#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ds9 n THR 343 N 0.00 3.42 -3.61 -0.72 5.66 -1.26 -4.92 114.28 112.86 2ds9 n THR 343 Ca 0.00 -4.27 -0.24 0.00 -3.05 0.00 0.00 64.05 56.49 2ds9 n THR 343 Cb 0.00 -1.24 -0.17 0.00 -1.55 0.00 0.00 70.33 67.38 2ds9 n THR 343 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 2ds9 s ARG 344 N -3.98 0.06 0.16 1.09 3.52 -1.26 -4.91 118.95 113.63 2ds9 s ARG 344 Ca 0.53 0.04 -0.20 0.00 -0.13 0.00 0.00 55.73 55.97 2ds9 s ARG 344 Cb 0.44 -1.51 -0.08 0.00 -1.56 0.00 0.00 34.95 32.25 2ds9 s ARG 344 CO -0.35 -0.61 0.67 0.08 -0.81 0.00 0.00 175.30 174.29 2ds9 s VAL 345 N 2.17 4.61 -0.24 7.11 1.01 -0.93 -4.97 120.40 129.17 2ds9 s VAL 345 Ca 0.03 1.28 -0.05 0.00 0.00 0.00 0.00 61.98 63.25 2ds9 s VAL 345 Cb -0.15 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2ds9 s VAL 345 CO -0.08 0.36 -0.00 -0.69 0.00 0.00 0.00 175.10 174.69 2ds9 s VAL 346 N -1.34 3.61 0.02 2.92 1.01 -1.26 -1.25 120.40 124.11 2ds9 s VAL 346 Ca 0.37 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.76 2ds9 s VAL 346 Cb -0.18 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2ds9 s VAL 346 CO 0.21 0.33 0.31 0.86 0.00 0.00 0.00 175.10 176.81 2ds9 s TRP 347 N 1.49 3.59 -0.25 5.22 -0.11 0.20 0.11 118.94 129.20 2ds9 s TRP 347 Ca 0.05 0.67 -0.10 0.00 1.22 0.00 0.00 56.10 57.94 2ds9 s TRP 347 Cb -0.15 -2.06 -0.04 0.00 -1.50 0.00 0.00 33.47 29.71 2ds9 s TRP 347 CO -0.01 0.59 0.14 0.00 -4.62 0.00 0.00 176.95 173.06 2ds9 s ALA 349 N 1.36 3.26 -0.50 0.00 0.00 0.12 -4.79 121.76 121.21 2ds9 s ALA 349 Ca 0.07 -0.80 -0.16 0.00 0.00 0.00 0.00 51.96 51.07 2ds9 s ALA 349 Cb -0.15 -1.57 0.09 0.00 0.00 0.00 0.00 23.12 21.49 2ds9 s ALA 349 CO 0.06 0.46 0.45 0.08 0.00 0.00 0.00 175.76 176.82 2ds9 s VAL 350 N -0.46 5.19 0.00 0.00 1.01 -1.26 -1.00 120.40 123.88 2ds9 s VAL 350 Ca 0.08 -1.14 0.00 0.00 0.00 0.00 0.00 61.98 60.92 2ds9 s VAL 350 Cb -0.12 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2ds9 s VAL 350 CO 0.02 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.03 2ds9 n GLY 351 N 5.22 1.51 0.27 4.51 0.00 -0.30 -4.45 105.19 111.95 2ds9 n GLY 351 Ca -0.12 -1.83 0.07 0.00 0.00 0.00 0.00 46.02 44.14 2ds9 n GLY 351 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ds9 h PRO 352 N 0.00 0.17 -0.06 1.61 0.13 -1.92 -2.81 132.00 129.13 2ds9 h PRO 352 Ca 0.00 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 64.99 2ds9 h PRO 352 Cb 0.00 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.08 2ds9 h PRO 352 CO 0.00 0.12 -0.55 0.93 -0.23 0.00 0.00 178.00 178.27 2ds9 h GLU 353 N 0.18 0.17 0.00 0.86 5.08 -1.97 -2.05 114.58 116.84 2ds9 h GLU 353 Ca 0.05 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2ds9 h GLU 353 Cb -0.01 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ds9 h GLU 353 CO -0.01 0.68 -0.35 0.93 -1.00 0.00 0.00 179.01 179.26 2ds9 h GLU 354 N 0.13 0.00 -0.05 2.33 5.08 -1.74 -2.80 114.58 117.53 2ds9 h GLU 354 Ca -0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.13 2ds9 h GLU 354 Cb 1.01 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.28 2ds9 h GLU 354 CO 0.08 0.00 -0.86 0.37 -1.00 0.00 0.00 179.01 177.60 2ds9 h GLN 355 N 0.00 0.68 -0.15 2.33 4.15 -1.24 -1.27 115.11 119.60 2ds9 h GLN 355 Ca 0.00 -0.66 -0.05 0.00 0.77 0.00 0.00 58.65 58.71 2ds9 h GLN 355 Cb 0.93 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.78 2ds9 h GLN 355 CO 0.00 1.26 -0.15 -0.22 -1.93 0.00 0.00 178.83 177.79 2ds9 h LYS 356 N 0.34 0.25 -0.00 1.69 3.64 -1.35 0.59 116.57 121.73 2ds9 h LYS 356 Ca -0.09 -0.06 -0.21 0.00 -1.27 0.00 0.00 60.65 59.01 2ds9 h LYS 356 Cb 1.52 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.30 2ds9 h LYS 356 CO 0.17 0.40 -0.91 -0.22 -2.27 0.00 0.00 179.45 176.62 2ds9 h LYS 357 N 0.24 0.33 -0.18 1.90 3.64 -1.44 -3.04 116.57 118.02 2ds9 h LYS 357 Ca 0.05 -0.36 -0.10 0.00 -1.27 0.00 0.00 60.65 58.97 2ds9 h LYS 357 Cb 0.41 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2ds9 h LYS 357 CO 0.02 1.05 -0.26 0.00 -2.27 0.00 0.00 179.45 177.99 2ds9 h GLN 359 N 0.15 0.98 -0.65 0.00 4.20 -1.00 0.31 115.11 119.11 2ds9 h GLN 359 Ca 0.02 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.60 2ds9 h GLN 359 Cb 0.83 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 28.36 2ds9 h GLN 359 CO 0.06 0.65 0.13 0.37 -0.67 0.00 0.00 178.83 179.37 2ds9 h GLN 360 N 1.01 1.04 -0.63 1.46 4.15 -1.40 -1.45 115.11 119.30 2ds9 h GLN 360 Ca 0.32 -0.25 -0.08 0.00 0.77 0.00 0.00 58.65 59.41 2ds9 h GLN 360 Cb 0.03 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 2ds9 h GLN 360 CO -0.09 0.94 0.09 2.35 -1.93 0.00 0.00 178.83 180.18 2ds9 h TRP 361 N 0.99 1.12 0.39 3.99 7.01 -0.31 -3.01 115.95 126.13 2ds9 h TRP 361 Ca 0.20 -0.16 -0.02 0.00 2.11 0.00 0.00 58.89 61.02 2ds9 h TRP 361 Cb 0.38 -0.30 0.00 0.00 -2.10 0.00 0.00 29.16 27.14 2ds9 h TRP 361 CO 0.03 0.96 -0.19 1.03 -2.79 0.00 0.00 178.44 177.47 2ds9 h SER 362 N 0.96 -0.45 -0.54 2.65 0.87 0.12 -1.52 113.55 115.64 2ds9 h SER 362 Ca 0.19 0.01 0.11 0.00 -1.23 0.00 0.00 61.79 60.87 2ds9 h SER 362 Cb 0.45 0.12 -0.11 0.00 -0.44 0.00 0.00 62.40 62.42 2ds9 h SER 362 CO 0.01 -0.31 -0.16 -0.61 -0.53 0.00 0.00 176.83 175.24 2ds9 h GLN 363 N -0.54 -0.02 0.00 2.24 4.15 -1.33 0.18 115.11 119.79 2ds9 h GLN 363 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2ds9 h GLN 363 Cb 0.41 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.11 2ds9 h GLN 363 CO 0.09 -0.02 0.00 1.96 -1.93 0.00 0.00 178.83 178.93 2ds9 h GLN 364 N -0.02 0.00 -0.09 1.69 1.08 -1.37 -2.70 115.11 113.69 2ds9 h GLN 364 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 2ds9 h GLN 364 Cb 0.42 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 2ds9 h GLN 364 CO -0.57 0.00 0.00 -1.13 -0.95 0.00 0.00 178.83 176.18 2ds9 n SER 365 N -2.33 2.80 -3.74 1.46 3.41 0.59 -4.94 113.62 110.87 2ds9 n SER 365 Ca 0.01 -1.91 -0.25 0.00 -0.26 0.00 0.00 58.87 56.46 2ds9 n SER 365 Cb 0.19 -0.04 0.04 0.00 -0.26 0.00 0.00 64.21 64.14 2ds9 n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ds9 n GLY 366 N 1.34 -0.42 2.49 5.00 0.00 -0.93 -1.05 105.19 111.63 2ds9 n GLY 366 Ca 0.16 0.17 -0.21 0.00 0.00 0.00 0.00 46.02 46.14 2ds9 n GLY 366 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ds9 n GLN 367 N -4.54 -1.56 0.16 1.61 3.00 -1.06 -4.81 117.38 110.18 2ds9 n GLN 367 Ca -0.12 1.12 0.03 0.00 -0.01 0.00 0.00 57.00 58.01 2ds9 n GLN 367 Cb 0.60 -5.64 0.22 0.00 0.00 0.00 0.00 30.24 25.41 2ds9 n GLN 367 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.06 176.15 2ds9 h ASN 368 N 0.00 0.00 -4.30 1.08 2.35 -1.34 -3.44 115.58 109.94 2ds9 h ASN 368 Ca -0.46 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 54.76 2ds9 h ASN 368 Cb 1.36 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 39.47 2ds9 h ASN 368 CO 0.60 0.50 -0.83 -0.69 -1.65 0.00 0.00 177.43 175.37 2ds9 s VAL 369 N -3.44 1.44 0.18 2.81 1.01 -1.26 -2.19 120.40 118.94 2ds9 s VAL 369 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 60.96 2ds9 s VAL 369 Cb 0.11 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 2ds9 s VAL 369 CO 0.72 0.19 0.06 -0.89 0.00 0.00 0.00 175.10 175.19 2ds9 s THR 370 N -0.72 0.33 0.02 3.92 2.01 -0.38 -4.38 115.64 116.45 2ds9 s THR 370 Ca 0.06 -1.96 0.07 0.00 0.31 0.00 0.00 61.69 60.16 2ds9 s THR 370 Cb -0.08 -2.27 -0.02 0.00 0.01 0.00 0.00 72.50 70.14 2ds9 s THR 370 CO 0.01 -0.29 -0.19 0.00 -0.69 0.00 0.00 174.62 173.46 2ds9 s ALA 372 N -0.69 1.83 0.03 0.00 0.00 0.02 -4.90 121.76 118.05 2ds9 s ALA 372 Ca 0.07 -1.07 0.07 0.00 0.00 0.00 0.00 51.96 51.03 2ds9 s ALA 372 Cb -0.08 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 2ds9 s ALA 372 CO 0.01 0.42 -0.21 0.99 0.00 0.00 0.00 175.76 176.97 2ds9 s THR 373 N -0.77 2.55 0.05 0.00 2.01 -1.26 0.13 115.64 118.35 2ds9 s THR 373 Ca 0.08 -1.19 0.01 0.00 0.31 0.00 0.00 61.69 60.90 2ds9 s THR 373 Cb -0.09 -2.02 -0.03 0.00 0.01 0.00 0.00 72.50 70.37 2ds9 s THR 373 CO 0.02 0.40 -0.05 0.00 -0.69 0.00 0.00 174.62 174.29 2ds9 s ALA 374 N -0.83 0.51 -0.99 7.40 0.00 -0.17 -4.93 121.76 122.75 2ds9 s ALA 374 Ca 0.13 -0.90 0.26 0.00 0.00 0.00 0.00 51.96 51.44 2ds9 s ALA 374 Cb -0.10 0.13 1.10 0.00 0.00 0.00 0.00 23.12 24.26 2ds9 s ALA 374 CO 0.03 -0.16 1.83 0.43 0.00 0.00 0.00 175.76 177.89 2ds9 n SER 375 N 0.98 0.01 -3.96 0.00 7.64 -1.26 -1.15 113.62 115.88 2ds9 n SER 375 Ca -0.20 0.50 -0.09 0.00 1.01 0.00 0.00 58.87 60.10 2ds9 n SER 375 Cb 0.57 -0.50 -0.05 0.00 -1.01 0.00 0.00 64.21 63.22 2ds9 n SER 375 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2ds9 s THR 376 N -3.00 0.00 0.12 0.44 -4.23 -1.26 -4.62 115.64 103.10 2ds9 s THR 376 Ca 0.12 -1.32 -0.15 0.00 -1.18 0.00 0.00 61.69 59.17 2ds9 s THR 376 Cb 0.17 -2.12 -0.02 0.00 1.34 0.00 0.00 72.50 71.86 2ds9 s THR 376 CO 0.48 -0.02 1.57 0.74 -0.54 0.00 0.00 174.62 176.85 2ds9 h THR 377 N 2.23 1.26 -0.10 3.99 2.02 -1.90 -2.40 112.91 118.00 2ds9 h THR 377 Ca -0.26 -0.99 0.04 0.00 0.77 0.00 0.00 66.41 65.98 2ds9 h THR 377 Cb 1.25 1.13 -0.05 0.00 -1.74 0.00 0.00 68.15 68.73 2ds9 h THR 377 CO 0.34 0.33 -0.24 0.44 0.37 0.00 0.00 175.52 176.77 2ds9 h ASP 378 N 0.52 -0.74 -0.71 4.18 3.32 -1.96 -0.14 116.42 120.89 2ds9 h ASP 378 Ca 0.11 0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.29 2ds9 h ASP 378 Cb 0.46 0.32 -0.04 0.00 0.22 0.00 0.00 39.33 40.30 2ds9 h ASP 378 CO 0.02 -0.30 0.47 0.44 -1.72 0.00 0.00 179.24 178.15 2ds9 h ASP 379 N -0.32 0.80 -0.86 6.45 3.32 -1.96 -0.57 116.42 123.28 2ds9 h ASP 379 Ca 0.09 -0.02 0.08 0.00 0.02 0.00 0.00 57.03 57.20 2ds9 h ASP 379 Cb 0.46 -0.20 -0.07 0.00 0.22 0.00 0.00 39.33 39.74 2ds9 h ASP 379 CO -0.29 0.57 0.52 0.00 -1.72 0.00 0.00 179.24 178.33 2ds9 h ILE 381 N 0.91 1.18 -0.26 0.00 2.04 0.39 -2.04 117.51 119.73 2ds9 h ILE 381 Ca 0.40 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.77 2ds9 h ILE 381 Cb 0.27 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.45 2ds9 h ILE 381 CO -0.21 0.17 -0.12 0.58 0.00 0.00 0.00 178.15 178.58 2ds9 h VAL 382 N 0.16 0.62 -0.57 1.67 2.07 -0.40 0.12 116.25 119.93 2ds9 h VAL 382 Ca 0.07 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.73 2ds9 h VAL 382 Cb 0.21 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 2ds9 h VAL 382 CO -0.00 0.00 0.40 -0.07 0.02 0.00 0.00 177.57 177.91 2ds9 h LEU 383 N -0.08 0.11 0.01 2.57 3.38 0.02 0.86 115.31 122.17 2ds9 h LEU 383 Ca 0.14 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.84 2ds9 h LEU 383 Cb 0.29 -0.02 0.02 0.00 0.09 0.00 0.00 40.66 41.04 2ds9 h LEU 383 CO -0.32 0.06 -1.10 0.58 0.09 0.00 0.00 178.44 177.75 2ds9 h VAL 384 N 0.12 1.31 -0.42 1.22 2.07 -0.15 -0.84 116.25 119.55 2ds9 h VAL 384 Ca 0.27 -2.38 0.03 0.00 0.82 0.00 0.00 66.70 65.44 2ds9 h VAL 384 Cb 0.92 2.51 -0.03 0.00 -1.52 0.00 0.00 31.29 33.16 2ds9 h VAL 384 CO -0.03 0.73 0.22 -0.07 0.02 0.00 0.00 177.57 178.43 2ds9 h LEU 385 N 0.32 0.33 -1.80 2.57 3.38 0.10 -1.87 115.31 118.33 2ds9 h LEU 385 Ca -0.14 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2ds9 