67 2dxr h THR 459 N 3.38 0.37 -1.24 1.30 1.35 -1.73 -3.41 112.91 112.92 2dxr h THR 459 Ca -0.48 0.00 0.25 0.00 -0.55 0.00 0.00 66.41 65.63 2dxr h THR 459 Cb 1.17 0.37 -0.23 0.00 -1.73 0.00 0.00 68.15 67.73 2dxr h THR 459 CO 0.55 0.00 0.88 0.00 -0.25 0.00 0.00 175.52 176.69 2dxr s ALA 460 N -6.03 -2.11 0.59 6.62 0.00 -1.26 -0.91 121.76 118.66 2dxr s ALA 460 Ca -0.16 1.77 -0.19 0.00 0.00 0.00 0.00 51.96 53.39 2dxr s ALA 460 Cb 0.08 -0.73 -0.05 0.00 0.00 0.00 0.00 23.12 22.42 2dxr s ALA 460 CO 0.65 -0.43 1.03 0.28 0.00 0.00 0.00 175.76 177.29 2dxr n VAL 461 N 0.21 3.77 -0.90 0.00 0.31 0.28 -3.06 118.33 118.96 2dxr n VAL 461 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2dxr n VAL 461 Cb 0.58 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 2dxr n VAL 461 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2dxr n ASP 462 N -0.83 -2.00 -4.92 4.52 8.00 -1.26 -4.95 116.55 115.11 2dxr n ASP 462 Ca 0.13 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.36 2dxr n ASP 462 Cb 0.47 -1.32 -0.03 0.00 -0.02 0.00 0.00 41.12 40.22 2dxr n ASP 462 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2dxr s ARG 463 N -0.58 3.56 0.03 -1.24 0.52 -1.17 -3.97 118.95 116.08 2dxr s ARG 463 Ca 0.00 -0.19 -0.16 0.00 -0.52 0.00 0.00 55.73 54.86 2dxr s ARG 463 Cb 0.00 -2.72 -0.09 0.00 0.52 0.00 0.00 34.95 32.66 2dxr s ARG 463 CO 0.00 0.27 1.24 1.15 0.02 0.00 0.00 175.30 177.98 2dxr h THR 464 N 1.30 0.00 0.03 0.02 2.02 -1.92 0.07 112.91 114.42 2dxr h THR 464 Ca -0.48 0.00 -0.22 0.00 0.77 0.00 0.00 66.41 66.48 2dxr h THR 464 Cb 1.20 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2dxr h THR 464 CO 0.66 0.00 -0.96 0.00 0.37 0.00 0.00 175.52 175.58 2dxr h ALA 465 N -1.72 0.41 0.00 6.16 0.00 -1.90 0.89 119.26 123.10 2dxr h ALA 465 Ca -0.06 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.08 2dxr h ALA 465 Cb 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2dxr h ALA 465 CO 0.09 0.95 -0.30 0.78 0.00 0.00 0.00 179.25 180.76 2dxr h GLY 466 N 1.84 0.00 0.00 0.00 0.00 -1.67 -3.38 103.07 99.86 2dxr h GLY 466 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2dxr h GLY 466 CO 0.15 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.56 2dxr n TRP 467 N -2.83 -0.56 -0.16 5.60 -0.00 -0.49 -4.20 117.44 114.80 2dxr n TRP 467 Ca 0.03 0.10 -0.03 0.00 -0.00 0.00 0.00 57.50 57.60 2dxr n TRP 467 Cb 0.52 0.48 0.06 0.00 -0.00 0.00 0.00 31.31 32.36 2dxr n TRP 467 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 2dxr h ASN 468 N 0.00 0.16 0.45 5.87 2.35 -1.03 0.14 115.58 123.53 2dxr h ASN 468 Ca 0.00 0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2dxr h ASN 468 Cb 0.00 0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2dxr h ASN 468 CO 0.00 0.12 -0.22 0.40 -1.65 0.00 0.00 177.43 176.08 2dxr h ILE 469 N 0.33 0.49 -0.22 2.81 1.08 -1.05 -0.84 117.51 120.12 2dxr h ILE 469 Ca 0.24 -0.39 -0.19 0.00 -0.39 0.00 0.00 64.86 64.12 2dxr h ILE 469 Cb 0.26 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 34.66 2dxr h ILE 469 CO -0.25 0.06 -0.63 1.55 -0.69 0.00 0.00 178.15 178.20 2dxr h PRO 470 N -0.86 0.77 0.00 2.37 0.13 -1.75 -2.11 132.00 130.55 2dxr h PRO 470 Ca -0.06 -0.54 -0.09 0.00 -0.87 0.00 0.00 66.00 64.44 2dxr h PRO 470 Cb 0.57 0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.77 2dxr h PRO 470 CO 0.10 1.16 -0.44 0.52 -0.23 0.00 0.00 178.00 179.11 2dxr h MET 471 N 0.57 0.00 -0.15 0.86 2.86 -0.81 -1.35 114.93 116.91 2dxr h MET 471 Ca -0.01 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2dxr h MET 471 Cb 1.23 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.88 2dxr h MET 471 CO 0.13 0.44 0.07 0.78 1.06 0.00 0.00 176.91 179.40 2dxr h GLY 472 N 2.13 0.23 0.86 8.32 0.00 -0.97 -1.23 103.07 112.41 2dxr h GLY 472 Ca -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 47.33 47.18 2dxr h GLY 472 CO 0.06 0.11 0.03 1.41 0.00 0.00 0.00 176.54 178.15 2dxr h LEU 473 N 0.11 0.40 -1.63 3.11 3.38 -1.16 -2.71 115.31 116.81 2dxr h LEU 473 Ca 0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 2dxr h LEU 473 Cb 0.13 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2dxr h LEU 473 CO -0.01 0.57 0.14 0.40 0.09 0.00 0.00 178.44 179.64 2dxr h ILE 474 N 0.21 1.10 0.18 1.22 2.04 -1.18 -0.00 117.51 121.08 2dxr h ILE 474 Ca 0.07 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 2dxr h ILE 474 Cb 0.35 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 2dxr h ILE 474 CO 0.01 0.11 -0.09 0.58 0.00 0.00 0.00 178.15 178.76 2dxr h VAL 475 N 0.39 0.93 -0.15 1.67 2.07 -1.12 -1.26 116.25 118.78 2dxr h VAL 475 Ca 0.10 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 66.98 2dxr h VAL 475 Cb 0.03 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 2dxr h VAL 475 CO -0.02 0.15 -0.04 0.78 0.02 0.00 0.00 177.57 178.47 2dxr h ASN 476 N -0.58 -0.14 -0.75 0.57 2.35 -1.19 0.38 115.58 116.23 2dxr h ASN 476 Ca -0.02 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2dxr h ASN 476 Cb 0.43 0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.86 2dxr h ASN 476 CO 0.04 -0.05 0.45 1.56 -1.65 0.00 0.00 177.43 177.79 2dxr h GLN 477 N 0.00 1.02 0.00 0.81 4.20 -1.08 -3.14 115.11 116.93 2dxr h GLN 477 Ca 0.07 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2dxr h GLN 477 Cb 0.11 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.67 2dxr h GLN 477 CO -0.16 0.72 -0.73 1.15 -0.67 0.00 0.00 178.83 179.14 2dxr h THR 478 N 1.04 0.00 -3.21 -0.54 2.02 -0.73 -3.47 112.91 108.02 2dxr h THR 478 Ca 0.27 -0.63 -0.28 0.00 0.77 0.00 0.00 66.41 66.55 2dxr h THR 478 Cb -0.04 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 2dxr h THR 478 CO -0.05 0.00 -0.33 0.61 0.37 0.00 0.00 175.52 176.12 2dxr n GLY 479 N 1.29 -0.12 2.99 2.16 0.00 0.13 -4.97 105.19 106.67 2dxr n GLY 479 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 2dxr n GLY 479 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dxr s SER 480 N -2.06 0.60 0.00 1.61 0.15 -1.21 -5.02 113.70 107.77 2dxr s SER 480 Ca 0.00 -0.32 0.17 0.00 0.70 0.00 0.00 55.95 56.50 2dxr s SER 480 Cb 0.00 0.00 0.74 0.00 -1.71 0.00 0.00 66.02 65.06 2dxr s SER 480 CO 0.00 -0.10 1.52 0.00 1.20 0.00 0.00 173.24 175.86 2dxr n ALA 482 N -0.08 6.26 0.26 0.00 0.00 -1.26 -4.58 120.51 121.11 2dxr n ALA 482 Ca 0.13 -2.15 0.16 0.00 0.00 0.00 0.00 53.44 51.59 2dxr n ALA 482 Cb 0.21 -2.18 0.84 0.00 0.00 0.00 0.00 19.45 18.33 2dxr n ALA 482 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2dxr h PHE 483 N 2.86 0.00 0.00 0.00 -0.00 -1.97 -0.58 116.94 117.25 2dxr h PHE 483 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.22 2dxr h PHE 483 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 2dxr h PHE 483 CO 1.58 0.00 0.00 -0.40 -0.00 0.00 0.00 178.31 179.49 2dxr n ASP 484 N -2.63 0.00 -0.02 -0.68 5.75 -1.26 -3.25 116.55 114.46 2dxr n ASP 484 Ca -0.02 -1.16 0.01 0.00 -0.01 0.00 0.00 54.79 53.61 2dxr n ASP 484 Cb 0.08 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.18 2dxr n ASP 484 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2dxr n GLU 485 N -0.91 2.08 -0.07 0.11 1.02 -0.23 -4.77 120.64 117.88 2dxr n GLU 485 Ca 0.19 -1.37 -0.10 0.00 -0.02 0.00 0.00 57.16 55.87 2dxr n GLU 485 Cb 0.09 -0.92 -0.08 0.00 -0.02 0.00 0.00 31.44 30.50 2dxr n GLU 485 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2dxr h PHE 486 N 0.00 0.00 -3.45 -0.32 3.57 -1.62 -3.45 116.94 111.66 2dxr h PHE 486 Ca 