h LEU 385 Cb 1.76 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.46 2ds9 h LEU 385 CO 0.21 0.23 -0.13 0.11 0.09 0.00 0.00 178.44 178.95 2ds9 h LYS 386 N 0.44 0.00 0.00 1.13 1.57 -0.98 -3.46 116.57 115.27 2ds9 h LYS 386 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2ds9 h LYS 386 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2ds9 h LYS 386 CO -0.12 0.13 0.00 0.41 -0.57 0.00 0.00 179.45 179.31 2ds9 n GLY 387 N -1.04 0.48 0.14 3.86 0.00 -0.71 -4.95 105.19 102.97 2ds9 n GLY 387 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.12 2ds9 n GLY 387 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ds9 h GLU 388 N 4.77 0.00 -4.29 1.61 5.08 -1.43 -3.44 114.58 116.87 2ds9 h GLU 388 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 2ds9 h GLU 388 Cb 0.00 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.09 2ds9 h GLU 388 CO 0.00 0.00 -0.69 0.00 -1.00 0.00 0.00 179.01 177.32 2ds9 s ALA 389 N -3.30 0.55 -0.24 3.43 0.00 -1.09 -4.94 121.76 116.17 2ds9 s ALA 389 Ca 0.05 -1.15 0.08 0.00 0.00 0.00 0.00 51.96 50.95 2ds9 s ALA 389 Cb 0.10 0.23 -0.20 0.00 0.00 0.00 0.00 23.12 23.25 2ds9 s ALA 389 CO 0.46 -0.31 -0.11 -0.25 0.00 0.00 0.00 175.76 175.55 2ds9 n ASP 390 N 0.30 1.22 -3.65 0.00 8.00 0.31 -4.34 116.55 118.38 2ds9 n ASP 390 Ca -0.15 -0.09 -0.10 0.00 0.71 0.00 0.00 54.79 55.17 2ds9 n ASP 390 Cb 0.60 0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 41.82 2ds9 n ASP 390 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ds9 s ALA 391 N -2.51 -1.35 0.25 2.24 0.00 -1.11 -4.08 121.76 115.21 2ds9 s ALA 391 Ca -0.25 0.05 -0.19 0.00 0.00 0.00 0.00 51.96 51.58 2ds9 s ALA 391 Cb 0.08 0.87 0.02 0.00 0.00 0.00 0.00 23.12 24.08 2ds9 s ALA 391 CO 0.69 -0.89 0.62 -0.48 0.00 0.00 0.00 175.76 175.70 2ds9 s LEU 392 N -2.84 -0.08 -0.18 0.00 2.34 -1.17 -1.47 118.68 115.28 2ds9 s LEU 392 Ca 0.06 -0.64 -0.08 0.00 0.06 0.00 0.00 54.13 53.54 2ds9 s LEU 392 Cb -0.03 2.39 -0.04 0.00 -0.56 0.00 0.00 46.19 47.94 2ds9 s LEU 392 CO -0.03 -1.23 0.08 0.21 -1.06 0.00 0.00 176.35 174.32 2ds9 s ASN 393 N -2.93 5.82 0.07 1.48 2.47 -1.26 -0.68 114.94 119.92 2ds9 s ASN 393 Ca 0.13 0.14 0.05 0.00 0.42 0.00 0.00 52.86 53.60 2ds9 s ASN 393 Cb -0.04 -2.00 -0.03 0.00 -1.45 0.00 0.00 41.25 37.74 2ds9 s ASN 393 CO 0.05 0.19 -0.14 -0.76 -3.72 0.00 0.00 177.10 172.72 2ds9 s LEU 394 N 0.30 2.29 0.62 3.21 1.43 0.41 -4.89 118.68 122.05 2ds9 s LEU 394 Ca 0.05 -0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 52.37 2ds9 s LEU 394 Cb -0.12 -0.48 -0.03 0.00 0.03 0.00 0.00 46.19 45.59 2ds9 s LEU 394 CO -0.00 -0.10 1.05 -0.62 0.23 0.00 0.00 176.35 176.91 2ds9 s ASP 395 N -1.82 5.72 0.21 2.29 2.15 -1.26 -0.71 116.67 123.26 2ds9 s ASP 395 Ca -0.01 1.74 -0.10 0.00 0.43 0.00 0.00 52.55 54.61 2ds9 s ASP 395 Cb -0.09 -2.52 0.31 0.00 -0.30 0.00 0.00 42.92 40.32 2ds9 s ASP 395 CO 0.02 -1.21 1.68 1.23 -0.17 0.00 0.00 175.17 176.73 2ds9 h GLY 396 N 0.12 0.75 0.22 2.66 0.00 -1.83 -2.06 103.07 102.93 2ds9 h GLY 396 Ca -0.46 0.02 0.18 0.00 0.00 0.00 0.00 47.33 47.07 2ds9 h GLY 396 CO 0.57 -0.16 0.61 -1.33 0.00 0.00 0.00 176.54 176.24 2ds9 h GLY 397 N 0.20 1.60 1.46 4.60 0.00 -1.88 -1.56 103.07 107.48 2ds9 h GLY 397 Ca 0.33 -0.34 -0.29 0.00 0.00 0.00 0.00 47.33 47.03 2ds9 h GLY 397 CO -0.47 -0.01 -1.28 -0.97 0.00 0.00 0.00 176.54 173.81 2ds9 h TYR 398 N 0.74 0.72 -0.86 5.60 0.05 -1.49 -3.17 116.97 118.56 2ds9 h TYR 398 Ca 0.54 -0.50 0.10 0.00 0.05 0.00 0.00 58.73 58.93 2ds9 h TYR 398 Cb 0.87 -0.04 -0.08 0.00 1.01 0.00 0.00 36.73 38.50 2ds9 h TYR 398 CO -0.00 1.38 0.50 0.82 -1.05 0.00 0.00 178.16 179.81 2ds9 h ILE 399 N 0.14 0.90 -0.55 -2.88 2.04 -0.80 0.47 117.51 116.82 2ds9 h ILE 399 Ca -0.17 -0.28 0.10 0.00 1.00 0.00 0.00 64.86 65.51 2ds9 h ILE 399 Cb 1.98 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.99 2ds9 h ILE 399 CO 0.23 0.15 0.10 0.22 0.00 0.00 0.00 178.15 178.85 2ds9 h TYR 400 N 0.82 0.16 0.08 1.37 3.20 -1.36 0.25 116.97 121.49 2ds9 h TYR 400 Ca 0.42 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.32 2ds9 h TYR 400 Cb 0.41 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.69 2ds9 h TYR 400 CO -0.05 -0.03 -0.04 1.15 -1.64 0.00 0.00 178.16 177.55 2ds9 h THR 401 N 0.23 0.96 -0.98 1.81 2.02 -1.11 -2.91 112.91 112.93 2ds9 h THR 401 Ca 0.28 -0.14 0.07 0.00 0.77 0.00 0.00 66.41 67.39 2ds9 h THR 401 Cb 0.41 1.06 -0.07 0.00 -1.74 0.00 0.00 68.15 67.81 2ds9 h THR 401 CO -0.38 0.04 0.64 0.00 0.37 0.00 0.00 175.52 176.18 2ds9 h ALA 402 N 0.74 1.43 -0.13 6.16 0.00 0.14 -2.41 119.26 125.19 2ds9 h ALA 402 Ca -0.01 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2ds9 h ALA 402 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2ds9 h ALA 402 CO 0.02 0.42 -0.26 0.78 0.00 0.00 0.00 179.25 180.21 2ds9 h GLY 403 N 1.14 0.25 1.59 0.00 0.00 -0.38 -1.05 103.07 104.62 2ds9 h GLY 403 Ca 0.43 -0.19 -0.08 0.00 0.00 0.00 0.00 47.33 47.48 2ds9 h GLY 403 CO -0.17 0.17 -0.19 0.50 0.00 0.00 0.00 176.54 176.85 2ds9 h LYS 404 N 0.21 0.49 -0.02 4.80 1.57 -1.25 -2.67 116.57 119.70 2ds9 h LYS 404 Ca 0.03 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2ds9 h LYS 404 Cb 0.57 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2ds9 h LYS 404 CO 0.04 0.66 0.00 0.00 -0.57 0.00 0.00 179.45 179.58 2ds9 n GLY 406 N 0.76 0.68 3.80 0.00 0.00 -0.96 -5.02 105.19 104.45 2ds9 n GLY 406 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 2ds9 n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ds9 s LEU 407 N 0.00 2.59 -0.00 0.99 1.43 -0.89 -4.04 118.68 118.76 2ds9 s LEU 407 Ca 0.00 1.32 0.02 0.00 -1.03 0.00 0.00 54.13 54.44 2ds9 s LEU 407 Cb 0.00 -3.93 -0.01 0.00 0.03 0.00 0.00 46.19 42.29 2ds9 s LEU 407 CO 0.00 -2.00 -0.07 0.68 0.23 0.00 0.00 176.35 175.20 2ds9 s VAL 408 N -3.14 0.52 0.29 -1.59 -7.23 0.20 -4.40 120.40 105.05 2ds9 s VAL 408 Ca 0.61 -0.28 -0.29 0.00 -1.81 0.00 0.00 61.98 60.20 2ds9 s VAL 408 Cb -0.15 -0.44 -0.10 0.00 0.56 0.00 0.00 36.38 36.26 2ds9 s VAL 408 CO 0.54 0.15 1.29 -2.16 -0.31 0.00 0.00 175.10 174.61 2ds9 s PRO 409 N -0.16 4.39 -0.01 4.82 0.04 -1.26 -1.02 135.00 141.80 2ds9 s PRO 409 Ca 0.03 2.14 -0.07 0.00 0.04 0.00 0.00 61.00 63.13 2ds9 s PRO 409 Cb -0.03 -3.11 -0.02 0.00 0.04 0.00 0.00 34.50 31.38 2ds9 s PRO 409 CO -0.00 -0.16 -0.14 0.28 0.04 0.00 0.00 177.00 177.01 2ds9 n VAL 410 N 1.31 1.32 -4.16 -0.36 0.31 -0.11 -4.90 118.33 111.76 2ds9 n VAL 410 Ca 0.01 0.29 -0.14 0.00 -0.01 0.00 0.00 64.34 64.50 2ds9 n VAL 410 Cb 0.42 -1.89 -0.11 0.00 -0.91 0.00 0.00 33.84 31.36 2ds9 n VAL 410 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2ds9 s LEU 411 N -7.34 2.39 0.24 7.52 1.43 -1.25 -4.34 118.68 117.32 2ds9 s LEU 411 Ca -0.12 -0.79 0.10 0.00 -1.03 0.00 0.00 54.13 52.30 2ds9 s LEU 411 Cb 0.02 -0.25 -0.04 0.00 0.03 0.00 0.00 46.19 45.94 2ds9 s LEU 411 CO 0.17 -0.27 -0.12 0.00 0.23 0.00 0.00 176.35 176.36 2ds9 s ALA 412 N -2.38 2.90 0.23 4.21 0.00 0.30 -1.33 121.76 125.68 2ds9 s ALA 412 Ca 0.03 -1.66 -0.30 0.00 0.00 0.00 0.00 51.96 50.03 2ds9 s ALA 412 Cb -0.03 -0.56 -0.09 0.00 0.00 0.00 0.00 23.12 22.44 2ds9 s ALA 412 CO -0.01 0.35 1.14 -1.21 0.00 0.00 0.00 175.76 176.04 2ds9 s GLU 413 N -3.26 4.57 -0.01 0.00 2.02 -0.85 0.25 118.70 121.42 2ds9 s GLU 413 Ca 0.28 1.83 0.03 0.00 0.02 0.00 0.00 54.97 57.13 2ds9 s GLU 413 Cb -0.07 -3.22 -0.01 0.00 0.10 0.00 0.00 34.13 30.93 2ds9 s GLU 413 CO 0.16 0.06 -0.11 1.21 0.02 0.00 0.00 175.26 176.59 2ds9 s ASN 414 N -0.33 1.37 0.44 -0.19 3.04 0.29 -4.78 114.94 114.78 2ds9 s ASN 414 Ca 0.49 -0.21 0.03 0.00 0.04 0.00 0.00 52.86 53.21 2ds9 s ASN 414 Cb -0.32 -0.19 -0.03 0.00 -1.54 0.00 0.00 41.25 39.17 2ds9 s ASN 414 CO 0.39 0.13 0.06 0.00 -3.04 0.00 0.00 177.10 174.64 2ds9 s ARG 415 N -0.20 2.00 0.78 0.43 1.70 -1.26 0.53 118.95 122.93 2ds9 s ARG 415 Ca 0.03 -2.22 -0.14 0.00 -0.47 0.00 0.00 55.73 52.93 2ds9 s ARG 415 Cb -0.05 -1.12 0.07 0.00 -0.57 0.00 0.00 34.95 33.28 2ds9 s ARG 415 CO -0.00 -0.35 1.21 0.15 -1.08 0.00 0.00 175.30 175.24 2ds9 s LYS 416 N -3.80 1.78 0.10 3.89 1.02 -1.26 -4.84 119.74 116.63 2ds9 s LYS 416 Ca 0.20 1.79 -0.26 0.00 0.02 0.00 0.00 55.97 57.72 2ds9 s LYS 416 Cb 0.04 -1.79 0.08 0.00 -0.52 0.00 0.00 37.83 35.64 2ds9 s LYS 416 CO 0.11 -2.11 0.81 -1.54 -0.92 0.00 0.00 175.35 171.70 2ds9 s SER 417 N -2.07 -0.37 -0.18 2.83 1.04 -1.26 -5.06 113.70 108.63 2ds9 s SER 417 Ca 0.74 -0.15 0.05 0.00 0.48 0.00 0.00 55.95 57.07 2ds9 s SER 417 Cb -0.30 0.49 -0.22 0.00 0.10 0.00 0.00 66.02 66.10 2ds9 s SER 417 CO 0.49 -0.84 0.10 -1.20 0.98 0.00 0.00 173.24 172.77 2ds9 n SER 418 N -0.35 1.43 -4.81 7.02 7.64 -1.26 -4.76 113.62 118.53 2ds9 n SER 418 Ca -0.10 0.05 -0.33 0.00 1.01 0.00 0.00 58.87 59.50 2ds9 n SER 418 Cb 0.62 -0.16 -0.02 0.00 -1.01 0.00 0.00 64.21 63.64 2ds9 n SER 418 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2ds9 s LYS 419 N -2.53 3.63 0.00 1.43 2.36 -1.26 -3.93 119.74 119.44 2ds9 s LYS 419 Ca -0.22 1.20 0.00 0.00 -2.55 0.00 0.00 55.97 54.40 2ds9 s LYS 419 Cb 0.08 -2.08 0.00 0.00 -1.05 0.00 0.00 37.83 34.78 2ds9 s LYS 419 CO 0.72 -0.55 0.00 0.72 1.55 0.00 0.00 175.35 177.79 2ds9 n HIS 420 N -1.55 0.00 -0.33 4.03 8.25 -1.26 -4.89 115.22 119.47 2ds9 n HIS 420 Ca 0.08 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.61 2ds9 n HIS 420 Cb 0.53 -1.08 0.15 0.00 1.12 0.00 0.00 29.99 30.71 2ds9 n HIS 420 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2ds9 h SER 421 N 0.00 -0.80 -1.06 0.41 4.64 -1.86 0.45 113.55 115.33 2ds9 h SER 421 Ca 0.00 0.28 0.30 0.00 -0.47 0.00 0.00 61.79 61.90 2ds9 h SER 421 Cb 0.51 0.56 -0.06 0.00 -0.31 0.00 0.00 62.40 63.11 2ds9 h SER 421 CO 0.00 -0.31 0.74 0.28 -0.87 0.00 0.00 176.83 176.67 2ds9 h SER 422 N 0.01 0.13 -3.72 4.97 0.02 -1.93 -3.42 113.55 109.61 2ds9 h SER 422 Ca 0.47 0.02 -0.50 0.00 -0.84 0.00 0.00 61.79 60.94 2ds9 h SER 422 Cb 0.77 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.30 2ds9 h SER 422 CO -0.95 0.03 0.41 -0.76 -1.14 0.00 0.00 176.83 174.41 2ds9 s LEU 423 N -8.78 4.58 0.44 5.07 1.43 0.15 -5.02 118.68 116.54 2ds9 s LEU 423 Ca -0.06 2.05 -0.24 0.00 -1.03 0.00 0.00 54.13 54.85 2ds9 s LEU 423 Cb 0.23 -3.61 -0.08 0.00 0.03 0.00 0.00 46.19 42.76 2ds9 s LEU 423 CO 0.79 -0.01 1.21 -0.62 0.23 0.00 0.00 176.35 177.96 2ds9 s ASP 424 N -0.80 6.24 0.21 2.29 2.15 -1.26 -4.77 116.67 120.73 2ds9 s ASP 424 Ca 0.44 2.43 -0.10 0.00 0.43 0.00 0.00 52.55 55.75 2ds9 s ASP 424 Cb -0.28 -2.62 0.30 0.00 -0.30 0.00 0.00 42.92 40.03 2ds9 s ASP 424 CO 0.35 -0.88 1.70 0.00 -0.17 0.00 0.00 175.17 176.17 2ds9 h VAL 426 N 0.24 0.96 0.00 0.00 2.07 -1.92 -2.75 116.25 114.84 2ds9 h VAL 426 Ca 0.32 -0.15 -0.12 0.00 0.82 0.00 0.00 66.70 67.57 2ds9 h VAL 426 Cb 0.49 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2ds9 h VAL 426 CO -0.43 0.04 -1.81 0.18 0.02 0.00 0.00 177.57 175.57 2ds9 n LEU 427 N -4.38 0.31 -4.76 2.57 4.77 -0.79 -0.55 117.00 114.17 2ds9 n LEU 427 Ca -0.03 0.13 -0.41 0.00 -0.03 0.00 0.00 56.01 55.67 2ds9 n LEU 427 Cb 0.13 