0.00 0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.96 2dxr h PHE 486 Cb 0.69 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 2dxr h PHE 486 CO 0.00 0.69 0.02 -0.06 -2.23 0.00 0.00 178.31 176.74 2dxr s PHE 487 N -2.03 3.63 0.10 0.41 0.08 -1.26 -1.18 117.98 117.73 2dxr s PHE 487 Ca -0.14 1.24 -0.16 0.00 0.12 0.00 0.00 56.93 57.99 2dxr s PHE 487 Cb -0.01 -2.50 -0.08 0.00 -0.57 0.00 0.00 43.02 39.86 2dxr s PHE 487 CO 0.45 0.38 1.45 0.66 -0.10 0.00 0.00 175.22 178.06 2dxr h SER 488 N 3.51 0.67 -4.63 1.36 4.64 -1.61 -3.45 113.55 114.04 2dxr h SER 488 Ca -0.48 -0.43 -0.12 0.00 -0.47 0.00 0.00 61.79 60.29 2dxr h SER 488 Cb 1.19 -0.19 -0.21 0.00 -0.31 0.00 0.00 62.40 62.88 2dxr h SER 488 CO 0.65 0.96 -0.25 -1.10 -0.87 0.00 0.00 176.83 176.23 2dxr s GLN 489 N -4.51 0.62 0.22 4.77 -0.21 -1.26 -4.88 119.66 114.41 2dxr s GLN 489 Ca -0.13 0.06 0.00 0.00 0.02 0.00 0.00 55.36 55.32 2dxr s GLN 489 Cb 0.08 0.28 -0.04 0.00 1.00 0.00 0.00 33.01 34.34 2dxr s GLN 489 CO 0.81 -0.15 0.16 -1.12 -2.12 0.00 0.00 175.29 172.87 2dxr s SER 490 N -0.83 0.43 -0.24 5.90 0.01 -0.85 -2.05 113.70 116.06 2dxr s SER 490 Ca -0.09 -1.46 0.01 0.00 1.31 0.00 0.00 55.95 55.73 2dxr s SER 490 Cb -0.04 0.41 0.04 0.00 0.21 0.00 0.00 66.02 66.65 2dxr s SER 490 CO 0.03 -0.88 -0.11 0.00 0.41 0.00 0.00 173.24 172.69 2dxr n ALA 492 N 4.53 3.03 -1.61 0.00 0.00 -0.04 -1.39 120.51 125.04 2dxr n ALA 492 Ca -0.16 -3.63 -0.51 0.00 0.00 0.00 0.00 53.44 49.14 2dxr n ALA 492 Cb 0.45 -0.84 -0.06 0.00 0.00 0.00 0.00 19.45 19.00 2dxr n ALA 492 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2dxr n PRO 493 N 2.28 1.37 0.00 0.00 -0.02 -1.26 -1.58 135.00 135.78 2dxr n PRO 493 Ca 0.26 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2dxr n PRO 493 Cb 0.45 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2dxr n PRO 493 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dxr n GLY 494 N 2.69 1.04 4.00 -1.23 0.00 -0.82 0.10 105.19 110.98 2dxr n GLY 494 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 2dxr n GLY 494 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dxr s ALA 495 N -2.10 3.99 -0.15 4.61 0.00 -0.61 -4.90 121.76 122.59 2dxr s ALA 495 Ca 0.00 -1.81 -0.29 0.00 0.00 0.00 0.00 51.96 49.86 2dxr s ALA 495 Cb 0.00 -1.87 -0.05 0.00 0.00 0.00 0.00 23.12 21.21 2dxr s ALA 495 CO 0.00 -1.23 1.83 0.34 0.00 0.00 0.00 175.76 176.70 2dxr s ASP 496 N -4.69 6.21 0.52 0.00 -1.08 -1.26 -4.88 116.67 111.48 2dxr s ASP 496 Ca 0.64 1.96 0.32 0.00 -0.52 0.00 0.00 52.55 54.96 2dxr s ASP 496 Cb -0.06 -2.53 1.46 0.00 -1.46 0.00 0.00 42.92 40.33 2dxr s ASP 496 CO 0.42 -1.34 1.81 -0.65 0.52 0.00 0.00 175.17 175.93 2dxr h PRO 497 N 11.58 0.07 -0.00 4.34 0.11 -1.94 0.67 132.00 146.83 2dxr h PRO 497 Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2dxr h PRO 497 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2dxr h PRO 497 CO 0.98 0.05 -0.11 1.63 -0.21 0.00 0.00 178.00 180.33 2dxr n LYS 498 N -4.28 0.24 -2.29 1.05 5.02 -1.26 -4.73 118.16 111.91 2dxr n LYS 498 Ca 0.24 -0.05 -0.26 0.00 -2.02 0.00 0.00 58.31 56.22 2dxr n LYS 498 Cb 1.13 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 34.69 2dxr n LYS 498 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2dxr s SER 499 N -2.79 5.22 0.38 4.39 1.04 0.23 -4.99 113.70 117.19 2dxr s SER 499 Ca 0.20 0.59 0.09 0.00 0.48 0.00 0.00 55.95 57.31 2dxr s SER 499 Cb 0.19 -1.42 0.76 0.00 0.10 0.00 0.00 66.02 65.65 2dxr s SER 499 CO 0.53 -1.32 1.91 0.08 0.98 0.00 0.00 173.24 175.42 2dxr h ARG 500 N -0.38 0.29 0.00 4.02 0.11 -1.90 -2.31 114.38 114.21 2dxr h ARG 500 Ca -0.45 -0.06 0.00 0.00 0.10 0.00 0.00 59.98 59.57 2dxr h ARG 500 Cb 1.28 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2dxr h ARG 500 CO 0.60 0.40 0.04 1.28 0.10 0.00 0.00 179.97 182.40 2dxr n LEU 501 N -4.28 0.00 -0.10 0.08 4.77 -1.26 -1.83 117.00 114.38 2dxr n LEU 501 Ca -0.00 0.44 0.01 0.00 -0.03 0.00 0.00 56.01 56.43 2dxr n LEU 501 Cb 0.26 -0.44 0.01 0.00 -2.33 0.00 0.00 43.42 40.92 2dxr n LEU 501 CO 0.38 -0.44 0.27 0.00 -1.33 0.00 0.00 177.39 176.27 2dxr h ALA 503 N 0.50 2.25 -0.01 0.00 0.00 -0.86 -1.99 119.26 119.15 2dxr h ALA 503 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2dxr h ALA 503 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2dxr h ALA 503 CO 0.00 -0.40 -0.39 1.28 0.00 0.00 0.00 179.25 179.74 2dxr n LEU 504 N -4.44 1.77 -4.77 0.00 4.32 -0.22 -4.93 117.00 108.73 2dxr n LEU 504 Ca 0.10 -0.62 -0.38 0.00 -0.02 0.00 0.00 56.01 55.09 2dxr n LEU 504 Cb 0.50 -0.03 -0.05 0.00 -1.62 0.00 0.00 43.42 42.22 2dxr n LEU 504 CO 0.35 0.33 0.73 0.00 -1.22 0.00 0.00 177.39 177.58 2dxr n ALA 506 N 0.51 3.49 -0.57 0.00 0.00 -1.26 -4.73 120.51 117.94 2dxr n ALA 506 Ca 0.02 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.02 2dxr n ALA 506 Cb 0.48 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.33 2dxr n ALA 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dxr n GLY 507 N 1.45 -0.43 0.00 0.00 0.00 -1.26 -4.46 105.19 100.49 2dxr n GLY 507 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.95 2dxr n GLY 507 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dxr n ASP 508 N -1.59 0.00 -0.20 1.61 5.75 -0.36 -2.60 116.55 119.16 2dxr n ASP 508 Ca 0.00 -0.34 0.06 0.00 -0.01 0.00 0.00 54.79 54.50 2dxr n ASP 508 Cb 0.00 0.00 0.34 0.00 -1.03 0.00 0.00 41.12 40.43 2dxr n ASP 508 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2dxr h ASP 509 N 0.00 0.69 -0.38 -1.12 3.32 -1.90 0.25 116.42 117.28 2dxr h ASP 509 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2dxr h ASP 509 Cb 0.00 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.41 2dxr h ASP 509 CO 0.00 0.44 0.00 0.00 -1.72 0.00 0.00 179.24 177.96 2dxr n GLN 510 N -4.48 2.04 -1.19 3.56 6.02 -1.26 -4.94 117.38 117.13 2dxr n GLN 510 Ca 0.11 -1.60 -0.07 0.00 -0.01 0.00 0.00 57.00 55.44 2dxr n GLN 510 Cb 0.23 -1.39 -0.03 0.00 1.02 0.00 0.00 30.24 30.07 2dxr n GLN 510 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dxr n GLY 511 N 1.25 0.86 3.96 1.08 0.00 0.07 -5.04 105.19 107.37 2dxr n GLY 511 Ca 0.16 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 2dxr n GLY 511 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dxr s LEU 512 N -1.49 3.23 -2.07 0.99 1.43 -1.26 -4.34 118.68 115.16 2dxr s LEU 512 Ca 0.00 0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 2dxr s LEU 512 Cb 0.00 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.26 2dxr s LEU 512 CO 0.00 -1.18 0.00 0.47 0.23 0.00 0.00 176.35 175.87 2dxr n ASP 513 N -2.43 -5.44 -4.64 2.29 8.00 -1.26 -1.22 116.55 111.86 2dxr n ASP 513 Ca 0.07 0.44 -0.60 0.00 0.71 0.00 0.00 54.79 55.41 2dxr n ASP 513 Cb 0.60 -4.67 -0.08 0.00 -0.02 0.00 0.00 41.12 36.94 2dxr n ASP 513 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2dxr n LYS 514 N -2.48 0.45 -0.11 -1.24 4.81 -1.26 -0.49 118.16 117.85 2dxr n LYS 514 Ca -0.20 0.17 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 2dxr n LYS 514 Cb 0.66 -1.73 0.00 0.00 0.02 0.00 0.00 35.03 33.98 2dxr n LYS 514 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dxr n VAL 516 N -2.00 2.42 -1.73 0.00 0.24 0.36 -1.95 118.33 115.68 2dxr n VAL 516 Ca 0.00 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.34 61.43 2dxr n VAL 516 Cb 0.00 -1.33 -0.02 0.00 -1.47 0.00 0.00 33.84 31.02 2dxr n VAL 516 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2dxr n PRO 517 N 0.18 4.07 -4.08 7.34 -0.04 -1.26 -4.52 135.00 136.69 2dxr n PRO 517 Ca 0.08 -2.94 -0.11 0.00 -0.04 0.00 0.00 63.50 60.49 2dxr n PRO 517 Cb 0.38 -2.60 -0.06 0.00 -0.04 0.00 0.00 33.50 31.18 2dxr n PRO 517 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dxr s ASN 518 N 0.90 0.26 0.00 3.54 2.20 -1.26 -4.55 114.94 116.04 2dxr s ASN 518 Ca 0.59 -1.21 0.09 0.00 -0.94 0.00 0.00 52.86 51.39 2dxr s ASN 518 Cb 0.21 0.55 0.45 0.00 -2.00 0.00 0.00 41.25 40.46 2dxr s ASN 518 CO -0.09 -1.11 1.11 -1.54 -2.94 0.00 0.00 177.10 172.53 2dxr n SER 519 N -0.65 0.00 0.31 3.54 3.41 -1.26 -1.28 113.62 117.70 2dxr n SER 519 Ca 0.00 0.08 0.20 0.00 -0.26 0.00 0.00 58.87 58.89 2dxr n SER 519 Cb 0.63 -0.23 1.01 0.00 -0.26 0.00 0.00 64.21 65.36 2dxr n SER 519 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2dxr h LYS 520 N 0.00 0.00 -6.02 4.33 1.57 -1.94 -3.40 116.57 111.11 2dxr h LYS 520 Ca 0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 2dxr h LYS 520 Cb 0.06 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.31 2dxr h LYS 520 CO 0.00 0.01 0.51 -2.00 -0.57 0.00 0.00 179.45 177.40 2dxr s GLU 521 N -4.01 4.31 0.34 3.15 2.56 -0.40 -2.94 118.70 121.71 2dxr s GLU 521 Ca -0.03 1.16 0.13 0.00 0.00 0.00 0.00 54.97 56.22 2dxr s GLU 521 Cb 0.12 -3.59 0.96 0.00 2.00 0.00 0.00 34.13 33.63 2dxr s GLU 521 CO 0.47 -0.40 1.74 -0.22 -0.56 0.00 0.00 175.26 176.29 2dxr h LYS 522 N 7.33 0.50 -0.76 4.30 3.64 -1.73 -2.52 116.57 127.34 2dxr h LYS 522 Ca -0.27 -0.03 -0.43 0.00 -1.27 0.00 0.00 60.65 58.65 2dxr h LYS 522 Cb 1.12 -0.11 -0.24 0.00 -0.41 0.00 0.00 32.23 32.58 2dxr h LYS 522 CO 0.87 0.33 0.34 0.66 -2.27 0.00 0.00 179.45 179.38 2dxr n TYR 523 N -4.81 2.39 -3.44 1.91 4.01 -1.26 -4.44 117.16 111.51 2dxr n TYR 523 Ca 0.27 -1.97 -0.35 0.00 -0.16 0.00 0.00 57.90 55.69 2dxr n TYR 523 Cb 0.80 -0.83 -0.06 0.00 -0.31 0.00 0.00 39.34 38.95 2dxr n TYR 523 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2dxr s TYR 524 N -3.39 3.58 0.05 -0.72 5.04 -0.95 -3.45 117.35 117.51 2dxr s TYR 524 Ca 0.54 0.95 0.00 0.00 -2.44 0.00 0.00 57.07 56.12 2dxr s TYR 524 Cb 0.46 -2.29 0.00 0.00 0.35 0.00 0.00 41.96 40.48 2dxr s TYR 524 CO 0.05 0.44 0.00 0.41 -1.34 0.00 0.00 175.55 175.11 2dxr n GLY 525 N 0.75 -1.74 0.17 8.97 0.00 -0.09 -1.75 105.19 111.50 2dxr n GLY 525 Ca -0.06 -1.28 -0.06 0.00 0.00 0.00 0.00 46.02 44.62 2dxr n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2dxr h TYR 526 N -0.19 0.34 0.03 1.61 0.05 -1.95 0.30 116.97 117.16 2dxr h TYR 526 Ca 0.00 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 2dxr h TYR 526 Cb 0.18 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.83 2dxr h TYR 526 CO 0.00 0.17 -0.01 1.15 -1.05 0.00 0.00 178.16 178.42 2dxr h THR 527 N 0.38 1.27 -0.58 -2.88 2.02 -1.90 -2.29 112.91 108.93 2dxr h THR 527 Ca 0.16 -0.95 0.11 0.00 0.77 0.00 0.00 66.41 66.50 2dxr h THR 527 Cb 0.08 1.90 -0.08 0.00 -1.74 0.00 0.00 68.15 68.32 2dxr h THR 527 CO -0.12 0.24 0.13 1.23 0.37 0.00 0.00 175.52 177.37 2dxr h GLY 528 N -0.45 0.74 1.18 2.16 0.00 -1.03 0.11 103.07 105.78 2dxr h GLY 528 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 2dxr h GLY 528 CO 0.01 -0.10 0.14 0.00 0.00 0.00 0.00 176.54 176.59 2dxr h ALA 529 N 1.46 1.04 -0.16 3.60 0.00 -0.92 -1.42 119.26 122.86 2dxr h ALA 529 Ca 0.30 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2dxr h ALA 529 Cb 0.44 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2dxr h ALA 529 CO -0.38 0.62 -0.47 0.35 0.00 0.00 0.00 179.25 179.37 2dxr h PHE 530 N 0.96 0.49 -0.54 0.00 3.57 -0.61 -2.77 116.94 118.03 2dxr h PHE 530 Ca 0.20 -0.15 -0.08 0.00 3.53 0.00 0.00 57.97 61.47 2dxr h PHE 530 Cb 0.36 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 2dxr h PHE 530 CO 0.03 0.80 0.05 -0.09 -2.23 0.00 0.00 178.31 176.86 2dxr h ARG 531 N 0.32 0.93 -0.77 1.11 2.43 -0.56 0.26 114.38 118.10 2dxr h ARG 531 Ca 0.02 -0.27 0.18 0.00 -0.81 0.00 0.00 59.98 59.10 2dxr h ARG 531 Cb 0.95 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 30.36 2dxr h ARG 531 CO 0.08 0.92 0.53 0.00 -1.51 0.00 0.00 179.97 179.99 2dxr h LEU 533 N 0.26 0.42 -1.85 0.00 5.85 -1.11 -1.23 115.31 117.64 2dxr h LEU 533 Ca 0.38 -0.89 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 2dxr h LEU 533 Cb 1.12 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.01 2dxr h LEU 533 CO -0.09 1.79 -0.03 0.00 -0.34 0.00 0.00 178.44 179.77 2dxr h ALA 534 N 0.15 1.88 -0.42 1.25 0.00 0.10 -0.10 119.26 122.13 2dxr h ALA 534 Ca -0.40 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2dxr h ALA 534 Cb 2.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2dxr h ALA 534 CO 0.10 0.09 0.00 0.39 0.00 0.00 0.00 179.25 179.84 2dxr n GLU 535 N -4.47 2.14 -1.56 0.00 1.02 0.30 -4.91 120.64 113.16 2dxr n GLU 535 Ca -0.02 -1.75 -0.19 0.00 -0.02 0.00 0.00 57.16 55.18 2dxr n GLU 535 Cb 0.13 -1.41 -0.08 0.00 -0.02 0.00 0.00 31.44 30.06 2dxr n GLU 535 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2dxr n ASP 536 N 0.93 -5.52 -0.10 1.62 8.00 -0.05 -4.84 116.55 116.59 2dxr n ASP 536 Ca 0.17 0.48 -0.09 0.00 0.71 0.00 0.00 54.79 56.06 2dxr n ASP 536 Cb 0.44 -4.72 -0.02 0.00 -0.02 0.00 0.00 41.12 36.80 2dxr n ASP 536 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2dxr h VAL 537 N 0.00 1.15 -1.61 2.53 2.07 -1.66 -3.45 116.25 115.27 2dxr h VAL 537 Ca -0.40 -0.43 -0.54 0.00 0.82 0.00 0.00 66.70 66.16 2dxr h VAL 537 Cb 1.32 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 31.87 2dxr h VAL 537 CO 0.58 0.16 -0.47 -0.83 0.02 0.00 0.00 177.57 177.03 2dxr s GLY 538 N -2.73 2.23 -0.14 2.17 0.00 -0.51 -4.97 107.32 103.36 2dxr s GLY 538 Ca -0.13 -2.01 0.14 0.00 0.00 0.00 0.00 44.72 42.72 2dxr s GLY 538 CO 0.73 -1.83 0.28 1.22 0.00 0.00 0.00 173.10 173.50 2dxr n ASP 539 N -1.31 0.50 -4.09 1.64 8.00 0.40 -4.72 116.55 116.97 2dxr n ASP 539 Ca -0.00 0.15 -0.12 0.00 0.71 0.00 0.00 54.79 55.54 2dxr n ASP 539 Cb 0.63 0.47 -0.11 0.00 -0.02 0.00 0.00 41.12 42.10 2dxr n ASP 539 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2dxr s VAL 540 N -2.53 0.54 -0.06 2.53 0.11 -0.73 -4.38 120.40 115.88 2dxr s VAL 540 Ca -0.10 -1.37 0.01 0.00 -2.93 0.00 0.00 61.98 57.59 2dxr s VAL 540 Cb 0.07 -0.96 0.02 0.00 -1.53 0.00 0.00 36.38 33.98 2dxr s VAL 540 CO 0.81 -0.57 -0.04 0.00 -3.33 0.00 0.00 175.10 171.97 2dxr s ALA 541 N -2.21 0.76 -0.55 1.54 0.00 -0.27 -0.12 121.76 120.91 2dxr s ALA 541 Ca -0.03 -0.13 -0.13 0.00 0.00 0.00 0.00 51.96 51.67 2dxr s ALA 541 Cb -0.04 -0.53 0.14 0.00 0.00 0.00 0.00 23.12 22.69 2dxr s ALA 541 CO -0.02 -0.12 0.48 -0.06 0.00 0.00 0.00 175.76 176.05 2dxr s PHE 542 N 1.15 3.36 0.00 0.00 0.08 -0.68 0.41 117.98 122.31 2dxr s PHE 542 Ca -0.07 -1.58 0.00 0.00 0.12 0.00 0.00 56.93 55.39 2dxr s PHE 542 Cb -0.14 -3.69 0.00 0.00 -0.57 0.00 0.00 43.02 38.62 2dxr s PHE 542 CO -0.01 -1.00 0.00 1.33 -0.10 0.00 0.00 175.22 175.43 2dxr n VAL 543 N 4.96 0.00 -4.42 -0.44 0.24 -0.87 -3.68 118.33 114.12 2dxr n VAL 543 Ca -0.09 0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 61.98 2dxr n VAL 543 Cb 0.41 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.69 2dxr n VAL 543 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 2dxr s LYS 544 N 1.51 1.85 0.34 7.34 -2.85 -1.26 -0.92 119.74 125.75 2dxr s LYS 544 Ca 0.00 -1.68 0.08 0.00 -1.00 0.00 0.00 55.97 53.37 2dxr s LYS 544 Cb 0.00 -1.87 0.80 0.00 -2.06 0.00 0.00 37.83 34.70 2dxr s LYS 