0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.32 2ds9 n LEU 427 CO 0.34 0.11 1.20 -1.14 -1.33 0.00 0.00 177.39 176.57 2ds9 n ARG 428 N -2.56 2.72 -1.00 3.23 0.63 -0.10 -4.92 116.66 114.66 2ds9 n ARG 428 Ca -0.11 0.96 -0.30 0.00 -0.92 0.00 0.00 57.85 57.48 2ds9 n ARG 428 Cb 0.75 -2.73 0.15 0.00 0.45 0.00 0.00 32.46 31.09 2ds9 n ARG 428 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2ds9 s PRO 429 N -1.29 1.12 -0.16 -0.14 0.02 -1.26 -4.87 135.00 128.42 2ds9 s PRO 429 Ca 0.59 1.07 -0.17 0.00 0.02 0.00 0.00 61.00 62.51 2ds9 s PRO 429 Cb -0.48 -1.77 -0.04 0.00 0.02 0.00 0.00 34.50 32.23 2ds9 s PRO 429 CO 0.56 -2.41 0.45 0.95 -0.33 0.00 0.00 177.00 176.22 2ds9 s THR 430 N -2.79 5.19 0.17 0.99 -4.23 -1.26 -4.99 115.64 108.71 2ds9 s THR 430 Ca 0.64 0.85 0.03 0.00 -1.18 0.00 0.00 61.69 62.04 2ds9 s THR 430 Cb -0.20 -3.78 -0.15 0.00 1.34 0.00 0.00 72.50 69.71 2ds9 s THR 430 CO 0.58 0.29 1.38 -0.33 -0.54 0.00 0.00 174.62 176.00 2ds9 h GLU 431 N 6.99 0.19 0.00 3.99 5.08 -1.93 -3.49 114.58 125.40 2ds9 h GLU 431 Ca -0.39 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 57.77 2ds9 h GLU 431 Cb 1.17 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2ds9 h GLU 431 CO 0.75 0.94 0.00 0.41 -1.00 0.00 0.00 179.01 180.11 2ds9 n GLY 432 N 0.86 0.55 3.14 -3.84 0.00 -1.26 -5.02 105.19 99.62 2ds9 n GLY 432 Ca -0.03 -2.13 -0.08 0.00 0.00 0.00 0.00 46.02 43.77 2ds9 n GLY 432 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ds9 s TYR 433 N -1.08 0.33 -0.20 1.61 -0.85 -0.21 -4.93 117.35 112.02 2ds9 s TYR 433 Ca 0.00 -0.80 -0.11 0.00 -0.52 0.00 0.00 57.07 55.64 2ds9 s TYR 433 Cb 0.00 -0.22 -0.05 0.00 0.38 0.00 0.00 41.96 42.07 2ds9 s TYR 433 CO 0.00 -0.44 0.16 -0.51 -1.52 0.00 0.00 175.55 173.23 2ds9 s LEU 434 N -2.80 4.19 -0.12 -3.49 1.43 -1.26 0.13 118.68 116.76 2ds9 s LEU 434 Ca 0.05 0.24 -0.22 0.00 -1.03 0.00 0.00 54.13 53.17 2ds9 s LEU 434 Cb 0.06 -2.13 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 2ds9 s LEU 434 CO -0.10 0.14 0.65 0.00 0.23 0.00 0.00 176.35 177.27 2ds9 s ALA 435 N 0.54 3.43 0.13 4.21 0.00 -0.31 -0.56 121.76 129.20 2ds9 s ALA 435 Ca 0.09 -0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.03 2ds9 s ALA 435 Cb -0.12 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 2ds9 s ALA 435 CO 0.00 -0.24 -0.04 0.14 0.00 0.00 0.00 175.76 175.62 2ds9 s VAL 436 N 1.15 0.75 -0.16 0.00 -7.23 -0.42 0.33 120.40 114.82 2ds9 s VAL 436 Ca 0.33 -1.97 -0.02 0.00 -1.81 0.00 0.00 61.98 58.51 2ds9 s VAL 436 Cb -0.17 -1.88 -0.01 0.00 0.56 0.00 0.00 36.38 34.89 2ds9 s VAL 436 CO 0.14 -0.70 -0.10 0.00 -0.31 0.00 0.00 175.10 174.13 2ds9 s ALA 437 N -3.60 2.70 0.03 1.32 0.00 -1.26 -2.77 121.76 118.18 2ds9 s ALA 437 Ca 0.17 -0.99 0.06 0.00 0.00 0.00 0.00 51.96 51.21 2ds9 s ALA 437 Cb 0.05 -1.39 -0.03 0.00 0.00 0.00 0.00 23.12 21.75 2ds9 s ALA 437 CO -0.01 0.00 -0.17 0.08 0.00 0.00 0.00 175.76 175.66 2ds9 s VAL 438 N 0.76 2.86 0.11 0.00 1.01 -0.65 -0.63 120.40 123.86 2ds9 s VAL 438 Ca -0.04 -1.10 -0.04 0.00 0.00 0.00 0.00 61.98 60.80 2ds9 s VAL 438 Cb -0.15 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 2ds9 s VAL 438 CO 0.01 0.38 0.11 0.68 0.00 0.00 0.00 175.10 176.28 2ds9 s VAL 439 N -0.90 0.14 0.17 2.92 -7.23 0.39 -2.50 120.40 113.39 2ds9 s VAL 439 Ca 0.14 -1.62 -0.30 0.00 -1.81 0.00 0.00 61.98 58.39 2ds9 s VAL 439 Cb -0.11 -1.71 -0.08 0.00 0.56 0.00 0.00 36.38 35.04 2ds9 s VAL 439 CO 0.05 -0.61 1.21 -0.75 -0.31 0.00 0.00 175.10 174.69 2ds9 s LYS 440 N -3.96 4.47 0.09 4.82 2.47 -1.26 -1.00 119.74 125.37 2ds9 s LYS 440 Ca 0.14 1.89 -0.23 0.00 -1.56 0.00 0.00 55.97 56.21 2ds9 s LYS 440 Cb 0.06 -3.25 -0.15 0.00 -1.46 0.00 0.00 37.83 33.04 2ds9 s LYS 440 CO -0.04 -0.13 1.74 -0.22 0.16 0.00 0.00 175.35 176.85 2ds9 h LYS 441 N 5.46 -0.01 -1.36 4.03 3.64 -0.60 -2.45 116.57 125.28 2ds9 h LYS 441 Ca -0.44 0.00 0.42 0.00 -1.27 0.00 0.00 60.65 59.36 2ds9 h LYS 441 Cb 1.21 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.93 2ds9 h LYS 441 CO 0.76 -0.01 0.91 0.00 -2.27 0.00 0.00 179.45 178.84 2ds9 h ALA 442 N 0.98 2.88 -0.83 5.00 0.00 -1.92 -3.07 119.26 122.31 2ds9 h ALA 442 Ca 0.00 0.06 -0.60 0.00 0.00 0.00 0.00 54.91 54.37 2ds9 h ALA 442 Cb 0.01 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 2ds9 h ALA 442 CO -0.00 -1.43 1.86 1.21 0.00 0.00 0.00 179.25 180.89 2ds9 s ASN 443 N -4.62 6.43 0.66 0.00 2.47 -0.92 -4.98 114.94 113.99 2ds9 s ASN 443 Ca -0.07 -2.10 -0.13 0.00 0.42 0.00 0.00 52.86 50.98 2ds9 s ASN 443 Cb 0.28 -2.58 -0.00 0.00 -1.45 0.00 0.00 41.25 37.50 2ds9 s ASN 443 CO 0.83 -1.59 1.07 -1.61 -3.72 0.00 0.00 177.10 172.08 2ds9 s GLU 444 N 4.81 2.94 0.00 0.43 2.02 -1.16 -3.98 118.70 123.75 2ds9 s GLU 444 Ca 0.56 1.16 0.00 0.00 0.02 0.00 0.00 54.97 56.71 2ds9 s GLU 444 Cb 0.02 -1.98 0.00 0.00 0.10 0.00 0.00 34.13 32.27 2ds9 s GLU 444 CO 0.06 -1.11 0.00 0.41 0.02 0.00 0.00 175.26 174.63 2ds9 n GLY 445 N -1.22 0.42 3.58 -1.39 0.00 -1.26 -4.96 105.19 100.36 2ds9 n GLY 445 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2ds9 n GLY 445 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ds9 s LEU 446 N 0.00 4.08 0.44 0.99 2.96 -1.26 -4.92 118.68 120.98 2ds9 s LEU 446 Ca 0.00 0.32 0.04 0.00 -0.22 0.00 0.00 54.13 54.26 2ds9 s LEU 446 Cb 0.00 -3.12 -0.04 0.00 0.50 0.00 0.00 46.19 43.53 2ds9 s LEU 446 CO 0.00 -0.85 0.03 0.42 -1.32 0.00 0.00 176.35 174.62 2ds9 s THR 447 N 3.36 1.37 0.64 3.68 -4.23 -1.26 -4.98 115.64 114.22 2ds9 s THR 447 Ca 0.34 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.16 2ds9 s THR 447 Cb -0.12 -2.55 0.34 0.00 1.34 0.00 0.00 72.50 71.51 2ds9 s THR 447 CO 0.20 0.00 1.98 -0.25 -0.54 0.00 0.00 174.62 176.01 2ds9 h TRP 448 N 1.65 0.00 -0.00 3.99 2.91 -1.90 0.40 115.95 123.00 2ds9 h TRP 448 Ca -0.42 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.60 2ds9 h TRP 448 Cb 1.28 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.93 2ds9 h TRP 448 CO 1.13 0.00 -0.57 0.09 -1.03 0.00 0.00 178.44 178.06 2ds9 n ASN 449 N -3.20 0.75 -2.01 2.65 3.02 -1.26 -3.99 115.26 111.21 2ds9 n ASN 449 Ca 0.01 -0.56 -0.24 0.00 -0.03 0.00 0.00 54.58 53.75 2ds9 n ASN 449 Cb 0.41 0.40 0.04 0.00 -0.61 0.00 0.00 39.78 40.02 2ds9 n ASN 449 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2ds9 n SER 450 N -1.31 5.22 0.06 6.41 3.41 0.13 -4.68 113.62 122.86 2ds9 n SER 450 Ca 0.06 -3.76 0.05 0.00 -0.26 0.00 0.00 58.87 54.96 2ds9 n SER 450 Cb 0.34 -0.45 -0.05 0.00 -0.26 0.00 0.00 64.21 63.79 2ds9 n SER 450 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2ds9 n LEU 451 N -0.77 0.83 -4.67 1.04 4.77 -1.23 -4.70 117.00 112.27 2ds9 n LEU 451 Ca 0.46 0.35 -0.48 0.00 -0.03 0.00 0.00 56.01 56.31 2ds9 n LEU 451 Cb 0.91 0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.98 2ds9 n LEU 451 CO 0.45 0.00 1.33 1.17 -1.33 0.00 0.00 177.39 179.00 2ds9 n LYS 452 N -2.79 2.09 -0.93 3.23 4.81 -1.26 -1.86 118.16 121.44 2ds9 n LYS 452 Ca -0.06 0.76 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 2ds9 n LYS 452 Cb 0.71 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 33.21 2ds9 n LYS 452 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2ds9 n ASP 453 N 4.96 0.00 -4.04 3.14 10.43 -0.70 -4.96 116.55 125.38 2ds9 n ASP 453 Ca 0.20 0.00 -0.30 0.00 2.57 0.00 0.00 54.79 57.26 2ds9 n ASP 453 Cb 0.28 0.00 0.20 0.00 1.84 0.00 0.00 41.12 43.44 2ds9 n ASP 453 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2ds9 s LYS 454 N -0.01 0.18 -0.14 -1.24 -0.14 -0.78 -3.85 119.74 113.77 2ds9 s LYS 454 Ca 0.00 -0.34 -0.06 0.00 -1.36 0.00 0.00 55.97 54.21 2ds9 s LYS 454 Cb 0.00 -1.79 -0.04 0.00 -1.68 0.00 0.00 37.83 34.32 2ds9 s LYS 454 CO 0.00 -2.73 0.08 0.15 -0.76 0.00 0.00 175.35 172.09 2ds9 s LYS 455 N -5.79 3.55 0.16 1.68 1.02 -1.26 -2.75 119.74 116.36 2ds9 s LYS 455 Ca 0.73 -0.27 0.10 0.00 0.02 0.00 0.00 55.97 56.55 2ds9 s LYS 455 Cb -0.05 -3.11 -0.04 0.00 -0.52 0.00 0.00 37.83 34.11 2ds9 s LYS 455 CO 0.54 0.57 -0.23 -1.54 -0.92 0.00 0.00 175.35 173.76 2ds9 s SER 456 N -0.45 3.16 -0.21 2.83 1.04 -0.87 0.07 113.70 119.27 2ds9 s SER 456 Ca 0.10 -0.82 0.02 0.00 0.48 0.00 0.00 55.95 55.73 2ds9 s SER 456 Cb -0.12 -0.21 0.03 0.00 0.10 0.00 0.00 66.02 65.82 2ds9 s SER 456 CO 0.02 0.09 -0.17 0.00 0.98 0.00 0.00 173.24 174.17 2ds9 s HIS 458 N 1.23 2.65 0.13 0.00 3.76 0.23 -1.62 115.29 121.67 2ds9 s HIS 458 Ca 0.00 -0.20 -0.22 0.00 -0.15 0.00 0.00 55.06 54.50 2ds9 s HIS 458 Cb -0.15 -1.55 -0.02 0.00 1.11 0.00 0.00 32.58 31.96 2ds9 s HIS 458 CO -0.10 0.22 1.68 1.79 -0.85 0.00 0.00 174.74 177.48 2ds9 h THR 459 N 4.12 0.65 0.00 1.30 1.35 -1.73 -3.39 112.91 115.21 2ds9 h THR 459 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2ds9 h THR 459 Cb 1.15 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 2ds9 h THR 459 CO 0.49 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.76 2ds9 n ALA 460 N -2.52 0.00 -1.71 6.62 0.00 -1.26 -1.14 120.51 120.50 2ds9 n ALA 460 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 2ds9 n ALA 460 Cb 0.19 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.66 2ds9 n ALA 460 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ds9 n VAL 461 N -0.20 3.00 -0.99 0.00 0.31 0.18 -2.78 118.33 117.84 2ds9 n VAL 461 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2ds9 n VAL 461 Cb 0.00 -1.58 0.00 0.00 -0.91 0.00 0.00 33.84 31.35 2ds9 n VAL 461 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2ds9 n ASP 462 N -0.22 -3.43 -4.96 4.52 8.00 -1.26 -4.95 116.55 114.25 2ds9 n ASP 462 Ca 0.08 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.36 2ds9 n ASP 462 Cb 0.42 -1.14 -0.01 0.00 -0.02 0.00 0.00 41.12 40.37 2ds9 n ASP 462 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2ds9 s ARG 463 N -0.44 3.39 0.01 -1.24 0.52 -1.12 -3.81 118.95 116.26 2ds9 s ARG 463 Ca 0.00 -0.57 -0.13 0.00 -0.52 0.00 0.00 55.73 54.51 2ds9 s ARG 463 Cb 0.00 -2.75 -0.07 0.00 0.52 0.00 0.00 34.95 32.65 2ds9 s ARG 463 CO 0.00 0.20 0.88 1.15 0.02 0.00 0.00 175.30 177.56 2ds9 h THR 464 N 0.88 0.00 -0.05 0.02 2.02 -1.93 0.28 112.91 114.13 2ds9 h THR 464 Ca -0.50 -0.15 -0.22 0.00 0.77 0.00 0.00 66.41 66.31 2ds9 h THR 464 Cb 1.23 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 67.65 2ds9 h THR 464 CO 0.60 0.00 -0.88 0.00 0.37 0.00 0.00 175.52 175.61 2ds9 h ALA 465 N -1.63 0.36 0.00 6.16 0.00 -1.95 -1.41 119.26 120.79 2ds9 h ALA 465 Ca -0.05 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2ds9 h ALA 465 Cb 0.36 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2ds9 h ALA 465 CO 0.08 0.75 0.00 0.78 0.00 0.00 0.00 179.25 180.86 2ds9 h GLY 466 N 0.97 0.00 0.00 0.00 0.00 -1.69 -3.40 103.07 98.94 2ds9 h GLY 466 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2ds9 h GLY 466 CO 0.16 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.57 2ds9 n TRP 467 N -3.08 -0.39 -0.35 5.60 -0.00 -0.93 -4.21 117.44 114.08 2ds9 n TRP 467 Ca 0.03 0.07 0.15 0.00 -0.00 0.00 0.00 57.50 57.75 2ds9 n TRP 467 Cb 0.45 0.50 0.35 0.00 -0.00 0.00 0.00 31.31 32.61 2ds9 n TRP 467 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 2ds9 h ASN 468 N 0.00 0.73 0.15 5.87 4.21 -0.37 -1.64 115.58 124.53 2ds9 h ASN 468 Ca 0.00 0.12 -0.01 0.00 1.21 0.00 0.00 56.30 57.62 2ds9 h ASN 468 Cb 0.00 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.19 2ds9 h ASN 468 CO 0.00 0.20 -0.07 0.40 -1.29 0.00 0.00 177.43 176.66 2ds9 h ILE 469 N 0.68 0.53 0.14 2.81 1.08 -1.48 -2.61 117.51 118.66 2ds9 h ILE 469 Ca 0.61 -1.12 -0.00 0.00 -0.39 0.00 0.00 64.86 63.95 2ds9 h ILE 469 Cb 1.03 0.94 -0.00 0.00 -3.07 0.00 0.00 36.82 35.73 2ds9 h ILE 469 CO -0.43 0.16 -0.08 1.55 -0.69 0.00 0.00 178.15 178.66 2ds9 h PRO 470 N -0.98 -0.20 -0.01 2.37 0.13 -1.75 -0.31 132.00 131.25 2ds9 h PRO 470 Ca -0.02 0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 65.01 2ds9 h PRO 470 Cb 0.41 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.57 2ds9 h PRO 470 CO 0.03 -0.13 -0.54 0.52 -0.23 0.00 0.00 178.00 177.65 2ds9 h MET 471 N -0.21 0.03 0.29 0.86 2.86 -1.49 0.33 114.93 117.61 2ds9 h MET 471 Ca -0.01 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2ds9 h MET 471 Cb 0.17 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 2ds9 h MET 471 CO 0.02 0.56 -0.33 0.78 1.06 0.00 0.00 176.91 179.00 2ds9 h GLY 472 N 1.59 -0.75 1.12 8.32 0.00 -1.00 0.51 103.07 112.86 2ds9 h GLY 472 Ca -0.00 0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.67 2ds9 h GLY 472 CO 0.07 -0.28 0.32 1.41 0.00 0.00 0.00 176.54 178.07 2ds9 h LEU 473 N -0.67 1.03 -0.69 3.11 3.38 -0.64 -1.00 115.31 119.83 2ds9 h LEU 473 Ca -0.01 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.72 2ds9 h LEU 473 Cb 0.62 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2ds9 h LEU 473 CO -0.09 0.90 -0.06 0.40 0.09 0.00 0.00 178.44 179.68 2ds9 h ILE 474 N 1.10 1.26 0.87 1.22 2.04 0.15 -0.46 117.51 123.69 2ds9 h ILE 474 Ca 0.26 -1.18 -0.04 0.00 1.00 0.00 0.00 64.86 64.90 2ds9 h ILE 474 Cb 0.18 0.91 0.01 0.00 -0.74 0.00 0.00 36.82 37.18 2ds9 h ILE 474 CO -0.02 0.42 -0.42 0.58 0.00 0.00 0.00 178.15 178.70 2ds9 h VAL 475 N 0.87 0.12 -0.33 1.67 2.07 0.36 -1.27 116.25 119.73 2ds9 h VAL 475 Ca 0.15 -0.04 0.07 0.00 0.82 0.00 0.00 66.70 67.69 2ds9 h VAL 475 Cb 0.59 0.12 -0.08 0.00 -1.52 0.00 0.00 31.29 30.40 2ds9 h VAL 475 CO 0.04 0.00 -0.35 0.78 0.02 0.00 0.00 177.57 178.06 2ds9 h ASN 476 N -1.21 -1.15 0.18 0.57 4.21 -0.95 0.33 115.58 117.56 2ds9 h ASN 476 Ca -0.12 0.19 -0.01 0.00 1.21 0.00 0.00 56.30 57.57 2ds9 h ASN 476 Cb 0.90 0.52 -0.00 0.00 -1.12 0.00 0.00 38.32 38.62 2ds9 h ASN 476 CO 0.20 -0.35 -0.03 1.56 -1.29 0.00 0.00 177.43 177.52 2ds9 h GLN 477 N -0.31 0.00 0.00 0.81 4.20 -1.09 -3.05 115.11 115.67 2ds9 h GLN 477 Ca 0.14 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.58 2ds9 h GLN 477 Cb 0.56 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.29 2ds9 h GLN 477 CO -0.50 0.03 -1.67 2.41 -0.67 0.00 0.00 178.83 178.43 2ds9 n THR 478 N -3.50 1.54 0.00 -0.54 -1.04 0.94 -4.94 114.28 106.74 2ds9 n THR 478 Ca -0.02 -0.78 0.00 0.00 -2.04 0.00 0.00 64.05 61.21 2ds9 n THR 478 Cb 0.14 -0.99 0.00 0.00 -1.82 0.00 0.00 70.33 67.66 2ds9 n THR 478 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ds9 n GLY 479 N 1.53 2.79 3.95 3.41 0.00 0.07 -4.98 105.19 111.96 2ds9 n GLY 479 Ca -0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 2ds9 n GLY 479 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ds9 s SER 480 N -2.41 6.34 0.00 1.61 0.15 -1.26 -4.99 113.70 113.13 2ds9 s SER 480 Ca 0.00 0.26 0.15 0.00 0.70 0.00 0.00 55.95 57.06 2ds9 s SER 480 Cb 0.00 -1.95 0.12 0.00 -1.71 0.00 0.00 66.02 62.48 2ds9 s SER 480 CO 0.00 -0.10 0.97 0.00 1.20 0.00 0.00 173.24 175.31 2ds9 n ALA 482 N 0.82 6.89 0.30 0.00 0.00 -1.26 -4.47 120.51 122.78 2ds9 n ALA 482 Ca 0.09 -3.38 0.18 0.00 0.00 0.00 0.00 53.44 50.33 2ds9 n ALA 482 Cb 0.37 -2.74 0.94 0.00 0.00 0.00 0.00 19.45 18.02 2ds9 n ALA 482 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2ds9 h PHE 483 N 4.14 0.00 0.00 0.00 -0.00 -1.98 -1.02 116.94 118.08 2ds9 h PHE 483 Ca 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.58 2ds9 h PHE 483 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.52 2ds9 h PHE 483 CO 1.68 0.03 0.00 -0.40 -0.00 0.00 0.00 178.31 179.62 2ds9 n ASP 484 N -3.27 0.00 0.00 -0.68 5.75 -1.26 -2.42 116.55 114.67 2ds9 n ASP 484 Ca -0.02 -0.29 0.00 0.00 -0.01 0.00 0.00 54.79 54.47 2ds9 n ASP 484 Cb 0.17 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 2ds9 n ASP 484 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2ds9 n GLU 485 N -1.03 2.27 0.31 0.11 1.02 -0.39 -4.79 120.64 118.14 2ds9 n GLU 485 Ca 0.08 -0.25 -0.12 0.00 -0.02 0.00 0.00 57.16 56.85 2ds9 n GLU 485 Cb 0.04 -0.72 -0.06 0.00 -0.02 0.00 0.00 31.44 30.68 2ds9 n GLU 485 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2ds9 h PHE 486 N 0.00 -0.74 -3.37 -0.32 3.57 -1.53 -3.42 116.94 111.13 2ds9 h PHE 486 Ca 0.00 -0.02 -0.54 0.00 3.53 0.00 0.00 57.97 60.94 2ds9 h PHE 486 Cb 0.03 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 2ds9 h PHE 486 CO 0.00 -0.46 0.43 -0.06 -2.23 0.00 0.00 178.31 175.98 2ds9 s PHE 487 N -4.49 3.62 0.18 0.41 0.08 -1.26 -1.72 117.98 114.80 2ds9 s PHE 487 Ca -0.12 1.67 -0.13 0.00 0.12 0.00 0.00 56.93 58.47 2ds9 s PHE 487 Cb 0.01 -3.14 0.17 0.00 -0.57 0.00 0.00 43.02 39.49 2ds9 s PHE 487 CO 0.35 -0.08 1.72 0.66 -0.10 0.00 0.00 175.22 177.77 2ds9 h SER 488 N 6.88 0.00 -5.03 1.36 4.64 -1.62 -3.44 113.55 116.35 2ds9 h SER 488 Ca -0.38 0.08 -0.13 0.00 -0.47 0.00 0.00 61.79 60.89 2ds9 h SER 488 Cb 1.20 0.12 -0.19 0.00 -0.31 0.00 0.00 62.40 63.21 2ds9 h SER 488 CO 0.78 0.03 -0.49 -1.10 -0.87 0.00 0.00 176.83 175.18 2ds9 s GLN 489 N -6.14 0.54 0.29 4.77 -0.21 -1.26 -4.91 119.66 112.74 2ds9 s GLN 489 Ca -0.13 -0.55 -0.12 0.00 0.02 0.00 0.00 55.36 54.58 2ds9 s GLN 489 Cb 0.15 0.22 0.01 0.00 1.00 0.00 0.00 33.01 34.39 2ds9 s GLN 489 CO 0.72 -0.14 0.55 -1.12 -2.12 0.00 0.00 175.29 173.18 2ds9 s SER 490 N -1.72 0.10 -0.30 5.90 0.01 -0.63 -2.05 113.70 115.02 2ds9 s SER 490 Ca -0.10 -1.03 -0.01 0.00 1.31 0.00 0.00 55.95 56.12 2ds9 s SER 490 Cb -0.05 0.65 0.10 0.00 0.21 0.00 0.00 66.02 66.93 2ds9 s SER 490 CO -0.01 -1.27 0.09 0.00 0.41 0.00 0.00 173.24 172.46 2ds9 s ALA 492 N 1.62 2.18 0.17 0.00 0.00 -0.31 -0.60 121.76 124.82 2ds9 s ALA 492 Ca 0.08 -2.25 -0.33 0.00 0.00 0.00 0.00 51.96 49.47 2ds9 s ALA 492 Cb -0.17 -1.82 -0.13 0.00 0.00 0.00 0.00 23.12 21.00 2ds9 s ALA 492 CO -0.23 -1.80 1.64 -2.30 0.00 0.00 0.00 175.76 173.08 2ds9 n PRO 493 N 4.24 2.38 0.00 0.00 -0.02 -1.26 -2.29 135.00 138.06 2ds9 n PRO 493 Ca 0.03 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 2ds9 n PRO 493 Cb 0.39 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 2ds9 n PRO 493 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ds9 n GLY 494 N 3.65 2.33 3.88 -1.23 0.00 -0.47 0.49 105.19 113.84 2ds9 n GLY 494 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2ds9 n GLY 494 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ds9 s ALA 495 N -2.17 2.37 -0.14 4.61 0.00 -0.97 -4.94 121.76 120.53 2ds9 s ALA 495 Ca 0.00 -0.76 -0.29 0.00 0.00 0.00 0.00 51.96 50.91 2ds9 s ALA 495 Cb 0.00 -2.93 -0.06 0.00 0.00 0.00 0.00 23.12 20.14 2ds9 s ALA 495 CO 0.00 -1.99 1.95 0.34 0.00 0.00 0.00 175.76 176.06 2ds9 s ASP 496 N -4.54 6.06 0.30 0.00 2.15 -1.26 -4.87 116.67 114.51 2ds9 s ASP 496 Ca 0.65 2.06 0.06 0.00 0.43 0.00 0.00 52.55 55.75 2ds9 s ASP 496 Cb -0.10 -2.52 0.78 0.00 -0.30 0.00 0.00 42.92 40.78 2ds9 s ASP 496 CO 0.51 -1.45 1.72 -0.65 -0.17 0.00 0.00 175.17 175.13 2ds9 h PRO 497 N 12.28 0.52 0.00 4.34 0.11 -1.92 0.48 132.00 147.81 2ds9 h PRO 497 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2ds9 h PRO 497 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2ds9 h PRO 497 CO 0.97 0.34 0.00 1.63 -0.21 0.00 0.00 178.00 180.73 2ds9 n LYS 498 N -4.93 0.90 -2.42 1.05 5.02 -1.26 -4.56 118.16 111.95 2ds9 n LYS 498 Ca 0.24 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.29 2ds9 n LYS 498 Cb 0.67 -1.35 0.05 0.00 -0.02 0.00 0.00 35.03 34.38 2ds9 n LYS 498 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2ds9 s SER 499 N -1.72 5.15 0.39 4.39 1.04 0.17 -4.98 113.70 118.15 2ds9 s SER 499 Ca 0.30 0.33 0.26 0.00 0.48 0.00 0.00 55.95 57.33 2ds9 s SER 499 Cb 0.14 -1.15 0.78 0.00 0.10 0.00 0.00 66.02 65.88 2ds9 s SER 499 CO 0.23 -1.31 1.75 0.08 0.98 0.00 0.00 173.24 174.97 2ds9 h ARG 500 N -0.25 0.00 -0.04 4.02 -0.00 -1.88 -2.30 114.38 113.93 2ds9 h ARG 500 Ca -0.44 0.00 0.01 0.00 -0.00 0.00 0.00 59.98 59.55 2ds9 h ARG 500 Cb 1.30 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.26 2ds9 h ARG 500 CO 0.58 0.00 0.06 -0.07 -0.00 0.00 0.00 179.97 180.53 2ds9 h LEU 501 N 0.00 0.00 -0.81 0.08 3.38 -1.85 -0.08 115.31 116.02 2ds9 h LEU 501 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ds9 h LEU 501 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2ds9 h LEU 501 CO 0.00 0.00 -0.49 0.00 0.09 0.00 0.00 178.44 178.04 2ds9 h ALA 503 N 3.35 2.75 0.00 0.00 0.00 -0.74 -1.28 119.26 123.34 2ds9 h ALA 503 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2ds9 h ALA 503 Cb 0.64 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2ds9 h ALA 503 CO 0.00 -1.22 -0.81 1.28 0.00 0.00 0.00 179.25 178.51 2ds9 n LEU 504 N -4.48 0.79 -4.80 0.00 4.32 0.10 -4.93 117.00 108.01 2ds9 n LEU 504 Ca 0.31 -0.29 -0.32 0.00 -0.02 0.00 0.00 56.01 55.69 2ds9 n LEU 504 Cb 1.24 -0.10 0.05 0.00 -1.62 0.00 0.00 43.42 42.98 2ds9 n LEU 504 CO 0.29 0.19 0.71 0.00 -1.22 0.00 0.00 177.39 177.37 2ds9 n ALA 506 N -2.82 1.43 -0.36 0.00 0.00 -1.26 -4.79 120.51 112.71 2ds9 n ALA 506 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2ds9 n ALA 506 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2ds9 n ALA 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ds9 n GLY 507 N 0.57 -1.32 0.00 0.00 0.00 -1.26 -4.09 105.19 99.09 2ds9 n GLY 507 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.79 2ds9 n GLY 507 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ds9 n ASP 508 N -0.65 0.00 -0.28 1.61 5.68 -0.35 -2.77 116.55 119.78 2ds9 n ASP 508 Ca 0.00 0.00 0.18 0.00 -0.50 0.00 0.00 54.79 54.47 2ds9 n ASP 508 Cb 0.00 0.00 0.46 0.00 -1.14 0.00 0.00 41.12 40.44 2ds9 n ASP 508 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2ds9 h ASP 509 N 0.00 0.52 -0.01 -1.12 3.32 -1.89 -1.71 116.42 115.53 2ds9 h ASP 509 Ca 0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2ds9 h ASP 509 Cb 0.00 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2ds9 h ASP 509 CO 0.00 0.19 -0.55 0.00 -1.72 0.00 0.00 179.24 177.16 2ds9 n GLN 510 N -4.58 1.12 -0.56 3.56 6.02 -1.26 -4.93 117.38 116.75 2ds9 n GLN 510 Ca 0.21 -0.76 0.00 0.00 -0.01 0.00 0.00 57.00 56.44 2ds9 n GLN 510 Cb 0.68 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 30.50 2ds9 n GLN 510 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ds9 n GLY 511 N 1.39 0.68 3.90 1.08 0.00 -0.64 -5.06 105.19 106.54 2ds9 n GLY 511 Ca 0.08 