544 CO 0.00 0.33 1.85 -0.97 0.10 0.00 0.00 175.35 176.66 2dxr h ASN 545 N 2.16 0.69 0.13 0.03 -1.24 -1.71 -0.72 115.58 114.91 2dxr h ASN 545 Ca -0.41 0.05 -0.02 0.00 0.71 0.00 0.00 56.30 56.62 2dxr h ASN 545 Cb 1.26 -0.08 -0.00 0.00 0.73 0.00 0.00 38.32 40.22 2dxr h ASN 545 CO 0.60 0.33 -0.12 0.44 -1.29 0.00 0.00 177.43 177.39 2dxr h ASP 546 N 0.71 0.00 -0.27 1.15 5.19 -1.96 -2.96 116.42 118.29 2dxr h ASP 546 Ca 0.48 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.75 2dxr h ASP 546 Cb 0.77 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.27 2dxr h ASP 546 CO -0.24 0.12 -0.33 0.74 -3.12 0.00 0.00 179.24 176.41 2dxr h THR 547 N 0.00 1.28 0.02 0.35 2.02 -1.53 -1.24 112.91 113.81 2dxr h THR 547 Ca -0.00 -1.48 -0.00 0.00 0.77 0.00 0.00 66.41 65.69 2dxr h THR 547 Cb 0.22 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 2dxr h THR 547 CO 0.02 0.49 -0.01 0.58 0.37 0.00 0.00 175.52 176.97 2dxr h VAL 548 N 0.66 1.21 -0.09 3.16 2.07 -1.63 -2.80 116.25 118.83 2dxr h VAL 548 Ca 0.07 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 66.93 2dxr h VAL 548 Cb 0.87 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 2dxr h VAL 548 CO 0.08 0.17 -0.05 -0.50 0.02 0.00 0.00 177.57 177.29 2dxr h TRP 549 N -0.31 -0.11 0.00 1.57 4.06 -1.59 -2.80 115.95 116.76 2dxr h TRP 549 Ca -0.00 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 2dxr h TRP 549 Cb 0.30 0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.52 2dxr h TRP 549 CO 0.02 -0.08 -0.05 0.93 -3.56 0.00 0.00 178.44 175.71 2dxr h GLU 550 N -0.04 0.00 -0.10 0.49 5.08 -1.24 -3.03 114.58 115.74 2dxr h GLU 550 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2dxr h GLU 550 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2dxr h GLU 550 CO -0.12 0.05 0.00 0.09 -1.00 0.00 0.00 179.01 178.03 2dxr n ASN 551 N -3.53 2.71 -4.36 1.42 3.02 -1.06 -3.64 115.26 109.83 2dxr n ASN 551 Ca -0.02 -2.74 -0.18 0.00 -0.03 0.00 0.00 54.58 51.61 2dxr n ASN 551 Cb 0.16 -0.35 -0.10 0.00 -0.61 0.00 0.00 39.78 38.88 2dxr n ASN 551 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2dxr s THR 552 N -2.30 1.00 -1.32 3.41 -4.23 -1.07 -4.73 115.64 106.41 2dxr s THR 552 Ca 0.27 -2.02 -0.07 0.00 -1.18 0.00 0.00 61.69 58.69 2dxr s THR 552 Cb 0.22 -2.49 -0.00 0.00 1.34 0.00 0.00 72.50 71.57 2dxr s THR 552 CO 0.05 -0.20 0.56 0.59 -0.54 0.00 0.00 174.62 175.08 2dxr n ASN 553 N -0.49 -1.85 -1.05 3.99 4.13 0.73 -2.77 115.26 117.96 2dxr n ASN 553 Ca -0.04 -1.00 -0.14 0.00 1.68 0.00 0.00 54.58 55.09 2dxr n ASN 553 Cb 0.65 -3.23 -0.06 0.00 -1.54 0.00 0.00 39.78 35.60 2dxr n ASN 553 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2dxr n GLY 554 N -1.86 1.39 0.11 7.41 0.00 -1.26 -4.88 105.19 106.10 2dxr n GLY 554 Ca -0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 46.02 45.56 2dxr n GLY 554 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dxr h GLU 555 N 0.04 0.00 0.03 1.61 4.39 -1.75 -3.38 114.58 115.51 2dxr h GLU 555 Ca -0.28 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.05 2dxr h GLU 555 Cb 1.03 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.63 2dxr h GLU 555 CO 0.41 0.72 -2.25 0.45 -1.16 0.00 0.00 179.01 177.19 2dxr n SER 556 N -3.46 1.41 0.00 1.42 2.88 -1.24 -4.93 113.62 109.70 2dxr n SER 556 Ca 0.00 0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 2dxr n SER 556 Cb 0.76 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 2dxr n SER 556 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2dxr n THR 557 N -3.16 0.00 -2.29 2.46 -2.24 -1.26 -4.92 114.28 102.86 2dxr n THR 557 Ca -0.36 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.07 2dxr n THR 557 Cb 1.05 -0.42 -0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2dxr n THR 557 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dxr s ALA 558 N -0.97 2.73 0.41 6.98 0.00 -1.26 -4.76 121.76 124.89 2dxr s ALA 558 Ca 0.00 0.81 0.11 0.00 0.00 0.00 0.00 51.96 52.88 2dxr s ALA 558 Cb 0.00 -3.35 0.93 0.00 0.00 0.00 0.00 23.12 20.70 2dxr s ALA 558 CO 0.00 -0.71 1.97 0.38 0.00 0.00 0.00 175.76 177.39 2dxr h ASP 559 N 1.30 0.48 1.13 0.00 2.03 -2.00 0.39 116.42 119.74 2dxr h ASP 559 Ca -0.50 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 55.81 2dxr h ASP 559 Cb 1.26 -0.09 0.00 0.00 -0.83 0.00 0.00 39.33 39.67 2dxr h ASP 559 CO 0.57 0.29 -0.57 4.11 -1.03 0.00 0.00 179.24 182.62 2dxr h TRP 560 N 0.53 0.00 0.00 4.15 5.08 -2.00 -3.36 115.95 120.35 2dxr h TRP 560 Ca 0.30 0.00 -0.10 0.00 1.08 0.00 0.00 58.89 60.17 2dxr h TRP 560 Cb 0.47 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.61 2dxr h TRP 560 CO -0.00 0.00 -1.85 0.00 -1.28 0.00 0.00 178.44 175.31 2dxr n ALA 561 N -1.96 2.25 0.00 0.11 0.00 -0.79 -4.66 120.51 115.46 2dxr n ALA 561 Ca 0.03 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2dxr n ALA 561 Cb 0.48 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2dxr n ALA 561 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dxr n LYS 562 N -2.24 0.00 -0.65 0.00 5.02 0.13 -0.31 118.16 120.11 2dxr n LYS 562 Ca -0.11 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.23 2dxr n LYS 562 Cb 0.63 0.00 0.29 0.00 -0.02 0.00 0.00 35.03 35.93 2dxr n LYS 562 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2dxr n ASN 563 N -3.62 4.30 -4.70 4.39 3.02 -1.26 -4.33 115.26 113.05 2dxr n ASN 563 Ca 0.00 -3.10 -0.41 0.00 -0.03 0.00 0.00 54.58 51.04 2dxr n ASN 563 Cb 0.00 -0.61 -0.04 0.00 -0.61 0.00 0.00 39.78 38.52 2dxr n ASN 563 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2dxr s LEU 564 N -2.88 4.31 -0.18 3.41 1.43 0.58 -4.99 118.68 120.36 2dxr s LEU 564 Ca 0.47 1.41 -0.05 0.00 -1.03 0.00 0.00 54.13 54.93 2dxr s LEU 564 Cb 0.38 -3.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.22 2dxr s LEU 564 CO 0.10 -0.25 0.00 -0.54 0.23 0.00 0.00 176.35 175.90 2dxr s LYS 565 N 1.20 3.72 0.31 1.70 1.02 -1.26 -0.19 119.74 126.24 2dxr s LYS 565 Ca 0.45 -0.48 0.08 0.00 0.02 0.00 0.00 55.97 56.04 2dxr s LYS 565 Cb -0.19 -3.06 0.83 0.00 -0.52 0.00 0.00 37.83 34.89 2dxr s LYS 565 CO 0.21 0.14 1.75 0.00 -0.92 0.00 0.00 175.35 176.54 2dxr h ARG 566 N 7.06 0.64 0.00 1.68 3.08 -1.91 0.42 114.38 125.35 2dxr h ARG 566 Ca -0.34 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.67 2dxr h ARG 566 Cb 1.18 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2dxr h ARG 566 CO 0.63 0.42 0.14 0.93 -1.07 0.00 0.00 179.97 181.02 2dxr h GLU 567 N 0.66 0.00 -0.30 0.04 3.07 -2.02 0.96 114.58 116.99 2dxr h GLU 567 Ca 0.62 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.48 2dxr h GLU 567 Cb 1.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 2dxr h GLU 567 CO -0.44 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 176.92 2dxr n ASP 568 N -2.86 2.26 -4.26 1.42 8.00 0.14 -4.87 116.55 116.38 2dxr n ASP 568 Ca -0.02 -1.86 -0.26 0.00 0.71 0.00 0.00 54.79 53.36 2dxr n ASP 568 Cb 0.19 -0.20 -0.14 0.00 -0.02 0.00 0.00 41.12 40.96 2dxr n ASP 568 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2dxr s PHE 569 N -1.61 1.84 0.04 1.24 0.08 0.33 -1.27 117.98 118.62 2dxr s PHE 569 Ca 0.33 -0.38 0.06 0.00 0.12 0.00 0.00 56.93 57.06 2dxr s PHE 569 Cb 0.18 -1.08 -0.02 0.00 -0.57 0.00 0.00 43.02 41.52 2dxr s PHE 569 CO 0.25 0.11 -0.17 1.03 -0.10 0.00 0.00 175.22 176.34 2dxr s ARG 570 N -1.27 1.18 0.25 0.44 1.81 -0.74 -4.35 118.95 116.27 2dxr s ARG 570 Ca 0.08 -0.84 -0.23 0.00 -1.72 0.00 0.00 55.73 53.02 2dxr s ARG 570 Cb -0.09 -1.24 -0.09 0.00 -0.45 0.00 0.00 34.95 33.08 2dxr s ARG 570 CO 0.02 0.31 0.81 -0.51 -0.68 0.00 0.00 175.30 175.26 2dxr s LEU 571 N -1.11 4.40 -0.24 2.53 1.43 0.13 -1.57 118.68 124.24 2dxr s LEU 571 Ca 0.05 1.62 -0.11 0.00 -1.03 0.00 0.00 54.13 54.66 2dxr s LEU 571 Cb -0.08 -3.68 -0.05 0.00 0.03 0.00 0.00 46.19 42.41 2dxr s LEU 571 CO 0.01 0.03 0.17 -0.76 0.23 0.00 0.00 176.35 176.04 2dxr s LEU 572 N -1.83 4.11 0.22 1.79 1.43 -0.45 -2.00 118.68 121.94 2dxr s LEU 572 Ca 0.44 0.12 0.05 0.00 -1.03 0.00 0.00 54.13 53.71 2dxr s LEU 572 Cb -0.19 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 43.88 2dxr s LEU 572 CO 0.23 0.05 0.30 0.00 0.23 0.00 0.00 176.35 177.16 2dxr n LEU 574 N -1.12 0.44 -1.06 0.00 4.77 -1.26 -2.46 117.00 116.31 2dxr n LEU 574 Ca -0.08 0.63 0.06 0.00 -0.03 0.00 0.00 56.01 56.58 2dxr n LEU 574 Cb 0.56 -0.59 0.22 0.00 -2.33 0.00 0.00 43.42 41.28 2dxr n LEU 574 CO 0.45 -0.53 0.64 -0.90 -1.33 0.00 0.00 177.39 175.72 2dxr n ASP 575 N -2.01 3.06 0.00 -1.43 5.75 -1.26 -4.90 116.55 115.76 2dxr n ASP 575 Ca 0.02 -2.27 0.00 0.00 -0.01 0.00 0.00 54.79 52.53 2dxr n ASP 575 Cb 0.17 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.81 2dxr n ASP 575 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dxr n GLY 576 N 0.79 1.70 3.92 6.12 0.00 -1.03 -5.04 105.19 111.65 2dxr n GLY 576 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 2dxr n GLY 576 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dxr s THR 577 N -2.80 2.13 -0.06 2.61 2.01 -1.26 -4.66 115.64 113.61 2dxr s THR 577 Ca 0.00 -0.15 0.00 0.00 0.31 0.00 0.00 61.69 61.85 2dxr s THR 577 Cb 0.00 -2.98 0.02 0.00 0.01 0.00 0.00 72.50 69.55 2dxr s THR 577 CO 0.00 0.00 -0.04 -0.13 -0.69 0.00 0.00 174.62 173.76 2dxr s ARG 578 N -5.45 0.89 0.18 4.92 0.52 -1.26 -2.75 118.95 116.00 2dxr s ARG 578 Ca 0.63 -0.08 0.07 0.00 -0.52 0.00 0.00 55.73 55.83 2dxr s ARG 578 Cb -0.10 -1.00 -0.04 0.00 0.52 0.00 0.00 34.95 34.33 2dxr s ARG 578 CO 0.47 -0.16 -0.14 0.15 0.02 0.00 0.00 175.30 175.64 2dxr s LYS 579 N 1.31 1.25 0.83 3.54 1.02 -0.85 -4.96 119.74 121.88 2dxr s LYS 579 Ca -0.05 -1.52 -0.13 0.00 0.02 0.00 0.00 55.97 54.30 2dxr s LYS 579 Cb -0.14 -1.03 0.10 0.00 -0.52 0.00 0.00 37.83 36.24 2dxr s LYS 579 CO -0.02 0.17 1.19 -2.14 -0.92 0.00 0.00 175.35 173.63 2dxr s PRO 580 N -3.49 1.50 0.00 -1.68 0.02 -1.26 0.22 135.00 130.30 2dxr s PRO 580 Ca 0.20 1.71 0.21 0.00 0.02 0.00 0.00 61.00 63.14 2dxr s PRO 580 Cb -0.01 -1.76 1.23 0.00 0.02 0.00 0.00 34.50 33.98 2dxr s PRO 580 CO 0.05 -2.31 1.67 1.33 -0.33 0.00 0.00 177.00 177.42 2dxr n VAL 581 N -3.51 0.00 0.61 3.83 0.24 -1.26 -1.41 118.33 116.83 2dxr n VAL 581 Ca 0.13 0.00 0.12 0.00 -2.04 0.00 0.00 64.34 62.55 2dxr n VAL 581 Cb 0.51 -0.51 0.23 0.00 -1.47 0.00 0.00 33.84 32.60 2dxr n VAL 581 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2dxr n THR 582 N -0.90 0.39 -1.47 3.34 -2.24 -1.26 -4.04 114.28 108.09 2dxr n THR 582 Ca 0.15 -0.26 -0.25 0.00 -2.27 0.00 0.00 64.05 61.42 2dxr n THR 582 Cb 0.07 -0.22 0.11 0.00 -2.10 0.00 0.00 70.33 68.19 2dxr n THR 582 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dxr n GLU 583 N -2.11 2.63 0.25 -0.78 4.71 -0.50 -4.66 120.64 120.17 2dxr n GLU 583 Ca 0.04 -3.39 0.12 0.00 -0.01 0.00 0.00 57.16 53.91 2dxr n GLU 583 Cb 0.43 -2.18 0.64 0.00 -1.01 0.00 0.00 31.44 29.32 2dxr n GLU 583 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2dxr h ALA 584 N 1.65 1.19 0.00 0.62 0.00 -1.76 -2.73 119.26 118.24 2dxr h ALA 584 Ca 0.50 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2dxr h ALA 584 Cb 1.51 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.28 2dxr h ALA 584 CO 1.12 0.20 0.00 0.37 0.00 0.00 0.00 179.25 180.93 2dxr h GLN 585 N 0.00 0.00 0.00 0.00 5.75 -1.94 -3.05 115.11 115.87 2dxr h GLN 585 Ca -0.00 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2dxr h GLN 585 Cb 0.47 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.02 2dxr h GLN 585 CO 0.02 0.00 -0.12 -1.13 -2.65 0.00 0.00 178.83 174.95 2dxr n SER 586 N -2.50 1.90 -2.73 -0.69 3.41 -1.04 -4.83 113.62 107.15 2dxr n SER 586 Ca 0.03 -2.93 -0.08 0.00 -0.26 0.00 0.00 58.87 55.63 2dxr n SER 586 Cb 0.32 -0.39 0.07 0.00 -0.26 0.00 0.00 64.21 63.94 2dxr n SER 586 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dxr s HIS 588 N 0.50 1.05 -0.10 0.00 -0.00 -1.25 -4.74 115.29 110.74 2dxr s HIS 588 Ca 0.28 -0.88 0.14 0.00 -0.00 0.00 0.00 55.06 54.60 2dxr s HIS 588 Cb 0.25 -0.58 -0.00 0.00 -0.00 0.00 0.00 32.58 32.25 2dxr s HIS 588 CO -0.18 -0.08 1.37 -0.07 -0.00 0.00 0.00 174.74 175.78 2dxr h LEU 589 N 2.88 0.00 0.00 5.38 3.38 -1.71 -3.44 115.31 121.80 2dxr h LEU 589 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2dxr h LEU 589 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2dxr h LEU 589 CO 0.64 0.60 0.00 0.00 0.09 0.00 0.00 178.44 179.77 2dxr n ALA 590 N -2.26 0.00 -2.83 1.53 0.00 -1.25 -5.01 120.51 110.68 2dxr n ALA 590 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2dxr n ALA 590 Cb 0.78 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.16 2dxr n ALA 590 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2dxr s VAL 591 N -2.00 5.35 -0.00 0.00 0.11 -1.26 -0.39 120.40 122.20 2dxr s VAL 591 Ca 0.00 0.15 0.06 0.00 -2.93 0.00 0.00 61.98 59.27 2dxr s VAL 591 Cb 0.00 -3.34 -0.03 0.00 -1.53 0.00 0.00 36.38 31.48 2dxr s VAL 591 CO 0.00 0.58 -0.20 0.00 -3.33 0.00 0.00 175.10 172.15 2dxr s ALA 592 N -0.71 2.47 0.25 1.54 0.00 0.26 -4.89 121.76 120.68 2dxr s ALA 592 Ca 0.13 -1.11 -0.30 0.00 0.00 0.00 0.00 51.96 50.68 2dxr s ALA 592 Cb -0.12 -0.74 -0.10 0.00 0.00 0.00 0.00 23.12 22.16 2dxr s ALA 592 CO 0.03 0.55 1.46 -1.25 0.00 0.00 0.00 175.76 176.55 2dxr s PRO 593 N -0.97 4.25 0.77 0.00 0.04 -1.26 -0.48 135.00 137.34 2dxr s PRO 593 Ca 0.12 2.33 -0.15 0.00 0.04 0.00 0.00 61.00 63.34 2dxr s PRO 593 Cb -0.10 -3.10 -0.02 0.00 0.04 0.00 0.00 34.50 31.31 2dxr s PRO 593 CO 0.02 -0.45 0.56 0.09 0.04 0.00 0.00 177.00 177.25 2dxr n ASN 594 N 2.42 -1.17 -4.75 6.66 3.02 -1.26 -4.33 115.26 115.85 2dxr n ASN 594 Ca 0.07 0.55 -0.41 0.00 -0.03 0.00 0.00 54.58 54.76 2dxr n ASN 594 Cb 0.40 -1.24 -0.02 0.00 -0.61 0.00 0.00 39.78 38.31 2dxr n ASN 594 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2dxr s HIS 595 N -1.99 2.89 0.13 3.10 3.76 -1.26 -4.52 115.29 117.40 2dxr s HIS 595 Ca 0.65 0.92 0.09 0.00 -0.15 0.00 0.00 55.06 56.56 2dxr s HIS 595 Cb -0.32 -3.94 -0.04 0.00 1.11 0.00 0.00 32.58 29.39 2dxr s HIS 595 CO 0.59 -3.09 -0.21 0.00 -0.85 0.00 0.00 174.74 171.18 2dxr s ALA 596 N -0.02 1.97 0.03 -1.40 0.00 -0.04 -1.39 121.76 120.91 2dxr s ALA 596 Ca 0.61 -1.38 -0.30 0.00 0.00 0.00 0.00 51.96 50.89 2dxr s ALA 596 Cb -0.45 -0.24 -0.05 0.00 0.00 0.00 0.00 23.12 22.39 2dxr s ALA 596 CO 0.46 0.33 1.19 0.08 0.00 0.00 0.00 175.76 177.82 2dxr s VAL 597 N -1.52 4.15 0.33 0.00 1.01 0.30 0.92 120.40 125.60 2dxr s VAL 597 Ca 0.11 1.53 0.09 0.00 0.00 0.00 0.00 61.98 63.71 2dxr s VAL 597 Cb -0.08 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 2dxr s VAL 597 CO 0.06 0.09 -0.01 0.68 0.00 0.00 0.00 175.10 175.91 2dxr s VAL 598 N 1.38 2.63 0.20 2.92 -7.23 -0.03 -0.51 120.40 119.76 2dxr s VAL 598 Ca 0.58 -2.02 -0.23 0.00 -1.81 0.00 0.00 61.98 58.49 2dxr s VAL 598 Cb -0.28 -2.75 0.05 0.00 0.56 0.00 0.00 36.38 33.96 2dxr s VAL 598 CO 0.27 -0.22 0.88 -0.94 -0.31 0.00 0.00 175.10 174.78 