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 2ds9 n GLY 511 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ds9 s LEU 512 N 0.00 3.94 -1.01 0.99 1.43 -1.26 -4.35 118.68 118.41 2ds9 s LEU 512 Ca 0.00 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 2ds9 s LEU 512 Cb 0.00 -3.69 0.00 0.00 0.03 0.00 0.00 46.19 42.53 2ds9 s LEU 512 CO 0.00 -0.31 0.00 0.47 0.23 0.00 0.00 176.35 176.74 2ds9 n ASP 513 N -1.27 -3.81 -4.60 2.29 8.00 -1.26 -1.21 116.55 114.69 2ds9 n ASP 513 Ca -0.00 0.07 -0.49 0.00 0.71 0.00 0.00 54.79 55.08 2ds9 n ASP 513 Cb 0.54 -2.83 -0.04 0.00 -0.02 0.00 0.00 41.12 38.77 2ds9 n ASP 513 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2ds9 n LYS 514 N -2.24 1.37 -0.74 -1.24 4.81 -1.26 -2.00 118.16 116.87 2ds9 n LYS 514 Ca -0.13 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 2ds9 n LYS 514 Cb 0.53 -2.07 0.00 0.00 0.02 0.00 0.00 35.03 33.51 2ds9 n LYS 514 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ds9 s VAL 516 N -2.16 2.66 -1.31 0.00 -7.23 -0.85 -1.37 120.40 110.15 2ds9 s VAL 516 Ca 0.00 0.49 -0.06 0.00 -1.81 0.00 0.00 61.98 60.59 2ds9 s VAL 516 Cb 0.00 -3.24 0.14 0.00 0.56 0.00 0.00 36.38 33.84 2ds9 s VAL 516 CO 0.00 -0.02 2.23 -0.81 -0.31 0.00 0.00 175.10 176.20 2ds9 n PRO 517 N -0.83 4.33 -1.18 4.82 -0.04 -1.26 -4.52 135.00 136.32 2ds9 n PRO 517 Ca 0.09 -3.50 0.00 0.00 -0.04 0.00 0.00 63.50 60.05 2ds9 n PRO 517 Cb 0.47 -2.71 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 2ds9 n PRO 517 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2ds9 n ASN 518 N 2.29 0.16 -1.75 3.54 0.23 -1.26 -4.54 115.26 113.93 2ds9 n ASN 518 Ca 0.56 -0.59 0.08 0.00 -0.53 0.00 0.00 54.58 54.10 2ds9 n ASN 518 Cb 0.28 0.00 0.38 0.00 -2.08 0.00 0.00 39.78 38.36 2ds9 n ASN 518 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 2ds9 n SER 519 N -1.68 5.26 0.14 0.53 2.88 -1.26 -3.75 113.62 115.74 2ds9 n SER 519 Ca 0.00 -2.71 0.01 0.00 -1.33 0.00 0.00 58.87 54.84 2ds9 n SER 519 Cb 0.00 -0.64 0.14 0.00 -0.75 0.00 0.00 64.21 62.96 2ds9 n SER 519 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2ds9 h LYS 520 N 3.99 0.00 -6.11 -1.46 1.57 -1.95 -3.43 116.57 109.18 2ds9 h LYS 520 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 2ds9 h LYS 520 Cb 1.74 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 34.00 2ds9 h LYS 520 CO 0.38 0.59 0.11 -2.00 -0.57 0.00 0.00 179.45 177.96 2ds9 s GLU 521 N -3.28 4.45 0.18 3.15 2.56 -1.25 -3.25 118.70 121.27 2ds9 s GLU 521 Ca 0.01 0.94 -0.15 0.00 0.00 0.00 0.00 54.97 55.76 2ds9 s GLU 521 Cb 0.10 -3.43 0.15 0.00 2.00 0.00 0.00 34.13 32.96 2ds9 s GLU 521 CO 0.74 0.11 1.66 -0.22 -0.56 0.00 0.00 175.26 177.00 2ds9 h LYS 522 N 6.51 0.02 -0.41 4.30 3.64 -1.79 -2.58 116.57 126.27 2ds9 h LYS 522 Ca -0.42 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 2ds9 h LYS 522 Cb 1.20 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2ds9 h LYS 522 CO 0.74 0.02 0.00 0.66 -2.27 0.00 0.00 179.45 178.60 2ds9 n TYR 523 N -5.32 0.54 -2.59 1.91 4.01 -1.26 -4.26 117.16 110.19 2ds9 n TYR 523 Ca 0.04 -0.27 -0.37 0.00 -0.16 0.00 0.00 57.90 57.14 2ds9 n TYR 523 Cb 0.26 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.24 2ds9 n TYR 523 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2ds9 s TYR 524 N -1.46 3.41 0.00 -0.72 5.04 -0.97 0.84 117.35 123.49 2ds9 s TYR 524 Ca 0.31 1.69 0.00 0.00 -2.44 0.00 0.00 57.07 56.62 2ds9 s TYR 524 Cb 0.16 -3.10 0.00 0.00 0.35 0.00 0.00 41.96 39.37 2ds9 s TYR 524 CO 0.22 -0.42 0.00 0.41 -1.34 0.00 0.00 175.55 174.42 2ds9 n GLY 525 N 0.51 -0.98 0.22 8.97 0.00 -0.29 -2.28 105.19 111.34 2ds9 n GLY 525 Ca 0.03 -1.64 -0.02 0.00 0.00 0.00 0.00 46.02 44.39 2ds9 n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2ds9 h TYR 526 N 0.00 0.34 -0.04 1.61 0.05 -1.90 -1.61 116.97 115.42 2ds9 h TYR 526 Ca 0.00 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 2ds9 h TYR 526 Cb 0.00 -0.07 -0.00 0.00 1.01 0.00 0.00 36.73 37.67 2ds9 h TYR 526 CO 0.00 0.09 -0.05 1.15 -1.05 0.00 0.00 178.16 178.31 2ds9 h THR 527 N 0.37 1.39 0.05 -2.88 2.02 -1.90 -2.42 112.91 109.54 2ds9 h THR 527 Ca 0.27 -1.22 0.03 0.00 0.77 0.00 0.00 66.41 66.25 2ds9 h THR 527 Cb 0.32 2.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.79 2ds9 h THR 527 CO -0.28 0.33 -0.39 1.23 0.37 0.00 0.00 175.52 176.78 2ds9 h GLY 528 N -0.37 -0.74 -0.36 2.16 0.00 -1.35 0.18 103.07 102.60 2ds9 h GLY 528 Ca 0.01 0.47 0.13 0.00 0.00 0.00 0.00 47.33 47.94 2ds9 h GLY 528 CO 0.01 -0.25 -0.19 0.00 0.00 0.00 0.00 176.54 176.11 2ds9 h ALA 529 N -0.01 0.40 0.00 3.60 0.00 0.15 0.46 119.26 123.85 2ds9 h ALA 529 Ca 0.04 0.25 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 2ds9 h ALA 529 Cb 0.64 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2ds9 h ALA 529 CO -0.27 -0.45 -0.23 0.35 0.00 0.00 0.00 179.25 178.65 2ds9 h PHE 530 N -0.02 0.00 -0.03 0.00 3.57 -0.79 -2.01 116.94 117.66 2ds9 h PHE 530 Ca 0.31 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.61 2ds9 h PHE 530 Cb 0.50 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 2ds9 h PHE 530 CO -0.55 0.23 -0.85 -0.09 -2.23 0.00 0.00 178.31 174.82 2ds9 h ARG 531 N 0.00 0.36 -0.78 1.11 2.43 0.27 -0.39 114.38 117.38 2ds9 h ARG 531 Ca -0.00 -0.35 0.10 0.00 -0.81 0.00 0.00 59.98 58.92 2ds9 h ARG 531 Cb 0.60 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.16 2ds9 h ARG 531 CO 0.03 1.02 0.41 0.00 -1.51 0.00 0.00 179.97 179.92 2ds9 h LEU 533 N 0.68 0.20 -0.91 0.00 5.85 -1.36 0.11 115.31 119.88 2ds9 h LEU 533 Ca 0.39 -0.85 0.26 0.00 0.84 0.00 0.00 57.88 58.52 2ds9 h LEU 533 Cb 0.42 -0.07 -0.15 0.00 0.37 0.00 0.00 40.66 41.23 2ds9 h LEU 533 CO -0.28 1.35 0.28 0.00 -0.34 0.00 0.00 178.44 179.45 2ds9 h ALA 534 N -0.10 1.40 -0.29 1.25 0.00 -0.92 2.00 119.26 122.60 2ds9 h ALA 534 Ca -0.19 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2ds9 h ALA 534 Cb 1.41 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.52 2ds9 h ALA 534 CO 0.00 -0.51 0.00 0.39 0.00 0.00 0.00 179.25 179.13 2ds9 n GLU 535 N -5.23 1.81 -3.21 0.00 1.02 -0.53 -4.91 120.64 109.59 2ds9 n GLU 535 Ca 0.24 -1.09 -0.23 0.00 -0.02 0.00 0.00 57.16 56.06 2ds9 n GLU 535 Cb 0.76 -1.31 0.05 0.00 -0.02 0.00 0.00 31.44 30.92 2ds9 n GLU 535 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2ds9 n ASP 536 N 0.35 -6.14 -0.02 1.62 8.00 0.68 -4.87 116.55 116.16 2ds9 n ASP 536 Ca 0.10 -0.37 -0.18 0.00 0.71 0.00 0.00 54.79 55.05 2ds9 n ASP 536 Cb 0.30 -4.92 -0.13 0.00 -0.02 0.00 0.00 41.12 36.34 2ds9 n ASP 536 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2ds9 h VAL 537 N -1.76 1.43 -1.88 2.53 2.07 -0.96 -3.47 116.25 114.21 2ds9 h VAL 537 Ca -0.54 -2.39 -0.50 0.00 0.82 0.00 0.00 66.70 64.09 2ds9 h VAL 537 Cb 1.37 3.03 -0.04 0.00 -1.52 0.00 0.00 31.29 34.13 2ds9 h VAL 537 CO 0.57 0.62 -0.45 -0.83 0.02 0.00 0.00 177.57 177.50 2ds9 s GLY 538 N -4.52 1.74 0.24 2.17 0.00 -0.93 -4.92 107.32 101.09 2ds9 s GLY 538 Ca -0.19 -1.63 0.22 0.00 0.00 0.00 0.00 44.72 43.13 2ds9 s GLY 538 CO 0.73 -1.56 1.13 -0.55 0.00 0.00 0.00 173.10 172.86 2ds9 h ASP 539 N 1.26 0.00 -4.29 1.64 3.32 -0.71 -3.42 116.42 114.22 2ds9 h ASP 539 Ca -0.45 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.50 2ds9 h ASP 539 Cb 1.25 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.58 2ds9 h ASP 539 CO 0.58 0.05 -0.13 0.54 -1.72 0.00 0.00 179.24 178.57 2ds9 s VAL 540 N -3.30 0.01 -0.07 -1.35 0.11 -0.90 -4.42 120.40 110.49 2ds9 s VAL 540 Ca 0.01 -0.10 0.03 0.00 -2.93 0.00 0.00 61.98 58.98 2ds9 s VAL 540 Cb 0.09 -0.71 0.01 0.00 -1.53 0.00 0.00 36.38 34.24 2ds9 s VAL 540 CO 0.77 -0.06 -0.14 0.00 -3.33 0.00 0.00 175.10 172.34 2ds9 s ALA 541 N -0.28 1.41 -0.48 1.54 0.00 -1.04 0.92 121.76 123.83 2ds9 s ALA 541 Ca -0.04 -0.51 -0.13 0.00 0.00 0.00 0.00 51.96 51.28 2ds9 s ALA 541 Cb -0.03 -0.61 0.10 0.00 0.00 0.00 0.00 23.12 22.58 2ds9 s ALA 541 CO 0.03 0.14 0.39 -0.06 0.00 0.00 0.00 175.76 176.25 2ds9 s PHE 542 N 0.62 3.31 0.28 0.00 0.08 -0.64 -1.63 117.98 120.00 2ds9 s PHE 542 Ca -0.15 -1.40 -0.02 0.00 0.12 0.00 0.00 56.93 55.48 2ds9 s PHE 542 Cb -0.16 -3.41 -0.02 0.00 -0.57 0.00 0.00 43.02 38.86 2ds9 s PHE 542 CO 0.04 -0.93 0.33 0.14 -0.10 0.00 0.00 175.22 174.71 2ds9 s VAL 543 N 1.52 0.00 0.76 -0.44 -7.23 -1.11 -3.75 120.40 110.15 2ds9 s VAL 543 Ca 0.04 -1.76 -0.12 0.00 -1.81 0.00 0.00 61.98 58.33 2ds9 s VAL 543 Cb -0.26 -2.48 0.05 0.00 0.56 0.00 0.00 36.38 34.25 2ds9 s VAL 543 CO 0.03 0.00 1.14 -1.59 -0.31 0.00 0.00 175.10 174.37 2ds9 s LYS 544 N -3.66 2.32 0.20 4.82 -2.85 -1.26 -1.30 119.74 118.02 2ds9 s LYS 544 Ca 0.34 0.23 -0.11 0.00 -1.00 0.00 0.00 55.97 55.43 2ds9 s LYS 544 Cb 0.02 -1.99 0.18 0.00 -2.06 0.00 0.00 37.83 33.99 2ds9 s LYS 544 CO 0.17 -1.36 1.82 -0.97 0.10 0.00 0.00 175.35 175.10 2ds9 h ASN 545 N -0.88 0.55 -0.26 0.03 -1.24 -1.17 -2.77 115.58 109.84 2ds9 h ASN 545 Ca -0.46 0.02 0.05 0.00 0.71 0.00 0.00 56.30 56.62 2ds9 h ASN 545 Cb 1.30 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 40.24 2ds9 h ASN 545 CO 0.65 0.37 0.18 0.44 -1.29 0.00 0.00 177.43 177.78 2ds9 h ASP 546 N 0.68 0.11 -0.27 1.15 5.19 -1.93 -2.42 116.42 118.93 2ds9 h ASP 546 Ca 0.26 -0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.59 2ds9 h ASP 546 Cb 0.10 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.57 2ds9 h ASP 546 CO -0.14 0.08 -0.10 0.74 -3.12 0.00 0.00 179.24 176.69 2ds9 h THR 547 N 0.13 1.25 -0.31 0.35 2.02 -1.87 -0.71 112.91 113.76 2ds9 h THR 547 Ca 0.12 -1.10 -0.05 0.00 0.77 0.00 0.00 66.41 66.15 2ds9 h THR 547 Cb 0.30 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 2ds9 h THR 547 CO -0.02 0.37 0.01 0.58 0.37 0.00 0.00 175.52 176.84 2ds9 h VAL 548 N 0.61 1.25 -0.25 3.16 2.07 -1.56 -3.05 116.25 118.48 2ds9 h VAL 548 Ca 0.11 -0.91 -0.10 0.00 0.82 0.00 0.00 66.70 66.62 2ds9 h VAL 548 Cb 0.54 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2ds9 h VAL 548 CO 0.03 0.30 -0.26 -0.50 0.02 0.00 0.00 177.57 177.16 2ds9 h TRP 549 N 0.35 0.55 0.00 1.57 4.06 -1.52 -3.08 115.95 117.87 2ds9 h TRP 549 Ca 0.09 -0.12 0.00 0.00 2.06 0.00 0.00 58.89 60.92 2ds9 h TRP 549 Cb 0.41 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.44 2ds9 h TRP 549 CO 0.03 0.71 0.00 0.39 -3.56 0.00 0.00 178.44 176.01 2ds9 n GLU 550 N -4.11 0.22 -0.06 0.49 1.02 -0.30 -3.74 120.64 114.15 2ds9 n GLU 550 Ca -0.00 0.25 0.02 0.00 -0.02 0.00 0.00 57.16 57.40 2ds9 n GLU 550 Cb 0.41 -1.79 0.06 0.00 -0.02 0.00 0.00 31.44 30.10 2ds9 n GLU 550 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2ds9 n ASN 551 N -2.17 2.30 -4.62 1.62 3.02 -1.16 -3.27 115.26 110.98 2ds9 n ASN 551 Ca 0.05 -1.95 -0.28 0.00 -0.03 0.00 0.00 54.58 52.37 2ds9 n ASN 551 Cb 0.37 -0.09 -0.11 0.00 -0.61 0.00 0.00 39.78 39.35 2ds9 n ASN 551 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2ds9 s THR 552 N -0.96 1.92 -1.49 3.41 -4.23 -1.17 -4.66 115.64 108.46 2ds9 s THR 552 Ca 0.09 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.51 2ds9 s THR 552 Cb 0.05 -2.95 0.06 0.00 1.34 0.00 0.00 72.50 70.99 2ds9 s THR 552 CO 0.06 0.00 0.77 0.59 -0.54 0.00 0.00 174.62 175.50 2ds9 n ASN 553 N -0.97 -2.80 -1.93 3.99 4.13 0.77 -2.00 115.26 116.47 2ds9 n ASN 553 Ca -0.05 -0.87 -0.19 0.00 1.68 0.00 0.00 54.58 55.15 2ds9 n ASN 553 Cb 0.67 -3.56 -0.03 0.00 -1.54 0.00 0.00 39.78 35.32 2ds9 n ASN 553 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ds9 n GLY 554 N -1.67 0.22 0.08 7.41 0.00 -1.26 -4.90 105.19 105.07 2ds9 n GLY 554 Ca -0.10 -0.11 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 2ds9 n GLY 554 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ds9 h GLU 555 N 0.00 0.08 0.02 1.61 4.39 -1.64 -3.40 114.58 115.64 2ds9 h GLU 555 Ca -0.42 -0.13 -0.37 0.00 0.34 0.00 0.00 59.36 58.77 2ds9 h GLU 555 Cb 1.29 0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 29.93 2ds9 h GLU 555 CO 0.53 0.97 -2.33 0.45 -1.16 0.00 0.00 179.01 177.48 2ds9 n SER 556 N -3.35 1.34 0.00 1.42 2.88 -1.20 -4.93 113.62 109.78 2ds9 n SER 556 Ca -0.06 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2ds9 n SER 556 Cb 0.98 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.40 2ds9 n SER 556 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2ds9 n THR 557 N -3.13 0.00 -2.22 2.46 -2.24 -1.26 -4.95 114.28 102.95 2ds9 n THR 557 Ca -0.38 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 60.99 2ds9 n THR 557 Cb 1.05 -0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 2ds9 n THR 557 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ds9 s ALA 558 N -2.30 3.51 0.62 6.98 0.00 -1.26 -4.60 121.76 124.71 2ds9 s ALA 558 Ca 0.00 1.12 0.21 0.00 0.00 0.00 0.00 51.96 53.29 2ds9 s ALA 558 Cb 0.00 -3.47 0.80 0.00 0.00 0.00 0.00 23.12 20.46 2ds9 s ALA 558 CO 0.00 -0.53 1.33 0.38 0.00 0.00 0.00 175.76 176.94 2ds9 h ASP 559 N 4.83 0.00 0.38 0.00 2.03 -2.00 1.01 116.42 122.67 2ds9 h ASP 559 Ca -0.46 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 55.79 2ds9 h ASP 559 Cb 1.22 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.71 2ds9 h ASP 559 CO 0.74 0.00 -1.66 -2.67 -1.03 0.00 0.00 179.24 174.62 2ds9 n TRP 560 N -3.11 0.41 -0.04 4.15 4.27 -1.26 -4.33 117.44 117.52 2ds9 n TRP 560 Ca 0.15 0.12 -0.09 0.00 -3.89 0.00 0.00 57.50 53.80 2ds9 n TRP 560 Cb 1.27 -0.75 -0.15 0.00 -1.36 0.00 0.00 31.31 30.32 2ds9 n TRP 560 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2ds9 n ALA 561 N -2.29 1.51 -0.05 -1.67 0.00 0.31 -4.57 120.51 113.74 2ds9 n ALA 561 Ca -0.06 -0.92 -0.01 0.00 0.00 0.00 0.00 53.44 52.44 2ds9 n ALA 561 Cb 0.64 -0.66 -0.01 0.00 0.00 0.00 0.00 19.45 19.41 2ds9 n ALA 561 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ds9 n LYS 562 N -2.96 -0.06 0.00 0.00 5.02 0.89 -1.20 118.16 119.85 2ds9 n LYS 562 Ca -0.21 0.86 0.01 0.00 -2.02 0.00 0.00 58.31 56.95 2ds9 n LYS 562 Cb 1.08 -1.28 0.07 0.00 -0.02 0.00 0.00 35.03 34.88 2ds9 n LYS 562 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ds9 n ASN 563 N -3.15 0.00 -4.76 4.39 3.02 -1.26 -4.06 115.26 109.44 2ds9 n ASN 563 Ca 0.00 -1.82 -0.40 0.00 -0.03 0.00 0.00 54.58 52.33 2ds9 n ASN 563 Cb 0.03 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.15 2ds9 n ASN 563 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2ds9 s LEU 564 N -1.08 4.60 -0.17 3.41 1.43 -0.34 -4.97 118.68 121.56 2ds9 s LEU 564 Ca 0.04 1.75 0.01 0.00 -1.03 0.00 0.00 54.13 54.90 2ds9 s LEU 564 Cb 0.02 -3.41 0.01 0.00 0.03 0.00 0.00 46.19 42.84 2ds9 s LEU 564 CO 0.03 0.17 -0.20 -0.75 0.23 0.00 0.00 176.35 175.83 2ds9 s LYS 565 N -1.05 3.02 0.22 1.70 2.36 -1.26 -0.16 119.74 124.57 2ds9 s LYS 565 Ca 0.38 -0.83 -0.15 0.00 -2.55 0.00 0.00 55.97 52.82 2ds9 s LYS 565 Cb -0.24 -2.54 0.24 0.00 -1.05 0.00 0.00 37.83 34.24 2ds9 s LYS 565 CO 0.28 -0.13 1.60 0.00 1.55 0.00 0.00 175.35 178.66 2ds9 h ARG 566 N 7.69 -0.05 0.00 4.03 3.08 -1.92 0.44 114.38 127.65 2ds9 h ARG 566 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 2ds9 h ARG 566 Cb 1.16 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.22 2ds9 h ARG 566 CO 0.60 -0.03 0.04 0.39 -1.07 0.00 0.00 179.97 179.91 2ds9 n GLU 567 N -5.47 0.00 -0.09 0.04 -0.58 -1.26 -0.43 120.64 112.85 2ds9 n GLU 567 Ca 0.08 0.37 0.07 0.00 -0.42 0.00 0.00 57.16 57.26 2ds9 n GLU 567 Cb 0.37 -1.54 0.27 0.00 -0.57 0.00 0.00 31.44 29.96 2ds9 n GLU 567 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2ds9 n ASP 568 N -1.36 1.28 -4.45 1.62 8.00 0.15 -4.85 116.55 116.94 2ds9 n ASP 568 Ca 0.00 -1.81 -0.25 0.00 0.71 0.00 0.00 54.79 53.44 2ds9 n ASP 568 Cb 0.04 -0.12 -0.11 0.00 -0.02 0.00 0.00 41.12 40.91 2ds9 n ASP 568 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ds9 s PHE 569 N -1.75 2.28 0.04 1.24 0.08 0.43 0.12 117.98 120.42 2ds9 s PHE 569 Ca 0.24 -0.34 -0.02 0.00 0.12 0.00 0.00 56.93 56.92 2ds9 s PHE 569 Cb 0.13 -1.04 -0.03 0.00 -0.57 0.00 0.00 43.02 41.51 2ds9 s PHE 569 CO 0.18 0.64 0.01 1.03 -0.10 0.00 0.00 175.22 176.98 2ds9 s ARG 570 N -3.21 0.55 -0.10 0.44 1.81 -0.17 -4.50 118.95 113.76 2ds9 s ARG 570 Ca 0.27 -0.97 -0.03 0.00 -1.72 0.00 0.00 55.73 53.28 2ds9 s ARG 570 Cb -0.06 0.20 -0.03 0.00 -0.45 0.00 0.00 34.95 34.61 2ds9 s ARG 570 CO 0.13 -0.12 0.02 -0.51 -0.68 0.00 0.00 175.30 174.14 2ds9 s LEU 571 N -2.42 3.66 -0.26 2.53 1.43 0.22 -0.46 118.68 123.37 2ds9 s LEU 571 Ca -0.01 0.15 -0.17 0.00 -1.03 0.00 0.00 54.13 53.06 2ds9 s LEU 571 Cb 0.02 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 2ds9 s LEU 571 CO -0.07 0.34 0.49 -0.76 0.23 0.00 0.00 176.35 176.59 2ds9 s LEU 572 N -0.67 4.05 0.57 1.79 1.43 0.20 -2.22 118.68 123.83 2ds9 s LEU 572 Ca 0.11 0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 53.69 2ds9 s LEU 572 Cb -0.12 -2.63 0.03 0.00 0.03 0.00 0.00 46.19 43.51 2ds9 s LEU 572 CO 0.02 -0.27 0.81 0.00 0.23 0.00 0.00 176.35 177.14 2ds9 h LEU 574 N -0.02 0.00 -0.26 0.00 3.38 -1.88 -2.76 115.31 113.78 2ds9 h LEU 574 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2ds9 h LEU 574 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2ds9 h LEU 574 CO 0.55 0.61 0.00 -0.90 0.09 0.00 0.00 178.44 178.79 2ds9 n ASP 575 N -3.25 0.23 -2.99 -0.43 5.68 -1.26 -4.87 116.55 109.66 2ds9 n ASP 575 Ca 0.01 -1.76 -0.02 0.00 -0.50 0.00 0.00 54.79 52.52 2ds9 n ASP 575 Cb 0.78 -0.11 0.01 0.00 -1.14 0.00 0.00 41.12 40.66 2ds9 n ASP 575 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ds9 n GLY 576 N 0.30 -1.16 3.30 6.12 0.00 -1.04 -5.05 105.19 107.66 2ds9 n GLY 576 Ca 0.00 0.44 -0.12 0.00 0.00 0.00 0.00 46.02 46.34 2ds9 n GLY 576 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ds9 s THR 577 N -3.06 0.06 -0.15 2.61 2.01 -1.26 -4.89 115.64 110.97 2ds9 s THR 577 Ca 0.07 -0.53 0.02 0.00 0.31 0.00 0.00 61.69 61.55 2ds9 s THR 577 Cb -0.01 -0.94 0.01 0.00 0.01 0.00 0.00 72.50 71.57 2ds9 s THR 577 CO 0.70 -0.29 -0.19 -0.13 -0.69 0.00 0.00 174.62 174.01 2ds9 s ARG 578 N -2.48 3.09 0.19 4.92 0.52 -1.26 -1.37 118.95 122.56 2ds9 s ARG 578 Ca -0.05 -0.82 0.10 0.00 -0.52 0.00 0.00 55.73 54.44 2ds9 s ARG 578 Cb -0.01 -2.51 -0.04 0.00 0.52 0.00 0.00 34.95 32.91 2ds9 s ARG 578 CO -0.03 -0.01 -0.20 0.15 0.02 0.00 0.00 175.30 175.24 2ds9 s LYS 579 N 0.83 1.39 1.13 3.54 1.02 -0.94 -4.92 119.74 121.79 2ds9 s LYS 579 Ca -0.06 -1.49 -0.12 0.00 0.02 0.00 0.00 55.97 54.32 2ds9 s LYS 579 Cb -0.15 -1.51 0.27 0.00 -0.52 0.00 0.00 37.83 35.91 2ds9 s LYS 579 CO -0.02 0.31 1.05 -2.14 -0.92 0.00 0.00 175.35 173.63 2ds9 s PRO 580 N -2.88 -0.68 0.00 -1.68 0.02 -1.26 -0.61 135.00 127.91 2ds9 s PRO 580 Ca 0.19 0.97 0.23 0.00 0.02 0.00 0.00 61.00 62.41 2ds9 s PRO 580 Cb -0.06 -1.57 1.28 0.00 0.02 0.00 0.00 34.50 34.16 2ds9 s PRO 580 CO 0.08 -3.60 1.83 1.33 -0.33 0.00 0.00 177.00 176.32 2ds9 n VAL 581 N -4.85 0.03 0.75 3.83 0.24 -1.26 -2.47 118.33 114.59 2ds9 n VAL 581 Ca 0.04 -0.06 0.11 0.00 -2.04 0.00 0.00 64.34 62.39 2ds9 n VAL 581 Cb 0.54 -0.21 0.05 0.00 -1.47 0.00 0.00 33.84 32.75 2ds9 n VAL 581 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2ds9 n THR 582 N -0.64 0.10 -0.92 3.34 -2.24 -1.26 -4.12 114.28 108.54 2ds9 n THR 582 Ca 0.17 -0.14 -0.22 0.00 -2.27 0.00 0.00 64.05 61.59 2ds9 n THR 582 Cb 0.13 0.37 0.08 0.00 -2.10 0.00 0.00 70.33 68.81 2ds9 n THR 582 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2ds9 n GLU 583 N -1.77 2.09 -0.16 -0.78 4.07 -1.03 -4.65 120.64 118.40 2ds9 n GLU 583 Ca 0.03 -2.25 -0.04 0.00 -0.06 0.00 0.00 57.16 54.85 2ds9 n GLU 583 Cb 0.39 -1.88 0.16 0.00 -0.06 0.00 0.00 31.44 30.06 2ds9 n GLU 583 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2ds9 h ALA 584 N 1.57 1.17 0.00 4.31 0.00 -1.79 -2.42 119.26 122.11 2ds9 h ALA 584 Ca 0.43 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2ds9 h ALA 584 Cb 1.33 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2ds9 h ALA 584 CO 1.01 0.57 -0.02 0.37 0.00 0.00 0.00 179.25 181.18 2ds9 h GLN 585 N 0.87 0.00 -0.12 0.00 5.75 -1.95 -2.04 115.11 117.63 2ds9 h GLN 585 Ca 0.19 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.69 2ds9 h GLN 585 Cb 0.29 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.84 2ds9 h GLN 585 CO -0.00 0.02 0.00 -1.13 -2.65 0.00 0.00 178.83 175.07 2ds9 n SER 586 N -3.25 2.58 -2.87 -0.69 3.41 -0.94 -4.70 113.62 107.16 2ds9 n SER 586 Ca -0.02 -2.41 -0.12 0.00 -0.26 0.00 0.00 58.87 56.06 2ds9 n SER 586 Cb 0.16 -0.24 0.04 0.00 -0.26 0.00 0.00 64.21 63.91 2ds9 n SER 586 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ds9 s HIS 588 N -1.43 2.47 -0.10 0.00 -0.00 -1.15 -4.73 115.29 110.35 2ds9 s HIS 588 Ca 0.29 -0.46 0.16 0.00 -0.00 0.00 0.00 55.06 55.05 2ds9 s HIS 588 Cb 0.37 -1.41 -0.19 0.00 -0.00 0.00 0.00 32.58 31.35 2ds9 s HIS 588 CO -0.05 0.54 0.66 1.28 -0.00 0.00 0.00 174.74 177.18 2ds9 n LEU 589 N -0.87 0.72 0.00 5.38 4.77 0.15 -4.76 117.00 122.39 2ds9 n LEU 589 Ca -0.05 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 2ds9 n LEU 589 Cb 0.63 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 2ds9 n LEU 589 CO 0.43 0.26 0.00 0.00 -1.33 0.00 0.00 177.39 176.75 2ds9 n ALA 590 N -2.48 0.00 -2.78 -1.18 0.00 -1.23 -4.98 120.51 107.86 2ds9 n ALA 590 Ca -0.15 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.94 2ds9 n ALA 590 Cb 0.93 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.31 2ds9 n ALA 590 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2ds9 s VAL 591 N -2.00 5.40 0.07 0.00 -7.23 -1.26 -1.16 120.40 114.21 2ds9 s VAL 591 Ca 0.00 0.18 0.01 0.00 -1.81 0.00 0.00 61.98 60.36 2ds9 s VAL 591 Cb 0.00 -3.42 -0.04 0.00 0.56 0.00 0.00 36.38 33.48 2ds9 s VAL 591 CO 0.00 0.50 0.17 0.00 -0.31 0.00 0.00 175.10 175.46 2ds9 s ALA 592 N -0.11 3.86 0.37 1.32 0.00 0.34 -4.86 121.76 122.69 2ds9 s ALA 592 Ca 0.10 -0.90 -0.26 0.00 0.00 0.00 0.00 51.96 50.90 2ds9 s ALA 592 Cb -0.11 -1.70 -0.09 0.00 0.00 0.00 0.00 23.12 21.22 2ds9 s ALA 592 CO 0.00 0.80 1.13 -2.14 0.00 0.00 0.00 175.76 175.55 2ds9 s PRO 593 N -2.47 4.21 0.53 0.00 0.02 -1.26 -1.04 135.00 134.98 2ds9 s PRO 593 Ca 0.33 1.77 -0.22 0.00 0.02 0.00 0.00 61.00 62.89 2ds9 s PRO 593 Cb -0.13 -2.76 -0.06 0.00 0.02 0.00 0.00 34.50 31.57 2ds9 s PRO 593 CO 0.26 -0.16 1.34 0.09 -0.33 0.00 0.00 177.00 178.20 2ds9 n ASN 594 N 0.30 2.65 -4.65 2.53 4.13 -1.26 -4.46 115.26 114.49 2ds9 n ASN 594 Ca 0.03 1.00 -0.37 0.00 1.68 0.00 0.00 54.58 56.92 2ds9 n ASN 594 Cb 0.47 -1.56 0.07 0.00 -1.54 0.00 0.00 39.78 37.21 2ds9 n ASN 594 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2ds9 n HIS 595 N -0.91 1.07 -3.82 3.10 8.25 -1.26 -4.65 115.22 117.00 2ds9 n HIS 595 Ca 0.10 0.42 -0.10 0.00 -0.26 0.00 0.00 57.72 57.88 2ds9 n HIS 595 Cb 0.44 -2.16 -0.06 0.00 1.12 0.00 0.00 29.99 29.34 2ds9 n HIS 595 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ds9 s ALA 596 N -1.57 -0.45 0.01 -1.41 0.00 0.12 -2.00 121.76 116.45 2ds9 s ALA 596 Ca 0.78 -0.51 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 2ds9 s ALA 596 Cb -0.38 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 2ds9 s ALA 596 CO 0.46 -0.66 0.87 0.08 0.00 0.00 0.00 175.76 176.51 2ds9 s VAL 597 N -3.89 4.84 0.31 0.00 1.01 -0.44 0.16 120.40 122.37 2ds9 s VAL 597 Ca 0.10 1.84 0.10 0.00 0.00 0.00 0.00 61.98 64.02 2ds9 s VAL 597 Cb 0.02 -4.