2dxr s SER 599 N -3.69 -0.19 0.51 4.85 1.04 -0.93 -2.95 113.70 112.34 2dxr s SER 599 Ca 0.34 -0.51 -0.22 0.00 0.48 0.00 0.00 55.95 56.04 2dxr s SER 599 Cb -0.01 0.58 -0.06 0.00 0.10 0.00 0.00 66.02 66.63 2dxr s SER 599 CO 0.19 -1.08 1.30 -0.13 0.98 0.00 0.00 173.24 174.50 2dxr s ARG 600 N -3.42 3.39 0.31 4.02 0.52 -1.26 -0.02 118.95 122.49 2dxr s ARG 600 Ca 0.12 2.11 -0.00 0.00 -0.52 0.00 0.00 55.73 57.44 2dxr s ARG 600 Cb -0.03 -2.35 0.50 0.00 0.52 0.00 0.00 34.95 33.59 2dxr s ARG 600 CO 0.04 -0.95 1.94 0.66 0.02 0.00 0.00 175.30 177.02 2dxr h SER 601 N 1.74 0.82 0.24 0.23 4.64 -1.92 -0.96 113.55 118.35 2dxr h SER 601 Ca -0.50 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2dxr h SER 601 Cb 1.28 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2dxr h SER 601 CO 0.59 0.65 0.00 -0.90 -0.87 0.00 0.00 176.83 176.30 2dxr n ASP 602 N -4.38 0.00 -0.00 4.97 5.75 -1.26 -2.73 116.55 118.89 2dxr n ASP 602 Ca 0.07 0.40 0.02 0.00 -0.01 0.00 0.00 54.79 55.26 2dxr n ASP 602 Cb 0.09 -0.43 -0.03 0.00 -1.03 0.00 0.00 41.12 39.72 2dxr n ASP 602 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2dxr n ARG 603 N -1.43 2.64 -0.31 0.11 5.12 -0.43 -4.78 116.66 117.58 2dxr n ARG 603 Ca 0.03 -0.02 0.01 0.00 -1.93 0.00 0.00 57.85 55.93 2dxr n ARG 603 Cb 0.09 -0.91 0.07 0.00 -1.16 0.00 0.00 32.46 30.55 2dxr n ARG 603 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dxr h ALA 604 N 0.44 0.33 -0.93 7.54 0.00 -1.19 -1.22 119.26 124.23 2dxr h ALA 604 Ca 0.00 0.29 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2dxr h ALA 604 Cb 0.14 0.79 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 2dxr h ALA 604 CO 0.00 -0.52 0.61 0.00 0.00 0.00 0.00 179.25 179.34 2dxr h ALA 605 N 1.55 1.18 -0.16 0.00 0.00 -1.86 0.46 119.26 120.43 2dxr h ALA 605 Ca 0.36 -0.07 -0.21 0.00 0.00 0.00 0.00 54.91 54.99 2dxr h ALA 605 Cb 0.61 -0.38 0.01 0.00 0.00 0.00 0.00 17.79 18.03 2dxr h ALA 605 CO -0.88 0.58 -0.73 1.25 0.00 0.00 0.00 179.25 179.47 2dxr h HIS 606 N 1.26 0.97 -0.72 0.00 6.17 -1.62 -1.95 115.15 119.26 2dxr h HIS 606 Ca 0.34 -0.41 -0.06 0.00 0.71 0.00 0.00 60.37 60.95 2dxr h HIS 606 Cb -0.14 -0.16 -0.03 0.00 2.52 0.00 0.00 27.41 29.61 2dxr h HIS 606 CO -0.01 1.23 0.22 0.28 0.71 0.00 0.00 177.93 180.36 2dxr h VAL 607 N 0.51 1.26 0.11 5.26 2.07 -0.69 -2.72 116.25 122.04 2dxr h VAL 607 Ca -0.04 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 2dxr h VAL 607 Cb 1.35 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2dxr h VAL 607 CO 0.15 0.36 -0.05 -0.08 0.02 0.00 0.00 177.57 177.96 2dxr h GLU 608 N 1.07 -0.14 -0.07 1.57 4.81 -0.65 -1.45 114.58 119.73 2dxr h GLU 608 Ca 0.23 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.48 2dxr h GLU 608 Cb 0.32 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2dxr h GLU 608 CO -0.01 0.05 0.02 0.37 -0.73 0.00 0.00 179.01 178.72 2dxr h GLN 609 N -0.31 0.05 -0.78 1.92 4.15 -1.34 -1.87 115.11 116.93 2dxr h GLN 609 Ca -0.01 -0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.46 2dxr h GLN 609 Cb 0.25 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.88 2dxr h GLN 609 CO 0.02 0.03 0.47 0.28 -1.93 0.00 0.00 178.83 177.71 2dxr h VAL 610 N 0.05 1.03 -0.43 2.39 2.07 -1.47 -2.74 116.25 117.15 2dxr h VAL 610 Ca 0.03 -0.30 -0.13 0.00 0.82 0.00 0.00 66.70 67.12 2dxr h VAL 610 Cb 0.02 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 2dxr h VAL 610 CO -0.04 0.16 -0.24 -0.07 0.02 0.00 0.00 177.57 177.41 2dxr h LEU 611 N 0.87 0.90 -0.57 2.57 4.07 -0.77 0.62 115.31 123.01 2dxr h LEU 611 Ca 0.34 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2dxr h LEU 611 Cb 0.15 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 41.61 2dxr h LEU 611 CO -0.16 1.10 0.38 -0.07 -1.08 0.00 0.00 178.44 178.60 2dxr h LEU 612 N 0.76 0.66 -0.55 1.67 3.38 -1.28 -1.65 115.31 118.31 2dxr h LEU 612 Ca 0.10 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.94 2dxr h LEU 612 Cb 0.79 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 2dxr h LEU 612 CO 0.07 0.48 -0.08 -0.74 0.09 0.00 0.00 178.44 178.26 2dxr h HIS 613 N 0.78 1.14 -0.82 1.13 2.76 -1.18 -2.52 115.15 116.43 2dxr h HIS 613 Ca 0.21 -0.23 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 2dxr h HIS 613 Cb -0.08 -0.28 -0.04 0.00 1.55 0.00 0.00 27.41 28.55 2dxr h HIS 613 CO -0.03 1.04 0.51 1.96 -1.30 0.00 0.00 177.93 180.11 2dxr h GLN 614 N 0.90 1.10 -0.02 5.26 1.08 -0.63 -2.83 115.11 119.97 2dxr h GLN 614 Ca 0.15 -0.09 -0.19 0.00 -1.45 0.00 0.00 58.65 57.07 2dxr h GLN 614 Cb 0.64 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 2dxr h GLN 614 CO 0.04 0.76 -0.82 -0.56 -0.95 0.00 0.00 178.83 177.30 2dxr h GLN 615 N 1.13 0.26 0.00 1.46 3.07 -1.25 -0.11 115.11 119.67 2dxr h GLN 615 Ca 0.30 -0.26 0.00 0.00 0.09 0.00 0.00 58.65 58.78 2dxr h GLN 615 Cb -0.08 0.07 0.00 0.00 0.08 0.00 0.00 27.48 27.55 2dxr h GLN 615 CO -0.06 0.95 0.01 0.00 0.09 0.00 0.00 178.83 179.82 2dxr h ALA 616 N 0.97 1.01 0.00 0.06 0.00 -1.20 0.34 119.26 120.44 2dxr h ALA 616 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.52 2dxr h ALA 616 Cb 1.42 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.15 2dxr h ALA 616 CO 0.13 -0.01 -2.31 1.28 0.00 0.00 0.00 179.25 178.33 2dxr n LEU 617 N -2.89 1.55 0.00 0.00 4.77 -0.97 -2.02 117.00 117.44 2dxr n LEU 617 Ca -0.03 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 2dxr n LEU 617 Cb 0.07 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 2dxr n LEU 617 CO 0.17 0.69 0.32 0.49 -1.33 0.00 0.00 177.39 177.74 2dxr n PHE 618 N -2.95 0.00 0.00 -1.77 3.72 -0.09 -0.45 117.46 115.92 2dxr n PHE 618 Ca -0.36 -0.21 0.00 0.00 -0.05 0.00 0.00 57.45 56.83 2dxr n PHE 618 Cb 1.02 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.54 2dxr n PHE 618 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dxr n GLY 619 N -0.21 -0.72 0.25 1.37 0.00 0.12 -1.44 105.19 104.56 2dxr n GLY 619 Ca 0.00 -1.59 -0.04 0.00 0.00 0.00 0.00 46.02 44.39 2dxr n GLY 619 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dxr h LYS 620 N 0.00 0.76 -0.20 1.61 3.64 -1.81 -2.47 116.57 118.09 2dxr h LYS 620 Ca 0.00 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.28 2dxr h LYS 620 Cb 0.00 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.61 2dxr h LYS 620 CO 0.00 0.50 -0.08 0.09 -2.27 0.00 0.00 179.45 177.69 2dxr n ASN 621 N -4.70 2.85 -4.60 4.20 5.03 -1.26 -4.89 115.26 111.88 2dxr n ASN 621 Ca 0.06 -3.37 -0.32 0.00 0.87 0.00 0.00 54.58 51.81 2dxr n ASN 621 Cb 0.07 -0.55 0.15 0.00 -1.02 0.00 0.00 39.78 38.43 2dxr n ASN 621 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2dxr n GLY 622 N -0.99 -0.78 0.27 7.41 0.00 -0.93 -4.87 105.19 105.30 2dxr n GLY 622 Ca 0.24 -0.69 0.05 0.00 0.00 0.00 0.00 46.02 45.62 2dxr n GLY 622 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dxr h LYS 623 N -1.65 0.39 -0.10 1.61 1.57 -1.12 -3.16 116.57 114.11 2dxr h LYS 623 Ca -0.44 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2dxr h LYS 623 Cb 1.28 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2dxr h LYS 623 CO 0.40 0.26 0.00 0.09 -0.57 0.00 0.00 179.45 179.63 2dxr n ASN 624 N -5.03 2.64 0.00 0.86 3.02 0.41 -4.89 115.26 112.26 2dxr n ASN 624 Ca 0.14 -2.61 0.00 0.00 -0.03 0.00 0.00 54.58 52.08 2dxr n ASN 624 Cb 0.41 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.28 2dxr n ASN 624 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dxr h PRO 626 N 0.00 -0.08 0.56 0.00 0.11 -1.84 -2.16 132.00 128.59 2dxr h PRO 626 Ca 0.00 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2dxr h PRO 626 Cb 0.00 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 2dxr h PRO 626 CO 0.00 -0.05 -0.45 -0.44 -0.21 0.00 0.00 178.00 176.85 2dxr h ASP 627 N -0.08 -1.19 0.00 -2.05 3.32 -1.91 -3.41 116.42 111.10 2dxr h ASP 627 Ca 0.29 0.08 -0.17 0.00 0.02 0.00 0.00 57.03 57.25 2dxr h ASP 627 Cb 0.57 0.37 -0.03 0.00 0.22 0.00 0.00 39.33 40.47 2dxr h ASP 627 CO -0.83 -0.63 -1.53 0.29 -1.72 0.00 0.00 179.24 174.82 2dxr n LYS 628 N -5.19 0.53 -3.64 3.56 5.02 0.03 -5.07 118.16 113.39 2dxr n LYS 628 Ca -0.12 0.22 -0.11 0.00 -2.02 0.00 0.00 58.31 56.28 2dxr n LYS 628 Cb 0.43 -1.41 -0.07 0.00 -0.02 0.00 0.00 35.03 33.95 2dxr n LYS 628 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2dxr s PHE 629 N -2.73 -0.88 -0.19 2.13 5.36 -0.20 -5.01 117.98 116.46 2dxr s PHE 629 Ca -0.31 1.96 -0.01 0.00 -0.96 0.00 0.00 56.93 57.61 2dxr s PHE 629 Cb 0.08 0.41 0.01 0.00 -0.34 0.00 0.00 43.02 43.18 2dxr s PHE 629 CO 0.43 -0.43 -0.13 0.00 -1.46 0.00 0.00 175.22 173.63 2dxr h LEU 631 N 7.97 0.00 -3.28 0.00 6.46 -1.57 -2.86 115.31 122.02 2dxr h LEU 631 Ca -0.43 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 2dxr h LEU 631 Cb 1.15 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.08 2dxr h LEU 631 CO 0.62 0.00 0.00 0.49 -0.62 0.00 0.00 178.44 178.93 2dxr n PHE 632 N -4.29 1.16 -4.49 1.25 3.72 -1.26 -4.68 117.46 108.87 2dxr n PHE 632 Ca 0.01 -0.79 -0.27 0.00 -0.05 0.00 0.00 57.45 56.35 2dxr n PHE 632 Cb 0.26 -0.32 -0.13 0.00 -0.94 0.00 0.00 39.48 38.34 2dxr n PHE 632 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2dxr s LYS 633 N -2.57 1.38 -0.10 -1.08 3.01 -1.08 -4.51 119.74 114.78 2dxr s LYS 633 Ca 0.43 -1.18 0.04 0.00 -1.01 0.00 0.00 55.97 54.25 2dxr s LYS 633 Cb 0.33 -1.69 0.12 0.00 -1.01 0.00 0.00 37.83 35.59 2dxr s LYS 633 CO 0.12 0.41 0.83 -1.13 0.51 0.00 0.00 175.35 176.09 2dxr n SER 634 N 1.27 -0.68 -3.58 2.83 3.41 -1.26 -4.91 113.62 110.70 2dxr n SER 634 Ca -0.18 -1.40 -0.24 0.00 -0.26 0.00 0.00 58.87 56.79 2dxr n SER 634 Cb 0.53 0.28 0.03 0.00 -0.26 0.00 0.00 64.21 64.79 2dxr n SER 634 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2dxr n GLU 635 N -0.46 -1.30 -0.88 4.33 0.28 -1.26 -1.95 120.64 119.40 2dxr n GLU 635 Ca -0.12 0.72 0.00 0.00 -0.16 0.00 0.00 57.16 57.59 2dxr n GLU 635 Cb 0.61 -4.09 0.00 0.00 1.43 0.00 0.00 31.44 29.39 2dxr n GLU 635 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 2dxr n THR 636 N -3.41 0.00 1.03 3.84 5.66 -1.26 -4.85 114.28 115.29 2dxr n THR 636 Ca -0.12 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 60.99 2dxr n THR 636 Cb 0.59 -0.55 0.02 0.00 -1.55 0.00 0.00 70.33 68.84 2dxr n THR 636 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2dxr n LYS 637 N -0.92 0.70 -3.66 1.09 5.02 -0.82 -4.87 118.16 114.69 2dxr n LYS 637 Ca 0.00 -0.55 -0.21 0.00 -2.02 0.00 0.00 58.31 55.53 2dxr n LYS 637 Cb 0.22 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.78 2dxr n LYS 637 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2dxr n ASN 638 N -0.67 -1.37 -4.68 4.39 5.03 -1.26 -4.95 115.26 111.76 2dxr n ASN 638 Ca 0.08 -0.80 -0.38 0.00 0.87 0.00 0.00 54.58 54.35 2dxr n ASN 638 Cb 0.40 -4.18 -0.07 0.00 -1.02 0.00 0.00 39.78 34.91 2dxr n ASN 638 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2dxr s LEU 639 N -6.62 4.17 0.00 3.41 1.43 -1.26 -4.43 118.68 115.39 2dxr s LEU 639 Ca 0.01 0.54 0.00 0.00 -1.03 0.00 0.00 54.13 53.65 2dxr s LEU 639 Cb -0.00 -2.52 0.00 0.00 0.03 0.00 0.00 46.19 43.70 2dxr s LEU 639 CO 0.80 -0.06 0.00 0.18 0.23 0.00 0.00 176.35 177.51 2dxr n LEU 640 N 4.33 0.00 -4.14 1.79 4.77 -1.26 -4.77 117.00 117.72 2dxr n LEU 640 Ca -0.08 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.80 2dxr n LEU 640 Cb 0.51 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 2dxr n LEU 640 CO 0.40 0.00 -0.34 -0.36 -1.33 0.00 0.00 177.39 175.76 2dxr s PHE 641 N 0.00 0.78 0.33 -1.77 0.08 -1.26 -4.53 117.98 111.61 2dxr s PHE 641 Ca 0.00 -1.08 -0.28 0.00 0.12 0.00 0.00 56.93 55.69 2dxr s PHE 641 Cb 0.00 -0.48 -0.09 0.00 -0.57 0.00 0.00 43.02 41.88 2dxr s PHE 641 CO 0.00 -0.35 1.19 -0.80 -0.10 0.00 0.00 175.22 175.15 2dxr s ASN 642 N -3.01 6.90 0.59 1.36 0.01 -1.26 -4.44 114.94 115.08 2dxr s ASN 642 Ca 0.15 2.43 0.29 0.00 -0.71 0.00 0.00 52.86 55.01 2dxr s ASN 642 Cb 0.07 -2.63 1.66 0.00 0.41 0.00 0.00 41.25 40.76 2dxr s ASN 642 CO -0.04 -0.42 2.10 0.44 -1.51 0.00 0.00 177.10 177.67 2dxr h ASP 643 N 3.33 0.00 -0.65 -1.22 3.32 -1.91 -2.67 116.42 116.63 2dxr h ASP 643 Ca -0.48 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.25 2dxr h ASP 643 Cb 1.22 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.58 2dxr h ASP 643 CO 0.65 0.00 0.41 -0.46 -1.72 0.00 0.00 179.24 178.12 2dxr n ASN 644 N -3.79 3.54 -4.64 6.45 0.23 -1.26 -4.82 115.26 110.98 2dxr n ASN 644 Ca 0.02 -3.05 -0.41 0.00 -0.53 0.00 0.00 54.58 50.61 2dxr n ASN 644 Cb 0.33 -0.72 -0.05 0.00 -2.08 0.00 0.00 39.78 37.26 2dxr n ASN 644 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2dxr s THR 645 N -2.20 4.92 -0.05 5.53 2.01 -1.01 -4.29 115.64 120.54 2dxr s THR 645 Ca 0.38 1.37 -0.25 0.00 0.31 0.00 0.00 61.69 63.50 2dxr s THR 645 Cb 0.32 -4.03 -0.20 0.00 0.01 0.00 0.00 72.50 68.59 2dxr s THR 645 CO 0.08 -0.00 1.06 -0.08 -0.69 0.00 0.00 174.62 174.98 2dxr h GLU 646 N 7.69 -0.06 -2.99 4.92 4.81 -0.12 -3.46 114.58 125.37 2dxr h GLU 646 Ca -0.26 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.01 2dxr h GLU 646 Cb 1.11 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.43 2dxr h GLU 646 CO 0.82 0.52 0.23 0.00 -0.73 0.00 0.00 179.01 179.85 2dxr s LEU 648 N -2.85 4.48 0.06 0.00 1.43 -1.26 -0.41 118.68 120.13 2dxr s LEU 648 Ca 0.07 1.52 0.06 0.00 -1.03 0.00 0.00 54.13 54.75 2dxr s LEU 648 Cb -0.04 -3.28 -0.04 0.00 0.03 0.00 0.00 46.19 42.86 2dxr s LEU 648 CO -0.01 0.04 -0.09 0.00 0.23 0.00 0.00 176.35 176.53 2dxr s ALA 649 N -0.24 2.98 0.75 4.21 0.00 0.36 -4.63 121.76 125.20 2dxr s ALA 649 Ca 0.39 -1.15 -0.13 0.00 0.00 0.00 0.00 51.96 51.07 2dxr s ALA 649 Cb -0.21 -0.99 0.05 0.00 0.00 0.00 0.00 23.12 21.97 2dxr s ALA 649 CO 0.24 0.63 1.13 0.15 0.00 0.00 0.00 175.76 177.92 2dxr s LYS 650 N -1.90 2.19 -0.24 0.00 1.02 -0.39 -1.27 119.74 119.14 2dxr s LYS 650 Ca 0.20 1.42 -0.16 0.00 0.02 0.00 0.00 55.97 57.45 2dxr s LYS 650 Cb -0.11 -1.87 -0.16 0.00 -0.52 0.00 0.00 37.83 35.17 2dxr s LYS 650 CO 0.11 -1.73 -0.09 1.28 -0.92 0.00 0.00 175.35 174.00 2dxr n LEU 651 N -3.14 2.00 -0.90 3.17 4.77 -1.26 -4.83 117.00 116.80 2dxr n LEU 651 Ca 0.11 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 2dxr n LEU 651 Cb 0.52 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2dxr n LEU 651 CO 0.50 0.49 -0.08 0.61 -1.33 0.00 0.00 177.39 177.57 2dxr n GLY 652 N 1.40 -3.76 0.42 -0.72 0.00 -1.26 -4.83 105.19 96.44 2dxr n GLY 652 Ca -0.44 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2dxr n GLY 652 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dxr n GLY 653 N 0.32 0.88 2.15 -0.02 0.00 -1.26 -4.64 105.19 102.62 2dxr n GLY 653 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2dxr n GLY 653 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dxr n ARG 654 N -2.21 -0.28 -2.03 1.61 1.74 -1.26 -4.75 116.66 109.47 2dxr n ARG 654 Ca 0.00 -0.14 -0.34 0.00 -0.77 0.00 0.00 57.85 56.59 2dxr n ARG 654 Cb 0.00 0.25 0.02 0.00 -1.02 0.00 0.00 32.46 31.72 2dxr n ARG 654 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2dxr s PRO 655 N -2.26 3.08 0.50 5.56 0.04 -1.26 -5.05 135.00 135.61 2dxr s PRO 655 Ca 0.00 1.57 -0.02 0.00 0.04 0.00 0.00 61.00 62.59 2dxr s PRO 655 Cb 0.00 -1.97 -0.00 0.00 0.04 0.00 0.00 34.50 32.57 2dxr s PRO 655 CO 0.00 -1.06 0.76 0.95 0.04 0.00 0.00 177.00 177.69 2dxr s THR 656 N -1.95 3.95 0.42 1.26 -4.23 -1.26 -4.79 115.64 109.04 2dxr s THR 656 Ca 0.71 -0.28 0.12 0.00 -1.18 0.00 0.00 61.69 61.07 2dxr s THR 656 Cb -0.24 -3.50 0.32 0.00 1.34 0.00 0.00 72.50 70.43 2dxr s THR 656 CO 0.33 -0.42 1.97 0.10 -0.54 0.00 0.00 174.62 176.07 2dxr h TYR 657 N 0.19 0.50 -0.13 3.99 -0.00 -1.95 0.25 116.97 119.82 2dxr h TYR 657 Ca -0.46 0.01 -0.13 0.00 0.00 0.00 0.00 58.73 58.15 2dxr h TYR 657 Cb 1.25 -0.16 -0.01 0.00 0.00 0.00 0.00 36.73 37.81 2dxr h TYR 657 CO 0.47 0.24 -0.48 0.93 -0.00 0.00 0.00 178.16 179.32 2dxr h GLU 658 N 0.48 0.33 -0.06 0.10 5.08 -1.95 -1.15 114.58 117.41 2dxr h GLU 658 Ca 0.29 -0.19 -0.24 0.00 -1.00 0.00 0.00 59.36 58.22 2dxr h GLU 658 Cb 0.49 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.77 2dxr h GLU 658 CO -0.08 0.75 -0.90 0.93 -1.00 0.00 0.00 179.01 178.70 2dxr h GLU 659 N 0.27 0.63 -0.32 2.33 5.08 -1.09 0.13 114.58 121.61 2dxr h GLU 659 Ca 0.01 -0.61 -0.00 0.00 -1.00 0.00 0.00 59.36 57.76 2dxr h GLU 659 Cb 0.95 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 2dxr h GLU 659 CO 0.08 1.22 0.19 -0.92 -1.00 0.00 0.00 179.01 178.57 2dxr h TYR 660 N 0.39 0.43 0.00 4.33 3.20 -0.46 -2.81 116.97 122.05 2dxr h TYR 660 Ca -0.08 -0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.62 2dxr h TYR 660 Cb 1.54 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.64 2dxr h TYR 660 CO 0.08 0.32 -0.80 -0.07 -1.64 0.00 0.00 178.16 176.05 2dxr h LEU 661 N 0.41 0.00 0.00 2.82 3.38 -1.25 -3.48 115.31 117.19 2dxr h LEU 661 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2dxr h LEU 661 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2dxr h LEU 661 CO -0.02 0.80 0.00 0.61 0.09 0.00 0.00 178.44 179.92 2dxr n GLY 662 N 1.04 -2.00 0.27 0.83 0.00 0.45 -4.44 105.19 101.33 2dxr n GLY 662 Ca 0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 46.02 44.60 2dxr n GLY 662 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2dxr h THR 663 N 0.00 0.96 -0.10 2.61 2.02 -1.89 -2.10 112.91 114.41 2dxr h THR 663 Ca 0.00 -0.24 0.01 0.00 0.77 0.00 0.00 66.41 66.95 2dxr h THR 663 Cb 0.00 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 2dxr h THR 663 CO 0.00 0.13 -0.20 -0.33 0.37 0.00 0.00 175.52 175.49 2dxr h GLU 664 N 0.71 -0.17 -0.72 6.66 4.39 -1.95 -1.69 114.58 121.82 2dxr h GLU 664 Ca 0.31 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 60.01 2dxr h GLU 664 Cb 0.20 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.86 2dxr h GLU 664 CO -0.19 -0.11 0.38 -0.92 -1.16 0.00 0.00 179.01 177.01 2dxr h TYR 665 N -0.17 0.98 0.00 4.33 3.20 -1.76 -2.64 116.97 120.90 2dxr h TYR 665 Ca 0.02 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 2dxr h TYR 665 Cb 0.23 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 2dxr h TYR 665 CO -0.57 0.69 -0.24 0.28 -1.64 0.00 0.00 178.16 176.67 2dxr h VAL 666 N 1.00 1.06 0.00 1.81 2.07 -1.11 -0.63 116.25 120.45 2dxr h VAL 666 Ca 0.25 -0.87 -0.14 0.00 0.82 0.00 0.00 66.70 66.77 2dxr h VAL 666 Cb 0.04 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 2dxr h VAL 666 CO -0.04 0.24 -0.89 0.71 0.02 0.00 0.00 177.57 177.61 2dxr h THR 667 N 0.00 0.77 -0.11 2.57 1.35 -0.97 -2.59 112.91 113.92 2dxr h THR 667 Ca -0.00 -2.20 -0.01 0.00 -0.55 0.00 0.00 66.41 63.65 2dxr h THR 667 Cb 0.46 2.29 -0.00 0.00 -1.73 0.00 0.00 68.15 69.17 2dxr h THR 667 CO 0.03 0.44 0.04 0.00 -0.25 0.00 0.00 175.52 175.78 2dxr h ALA 668 N 1.44 0.14 -0.49 6.62 0.00 -0.85 -1.21 119.26 124.91 2dxr h ALA 668 Ca -0.07 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2dxr h ALA 668 Cb 1.48 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.21 2dxr h ALA 668 CO 0.06 -0.26 0.04 0.82 0.00 0.00 0.00 179.25 179.91 2dxr h ILE 669 N 0.01 1.26 0.15 0.00 2.04 -1.35 -1.90 117.51 117.72 2dxr h ILE 669 Ca 0.04 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 2dxr h ILE 669 Cb 0.19 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 2dxr h ILE 669 CO -0.00 0.35 -0.07 0.00 0.00 0.00 0.00 178.15 178.43 2dxr h ALA 670 N 0.95 -0.20 -0.76 1.87 0.00 -1.43 -0.02 119.26 119.66 2dxr h ALA 670 Ca 0.14 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.11 2dxr h ALA 670 Cb 0.46 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.24 2dxr h ALA 670 CO 0.02 -0.59 0.36 -0.91 0.00 0.00 0.00 179.25 178.13 2dxr h ASN 671 N -0.26 0.41 0.67 0.00 2.35 -1.20 -1.97 115.58 115.59 2dxr h ASN 671 Ca -0.02 0.09 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 2dxr h ASN 671 Cb 0.20 0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 2dxr h ASN 671 CO 0.03 0.20 -0.51 0.25 -1.65 0.00 0.00 177.43 175.75 2dxr h LEU 672 N 0.55 0.00 0.00 1.61 5.85 -1.09 -2.76 115.31 119.47 2dxr h LEU 672 Ca 0.40 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.12 2dxr h LEU 672 Cb 0.53 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2dxr h LEU 672 CO -0.34 0.51 0.00 0.29 -0.34 0.00 0.00 178.44 178.56 2dxr n LYS 673 N -3.74 0.46 0.12 1.25 4.76 -0.04 -2.94 118.16 118.03 2dxr n LYS 673 Ca -0.01 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.43 2dxr n LYS 673 Cb 0.56 -1.50 0.09 0.00 -1.84 0.00 0.00 35.03 32.34 2dxr n LYS 673 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 2dxr h LYS 674 N 0.00 0.00 -0.16 1.97 2.10 -1.16 -3.26 116.57 116.06 2dxr h LYS 674 Ca 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.61 2dxr h LYS 674 Cb 0.27 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.59 2dxr h LYS 674 CO 0.00 0.66 -0.05 0.00 -2.00 0.00 0.00 179.45 178.06 2dxr h SER 676 N 0.00 0.59 0.00 0.00 0.02 -1.67 -3.50 113.55 108.99 2dxr h SER 676 Ca 0.04 -0.66 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 2dxr h SER 676 Cb 0.50 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.87 2dxr h SER 676 CO 0.02 1.15 0.00 -0.11 -1.14 0.00 0.00 176.83 176.75 2dxr n LEU 681 N -4.25 0.00 -4.20 5.07 7.94 -1.26 -5.15 117.00 115.15 2dxr n LEU 681 Ca -0.08 0.00 -0.41 0.00 -1.11 0.00 0.00 56.01 54.41 2dxr n LEU 681 Cb 0.60 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.49 2dxr n LEU 681 CO 0.46 0.00 0.18 -0.70 -1.11 0.00 0.00 177.39 176.22 2dxr s GLU 682 N 0.00 2.96 0.21 1.96 2.12 -1.26 -5.06 118.70 119.63 2dxr s GLU 682 Ca 0.00 -2.42 -0.20 0.00 0.36 0.00 0.00 54.97 52.70 2dxr s GLU 682 Cb 0.00 -4.02 0.04 0.00 0.26 0.00 0.00 34.13 30.41 2dxr s GLU 682 CO 0.00 -1.22 0.60 0.00 -0.54 0.00 0.00 175.26 174.10 2dxr s ALA 683 N 0.17 -1.21 0.04 6.30 0.00 -1.26 -5.13 121.76 120.67 2dxr s ALA 683 Ca 0.16 -0.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.78 2dxr s ALA 683 Cb -0.17 0.87 -0.06 0.00 0.00 0.00 0.00 23.12 23.75 2dxr s ALA 683 CO -0.05 -0.87 1.41 0.00 0.00 0.00 0.00 175.76 176.25 2dxr h ALA 685 N 7.54 1.07 -0.01 0.00 0.00 -1.91 -3.50 119.26 122.45 2dxr h ALA 685 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2dxr h ALA 685 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2dxr h ALA 685 CO 0.89 -0.07 0.00 1.19 0.00 0.00 0.00 179.25 181.26