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 2ds9 s VAL 597 CO -0.05 0.24 -0.08 0.68 0.00 0.00 0.00 175.10 175.89 2ds9 s VAL 598 N 0.64 2.68 0.38 2.92 -7.23 0.15 -0.93 120.40 119.01 2ds9 s VAL 598 Ca 0.45 -2.14 -0.15 0.00 -1.81 0.00 0.00 61.98 58.33 2ds9 s VAL 598 Cb -0.20 -2.62 0.05 0.00 0.56 0.00 0.00 36.38 34.17 2ds9 s VAL 598 CO 0.25 -0.30 0.77 -0.94 -0.31 0.00 0.00 175.10 174.56 2ds9 s SER 599 N -3.62 0.05 0.30 4.85 1.04 -0.19 -3.04 113.70 113.09 2ds9 s SER 599 Ca 0.32 -1.14 -0.28 0.00 0.48 0.00 0.00 55.95 55.33 2ds9 s SER 599 Cb -0.03 0.83 -0.09 0.00 0.10 0.00 0.00 66.02 66.84 2ds9 s SER 599 CO 0.18 -1.65 1.03 -0.60 0.98 0.00 0.00 173.24 173.17 2ds9 s ARG 600 N -2.44 4.59 0.30 4.02 3.52 -1.26 0.62 118.95 128.30 2ds9 s ARG 600 Ca 0.16 1.59 0.01 0.00 -0.13 0.00 0.00 55.73 57.37 2ds9 s ARG 600 Cb -0.05 -3.02 0.56 0.00 -1.56 0.00 0.00 34.95 30.88 2ds9 s ARG 600 CO 0.12 0.22 1.87 0.66 -0.81 0.00 0.00 175.30 177.37 2ds9 h SER 601 N 3.52 0.91 0.00 -2.12 4.64 -1.90 0.19 113.55 118.79 2ds9 h SER 601 Ca -0.47 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ds9 h SER 601 Cb 1.21 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 2ds9 h SER 601 CO 0.66 0.53 0.00 -0.90 -0.87 0.00 0.00 176.83 176.25 2ds9 n ASP 602 N -4.55 0.00 0.00 4.97 5.75 -1.26 -2.69 116.55 118.78 2ds9 n ASP 602 Ca 0.16 -0.55 0.00 0.00 -0.01 0.00 0.00 54.79 54.39 2ds9 n ASP 602 Cb 0.29 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 2ds9 n ASP 602 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2ds9 n ARG 603 N -0.87 3.88 -0.31 0.11 5.12 0.53 -4.82 116.66 120.31 2ds9 n ARG 603 Ca 0.08 -0.01 0.17 0.00 -1.93 0.00 0.00 57.85 56.15 2ds9 n ARG 603 Cb 0.04 -0.31 0.43 0.00 -1.16 0.00 0.00 32.46 31.45 2ds9 n ARG 603 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2ds9 h ALA 604 N 0.00 1.97 -0.28 7.54 0.00 -0.97 -0.79 119.26 126.73 2ds9 h ALA 604 Ca 0.00 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2ds9 h ALA 604 Cb 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2ds9 h ALA 604 CO 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 179.25 178.92 2ds9 h ALA 605 N 1.62 0.38 0.00 0.00 0.00 -1.88 -1.43 119.26 117.96 2ds9 h ALA 605 Ca 0.54 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 2ds9 h ALA 605 Cb 1.10 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2ds9 h ALA 605 CO -0.28 0.14 -0.41 1.25 0.00 0.00 0.00 179.25 179.95 2ds9 h HIS 606 N 0.29 0.00 -0.01 0.00 6.17 -1.67 -2.31 115.15 117.61 2ds9 h HIS 606 Ca 0.08 0.00 -0.10 0.00 0.71 0.00 0.00 60.37 61.06 2ds9 h HIS 606 Cb 0.46 0.00 0.01 0.00 2.52 0.00 0.00 27.41 30.40 2ds9 h HIS 606 CO 0.04 0.41 -0.38 0.28 0.71 0.00 0.00 177.93 178.98 2ds9 h VAL 607 N 0.00 1.48 -0.24 5.26 2.07 -1.09 -2.68 116.25 121.05 2ds9 h VAL 607 Ca -0.00 -1.95 0.05 0.00 0.82 0.00 0.00 66.70 65.62 2ds9 h VAL 607 Cb 1.23 2.62 -0.05 0.00 -1.52 0.00 0.00 31.29 33.58 2ds9 h VAL 607 CO 0.05 0.55 -0.09 -0.08 0.02 0.00 0.00 177.57 178.03 2ds9 h GLU 608 N -0.30 -0.04 0.21 1.57 4.81 -1.23 -1.59 114.58 118.01 2ds9 h GLU 608 Ca -0.04 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2ds9 h GLU 608 Cb 1.11 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 2ds9 h GLU 608 CO 0.08 -0.03 -0.25 0.37 -0.73 0.00 0.00 179.01 178.45 2ds9 h GLN 609 N -0.04 -0.46 -0.29 1.92 4.15 -1.47 -2.13 115.11 116.79 2ds9 h GLN 609 Ca 0.12 0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.66 2ds9 h GLN 609 Cb 0.23 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 2ds9 h GLN 609 CO -0.27 -0.31 0.29 0.28 -1.93 0.00 0.00 178.83 176.89 2ds9 h VAL 610 N -0.48 0.51 0.06 2.39 2.07 -1.40 -3.02 116.25 116.38 2ds9 h VAL 610 Ca -0.03 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.40 2ds9 h VAL 610 Cb 0.42 0.78 0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2ds9 h VAL 610 CO -0.05 0.00 -0.40 0.25 0.02 0.00 0.00 177.57 177.39 2ds9 h LEU 611 N 0.00 0.25 -1.62 2.57 5.85 -0.95 -2.20 115.31 119.21 2ds9 h LEU 611 Ca 0.14 -0.93 0.03 0.00 0.84 0.00 0.00 57.88 57.95 2ds9 h LEU 611 Cb 0.71 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 2ds9 h LEU 611 CO -0.00 1.16 0.29 -0.07 -0.34 0.00 0.00 178.44 179.49 2ds9 h LEU 612 N -0.62 0.43 -0.52 2.25 3.38 -1.28 0.16 115.31 119.11 2ds9 h LEU 612 Ca -0.07 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.74 2ds9 h LEU 612 Cb 1.28 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2ds9 h LEU 612 CO 0.08 0.30 -0.73 -0.74 0.09 0.00 0.00 178.44 177.44 2ds9 h HIS 613 N 0.50 0.14 -0.04 1.13 2.76 -1.56 -2.15 115.15 115.94 2ds9 h HIS 613 Ca 0.18 -0.07 -0.12 0.00 -2.20 0.00 0.00 60.37 58.16 2ds9 h HIS 613 Cb 0.09 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 2ds9 h HIS 613 CO -0.00 0.79 -0.52 1.96 -1.30 0.00 0.00 177.93 178.87 2ds9 h GLN 614 N 0.06 0.10 -0.00 5.26 1.08 -0.39 -3.05 115.11 118.17 2ds9 h GLN 614 Ca -0.02 -0.06 -0.17 0.00 -1.45 0.00 0.00 58.65 56.96 2ds9 h GLN 614 Cb 1.29 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.70 2ds9 h GLN 614 CO 0.10 0.59 -0.79 -0.56 -0.95 0.00 0.00 178.83 177.23 2ds9 h GLN 615 N 0.08 0.03 -0.35 1.46 3.07 -0.53 -0.77 115.11 118.10 2ds9 h GLN 615 Ca -0.00 -0.03 0.07 0.00 0.09 0.00 0.00 58.65 58.77 2ds9 h GLN 615 Cb 0.94 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 28.49 2ds9 h GLN 615 CO 0.07 0.81 0.24 0.00 0.09 0.00 0.00 178.83 180.04 2ds9 h ALA 616 N 1.18 2.11 0.08 0.06 0.00 -1.29 0.17 119.26 121.57 2ds9 h ALA 616 Ca -0.01 -0.01 -0.37 0.00 0.00 0.00 0.00 54.91 54.52 2ds9 h ALA 616 Cb 1.40 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 2ds9 h ALA 616 CO 0.11 -0.19 -2.14 1.28 0.00 0.00 0.00 179.25 178.31 2ds9 n LEU 617 N -4.47 2.60 0.00 0.00 4.77 -0.94 -3.01 117.00 115.95 2ds9 n LEU 617 Ca 0.04 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2ds9 n LEU 617 Cb 0.30 -0.96 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 2ds9 n LEU 617 CO 0.35 0.85 0.27 0.49 -1.33 0.00 0.00 177.39 178.02 2ds9 n PHE 618 N -3.38 0.00 -0.69 -1.77 3.72 -0.34 -1.61 117.46 113.39 2ds9 n PHE 618 Ca -0.35 -0.10 0.00 0.00 -0.05 0.00 0.00 57.45 56.94 2ds9 n PHE 618 Cb 1.03 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.56 2ds9 n PHE 618 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ds9 n GLY 619 N -0.10 -1.87 0.39 1.37 0.00 0.59 -0.53 105.19 105.04 2ds9 n GLY 619 Ca 0.00 -1.54 0.17 0.00 0.00 0.00 0.00 46.02 44.65 2ds9 n GLY 619 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2ds9 h LYS 620 N 0.00 0.49 0.00 1.61 3.64 -1.80 -2.89 116.57 117.62 2ds9 h LYS 620 Ca 0.00 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 2ds9 h LYS 620 Cb 0.00 -0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 31.63 2ds9 h LYS 620 CO 0.00 0.33 -0.53 0.09 -2.27 0.00 0.00 179.45 177.06 2ds9 n ASN 621 N -4.56 1.58 -4.81 4.20 5.03 -1.26 -4.93 115.26 110.50 2ds9 n ASN 621 Ca 0.20 -3.30 -0.31 0.00 0.87 0.00 0.00 54.58 52.03 2ds9 n ASN 621 Cb 0.65 -0.45 0.04 0.00 -1.02 0.00 0.00 39.78 39.00 2ds9 n ASN 621 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 2ds9 s GLY 622 N -2.82 1.79 0.47 7.41 0.00 -1.09 -4.92 107.32 108.17 2ds9 s GLY 622 Ca 0.34 0.18 0.36 0.00 0.00 0.00 0.00 44.72 45.61 2ds9 s GLY 622 CO -0.07 0.50 1.61 0.50 0.00 0.00 0.00 173.10 175.64 2ds9 h LYS 623 N -0.45 0.04 0.00 2.90 6.56 -1.60 -2.55 116.57 121.47 2ds9 h LYS 623 Ca -0.45 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.14 2ds9 h LYS 623 Cb 1.21 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.87 2ds9 h LYS 623 CO 0.56 0.03 -0.11 0.09 -2.06 0.00 0.00 179.45 177.96 2ds9 n ASN 624 N -4.49 1.59 0.00 0.86 3.02 -0.63 -4.93 115.26 110.68 2ds9 n ASN 624 Ca 0.39 -2.51 0.00 0.00 -0.03 0.00 0.00 54.58 52.44 2ds9 n ASN 624 Cb 1.60 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 40.50 2ds9 n ASN 624 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ds9 h PRO 626 N 0.00 -0.31 0.38 0.00 0.11 -1.87 -3.16 132.00 127.15 2ds9 h PRO 626 Ca 0.00 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.11 2ds9 h PRO 626 Cb 0.00 0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.18 2ds9 h PRO 626 CO 0.00 -0.21 -0.19 -0.44 -0.21 0.00 0.00 178.00 176.95 2ds9 h ASP 627 N -0.32 -0.46 0.00 -2.05 3.32 -1.92 -3.42 116.42 111.56 2ds9 h ASP 627 Ca 0.09 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 2ds9 h ASP 627 Cb 0.56 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 2ds9 h ASP 627 CO -0.66 -0.32 -1.38 0.29 -1.72 0.00 0.00 179.24 175.45 2ds9 n LYS 628 N -5.32 0.16 -3.57 3.56 5.02 0.18 -5.07 118.16 113.11 2ds9 n LYS 628 Ca -0.11 0.05 -0.02 0.00 -2.02 0.00 0.00 58.31 56.21 2ds9 n LYS 628 Cb 0.23 -0.98 -0.06 0.00 -0.02 0.00 0.00 35.03 34.20 2ds9 n LYS 628 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2ds9 s PHE 629 N -2.13 -0.77 -0.35 2.13 5.36 -0.55 -5.04 117.98 116.64 2ds9 s PHE 629 Ca -0.09 1.44 -0.07 0.00 -0.96 0.00 0.00 56.93 57.25 2ds9 s PHE 629 Cb 0.03 0.46 0.04 0.00 -0.34 0.00 0.00 43.02 43.21 2ds9 s PHE 629 CO 0.14 -0.38 0.12 0.00 -1.46 0.00 0.00 175.22 173.64 2ds9 h LEU 631 N 8.24 0.23 -3.43 0.00 6.46 -1.13 -2.04 115.31 123.64 2ds9 h LEU 631 Ca -0.23 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.56 2ds9 h LEU 631 Cb 1.08 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 41.01 2ds9 h LEU 631 CO 0.61 0.07 0.00 0.49 -0.62 0.00 0.00 178.44 179.00 2ds9 n PHE 632 N -4.41 1.71 -5.28 1.25 3.72 -1.26 -4.75 117.46 108.42 2ds9 n PHE 632 Ca 0.21 -0.74 -0.31 0.00 -0.05 0.00 0.00 57.45 56.56 2ds9 n PHE 632 Cb 0.89 -0.42 -0.16 0.00 -0.94 0.00 0.00 39.48 38.85 2ds9 n PHE 632 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2ds9 s LYS 633 N -2.62 2.13 0.00 -1.08 2.47 -0.77 -4.52 119.74 115.35 2ds9 s LYS 633 Ca 0.51 -0.91 0.00 0.00 -1.56 0.00 0.00 55.97 54.00 2ds9 s LYS 633 Cb 0.38 -2.02 0.00 0.00 -1.46 0.00 0.00 37.83 34.73 2ds9 s LYS 633 CO 0.16 0.53 0.30 -1.13 0.16 0.00 0.00 175.35 175.36 2ds9 n SER 634 N 2.51 0.00 -2.91 1.43 3.41 -1.26 -4.86 113.62 111.94 2ds9 n SER 634 Ca -0.16 -1.07 -0.08 0.00 -0.26 0.00 0.00 58.87 57.30 2ds9 n SER 634 Cb 0.51 -0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.46 2ds9 n SER 634 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2ds9 n GLU 635 N 0.00 -2.55 -0.55 4.33 0.28 -1.26 -3.67 120.64 117.22 2ds9 n GLU 635 Ca 0.00 2.17 0.00 0.00 -0.16 0.00 0.00 57.16 59.17 2ds9 n GLU 635 Cb 0.51 -4.72 0.00 0.00 1.43 0.00 0.00 31.44 28.66 2ds9 n GLU 635 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 2ds9 n THR 636 N 0.23 0.00 1.01 3.84 5.66 -1.26 -4.78 114.28 118.98 2ds9 n THR 636 Ca 0.04 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.15 2ds9 n THR 636 Cb 0.32 -0.55 -0.05 0.00 -1.55 0.00 0.00 70.33 68.51 2ds9 n THR 636 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2ds9 n LYS 637 N -0.36 0.45 -3.86 1.09 5.02 -1.24 -4.88 118.16 114.37 2ds9 n LYS 637 Ca 0.00 -0.36 -0.26 0.00 -2.02 0.00 0.00 58.31 55.67 2ds9 n LYS 637 Cb 0.17 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.70 2ds9 n LYS 637 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ds9 n ASN 638 N -0.96 -2.31 -4.64 4.39 5.03 -1.26 -4.93 115.26 110.57 2ds9 n ASN 638 Ca 0.06 -0.86 -0.41 0.00 0.87 0.00 0.00 54.58 54.24 2ds9 n ASN 638 Cb 0.38 -3.69 -0.06 0.00 -1.02 0.00 0.00 39.78 35.39 2ds9 n ASN 638 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2ds9 s LEU 639 N -6.98 4.09 0.00 3.41 1.43 -1.26 -4.28 118.68 115.09 2ds9 s LEU 639 Ca 0.27 0.83 0.00 0.00 -1.03 0.00 0.00 54.13 54.21 2ds9 s LEU 639 Cb -0.14 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.12 2ds9 s LEU 639 CO 0.84 -0.39 0.00 0.18 0.23 0.00 0.00 176.35 177.22 2ds9 n LEU 640 N 5.62 0.00 -3.96 1.79 4.77 -1.26 -4.81 117.00 119.16 2ds9 n LEU 640 Ca 0.01 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.90 2ds9 n LEU 640 Cb 0.49 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 2ds9 n LEU 640 CO 0.44 0.00 -0.26 -0.36 -1.33 0.00 0.00 177.39 175.88 2ds9 s PHE 641 N 0.00 0.25 0.55 -1.77 0.08 -1.26 -4.53 117.98 111.30 2ds9 s PHE 641 Ca 0.00 -0.57 -0.21 0.00 0.12 0.00 0.00 56.93 56.27 2ds9 s PHE 641 Cb 0.00 -0.18 -0.04 0.00 -0.57 0.00 0.00 43.02 42.22 2ds9 s PHE 641 CO 0.00 -0.33 1.35 -0.80 -0.10 0.00 0.00 175.22 175.34 2ds9 s ASN 642 N -2.07 5.22 0.41 1.36 0.01 -1.26 -4.34 114.94 114.27 2ds9 s ASN 642 Ca -0.06 2.74 0.22 0.00 -0.71 0.00 0.00 52.86 55.06 2ds9 s ASN 642 Cb -0.02 -2.63 0.79 0.00 0.41 0.00 0.00 41.25 39.79 2ds9 s ASN 642 CO -0.04 -1.60 1.77 0.44 -1.51 0.00 0.00 177.10 176.15 2ds9 h ASP 643 N 1.38 0.00 -0.22 -1.22 5.19 -1.90 -3.11 116.42 116.54 2ds9 h ASP 643 Ca -0.51 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.90 2ds9 h ASP 643 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.81 2ds9 h ASP 643 CO 0.57 0.27 0.00 -0.46 -3.12 0.00 0.00 179.24 176.50 2ds9 n ASN 644 N -3.40 2.24 -4.66 6.45 0.23 -1.26 -4.79 115.26 110.06 2ds9 n ASN 644 Ca 0.00 -2.22 -0.43 0.00 -0.53 0.00 0.00 54.58 51.40 2ds9 n ASN 644 Cb 0.47 -0.44 -0.02 0.00 -2.08 0.00 0.00 39.78 37.71 2ds9 n ASN 644 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2ds9 s THR 645 N -1.62 4.33 -0.04 5.53 2.01 -1.18 -4.59 115.64 120.07 2ds9 s THR 645 Ca 0.18 1.60 -0.19 0.00 0.31 0.00 0.00 61.69 63.59 2ds9 s THR 645 Cb 0.13 -4.03 -0.13 0.00 0.01 0.00 0.00 72.50 68.48 2ds9 s THR 645 CO 0.07 -0.14 0.82 -0.08 -0.69 0.00 0.00 174.62 174.60 2ds9 h GLU 646 N 8.10 -0.40 -3.52 4.92 4.81 -0.24 -3.46 114.58 124.79 2ds9 h GLU 646 Ca -0.26 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.96 2ds9 h GLU 646 Cb 1.10 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 30.49 2ds9 h GLU 646 CO 0.97 -0.10 -0.04 0.00 -0.73 0.00 0.00 179.01 179.11 2ds9 s LEU 648 N -3.01 4.17 -0.07 0.00 1.43 -1.26 0.11 118.68 120.05 2ds9 s LEU 648 Ca 0.20 0.75 -0.03 0.00 -1.03 0.00 0.00 54.13 54.03 2ds9 s LEU 648 Cb -0.02 -2.75 -0.04 0.00 0.03 0.00 0.00 46.19 43.41 2ds9 s LEU 648 CO 0.09 -0.16 0.05 0.00 0.23 0.00 0.00 176.35 176.55 2ds9 s ALA 649 N 1.48 3.46 0.81 4.21 0.00 0.69 -4.61 121.76 127.81 2ds9 s ALA 649 Ca 0.26 -0.79 -0.13 0.00 0.00 0.00 0.00 51.96 51.30 2ds9 s ALA 649 Cb -0.16 -1.59 0.08 0.00 0.00 0.00 0.00 23.12 21.45 2ds9 s ALA 649 CO 0.10 0.62 1.20 0.15 0.00 0.00 0.00 175.76 177.83 2ds9 s LYS 650 N -1.10 1.62 -0.24 0.00 1.02 0.29 -0.54 119.74 120.79 2ds9 s LYS 650 Ca 0.16 1.75 -0.18 0.00 0.02 0.00 0.00 55.97 57.72 2ds9 s LYS 650 Cb -0.12 -1.78 -0.16 0.00 -0.52 0.00 0.00 37.83 35.26 2ds9 s LYS 650 CO 0.05 -2.22 -0.06 1.28 -0.92 0.00 0.00 175.35 173.48 2ds9 n LEU 651 N -3.32 1.93 -1.97 3.17 4.77 -1.26 -4.76 117.00 115.55 2ds9 n LEU 651 Ca 0.13 0.37 -0.01 0.00 -0.03 0.00 0.00 56.01 56.47 2ds9 n LEU 651 Cb 0.51 -0.90 -0.01 0.00 -2.33 0.00 0.00 43.42 40.68 2ds9 n LEU 651 CO 0.48 0.43 -0.25 0.61 -1.33 0.00 0.00 177.39 177.34 2ds9 n GLY 652 N 1.37 -3.71 0.00 -0.72 0.00 -1.26 -4.87 105.19 95.99 2ds9 n GLY 652 Ca -0.43 0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2ds9 n GLY 652 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ds9 n GLY 653 N 0.52 1.79 2.13 -0.02 0.00 -1.26 -4.92 105.19 103.43 2ds9 n GLY 653 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 2ds9 n GLY 653 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ds9 n ARG 654 N 0.00 -0.47 -2.20 1.61 1.74 -1.26 -4.81 116.66 111.28 2ds9 n ARG 654 Ca 0.00 0.30 -0.42 0.00 -0.77 0.00 0.00 57.85 56.96 2ds9 n ARG 654 Cb 0.00 -0.54 -0.03 0.00 -1.02 0.00 0.00 32.46 30.87 2ds9 n ARG 654 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2ds9 s PRO 655 N -1.49 4.27 0.56 5.56 0.02 -1.26 -5.03 135.00 137.62 2ds9 s PRO 655 Ca 0.06 1.99 -0.12 0.00 0.02 0.00 0.00 61.00 62.95 2ds9 s PRO 655 Cb -0.01 -3.61 -0.05 0.00 0.02 0.00 0.00 34.50 30.85 2ds9 s PRO 655 CO 0.23 -0.61 0.98 0.95 -0.33 0.00 0.00 177.00 178.22 2ds9 s THR 656 N 2.56 4.67 0.34 0.99 -4.23 -1.26 -4.69 115.64 114.03 2ds9 s THR 656 Ca 0.65 0.92 0.09 0.00 -1.18 0.00 0.00 61.69 62.16 2ds9 s THR 656 Cb -0.32 -3.81 0.32 0.00 1.34 0.00 0.00 72.50 70.03 2ds9 s THR 656 CO 0.27 -0.94 1.83 0.10 -0.54 0.00 0.00 174.62 175.34 2ds9 h TYR 657 N 0.22 0.89 -0.75 3.99 -0.00 -1.95 0.51 116.97 119.88 2ds9 h TYR 657 Ca -0.45 0.03 -0.02 0.00 0.00 0.00 0.00 58.73 58.28 2ds9 h TYR 657 Cb 1.19 -0.28 -0.03 0.00 0.00 0.00 0.00 36.73 37.61 2ds9 h TYR 657 CO 0.64 0.27 0.39 0.93 -0.00 0.00 0.00 178.16 180.39 2ds9 h GLU 658 N 0.70 1.06 -0.42 0.10 5.08 -1.94 0.73 114.58 119.89 2ds9 h GLU 658 Ca 0.51 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.69 2ds9 h GLU 658 Cb 0.85 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 2ds9 h GLU 658 CO -0.27 0.81 0.11 0.93 -1.00 0.00 0.00 179.01 179.59 2ds9 h GLU 659 N 1.04 0.67 -0.52 2.33 5.08 -0.55 0.49 114.58 123.12 2ds9 h GLU 659 Ca 0.26 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.42 2ds9 h GLU 659 Cb 0.07 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2ds9 h GLU 659 CO -0.04 0.67 0.13 -0.92 -1.00 0.00 0.00 179.01 177.86 2ds9 h TYR 660 N 0.54 0.87 0.00 4.33 3.20 0.41 -2.84 116.97 123.49 2ds9 h TYR 660 Ca 0.13 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 2ds9 h TYR 660 Cb 0.30 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 2ds9 h TYR 660 CO 0.02 0.76 -0.08 -0.07 -1.64 0.00 0.00 178.16 177.15 2ds9 h LEU 661 N 0.73 0.00 0.00 2.82 3.38 0.82 -3.48 115.31 119.57 2ds9 h LEU 661 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2ds9 h LEU 661 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2ds9 h LEU 661 CO 0.00 0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.22 2ds9 n GLY 662 N 0.94 -1.89 0.28 0.83 0.00 0.17 -4.31 105.19 101.22 2ds9 n GLY 662 Ca 0.03 -1.39 -0.05 0.00 0.00 0.00 0.00 46.02 44.61 2ds9 n GLY 662 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ds9 h THR 663 N 0.00 1.25 0.01 2.61 1.35 -1.88 -2.15 112.91 114.09 2ds9 h THR 663 Ca 0.00 -1.06 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 2ds9 h THR 663 Cb 0.00 0.92 -0.01 0.00 -1.73 0.00 0.00 68.15 67.33 2ds9 h THR 663 CO 0.00 0.37 -0.06 -0.33 -0.25 0.00 0.00 175.52 175.25 2ds9 h GLU 664 N 0.75 -0.08 -0.93 4.72 5.08 -1.96 -2.30 114.58 119.87 2ds9 h GLU 664 Ca 0.14 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.56 2ds9 h GLU 664 Cb 0.50 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.71 2ds9 h GLU 664 CO 0.03 -0.05 0.60 -0.92 -1.00 0.00 0.00 179.01 177.67 2ds9 h TYR 665 N -0.08 1.09 -0.36 4.33 3.20 -1.74 -1.63 116.97 121.78 2ds9 h TYR 665 Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2ds9 h TYR 665 Cb 0.09 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 37.98 2ds9 h TYR 665 CO -0.35 0.58 0.17 0.28 -1.64 0.00 0.00 178.16 177.20 2ds9 h VAL 666 N 1.08 1.13 -0.05 1.81 2.07 -1.31 -2.02 116.25 118.95 2ds9 h VAL 666 Ca 0.39 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.52 2ds9 h VAL 666 Cb 0.15 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 2ds9 h VAL 666 CO -0.14 0.14 -0.10 0.71 0.02 0.00 0.00 177.57 178.20 2ds9 h THR 667 N 0.50 1.42 -0.69 2.57 1.35 -0.71 -2.34 112.91 115.00 2ds9 h THR 667 Ca 0.13 -1.40 0.20 0.00 -0.55 0.00 0.00 66.41 64.78 2ds9 h THR 667 Cb 0.05 2.22 -0.03 0.00 -1.73 0.00 0.00 68.15 68.67 2ds9 h THR 667 CO -0.02 0.39 0.50 0.00 -0.25 0.00 0.00 175.52 176.14 2ds9 h ALA 668 N 0.48 2.66 0.12 6.62 0.00 -1.15 0.20 119.26 128.19 2ds9 h ALA 668 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.60 2ds9 h ALA 668 Cb 0.68 0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.54 2ds9 h ALA 668 CO 0.02 -0.86 -1.24 0.82 0.00 0.00 0.00 179.25 178.00 2ds9 h ILE 669 N 0.00 1.34 0.46 0.00 2.04 -1.26 -3.16 117.51 116.93 2ds9 h ILE 669 Ca 0.33 -2.61 -0.02 0.00 1.00 0.00 0.00 64.86 63.56 2ds9 h ILE 669 Cb 1.33 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 40.16 2ds9 h ILE 669 CO -0.00 0.78 -0.22 0.00 0.00 0.00 0.00 178.15 178.71 2ds9 h ALA 670 N 0.39 -0.62 -0.39 1.87 0.00 -0.08 -2.03 119.26 118.41 2ds9 h ALA 670 Ca -0.17 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.68 2ds9 h ALA 670 Cb 1.92 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.93 2ds9 h ALA 670 CO 0.23 -0.81 0.27 -0.91 0.00 0.00 0.00 179.25 178.03 2ds9 h ASN 671 N -0.68 0.06 0.67 0.00 2.35 -1.47 -1.04 115.58 115.48 2ds9 h ASN 671 Ca -0.06 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.48 2ds9 h ASN 671 Cb 0.51 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 2ds9 h ASN 671 CO 0.10 0.04 -0.94 0.25 -1.65 0.00 0.00 177.43 175.23 2ds9 h LEU 672 N 0.07 0.21 -0.31 1.61 5.85 -1.48 -3.33 115.31 117.93 2ds9 h LEU 672 Ca 0.18 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 2ds9 h LEU 672 Cb 0.63 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 2ds9 h LEU 672 CO -0.01 1.04 -0.39 0.11 -0.34 0.00 0.00 178.44 178.85 2ds9 h LYS 673 N 0.08 0.00 0.00 1.25 1.79 -0.44 -2.94 116.57 116.31 2ds9 h LYS 673 Ca -0.05 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.36 2ds9 h LYS 673 Cb 1.60 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.24 2ds9 h LYS 673 CO 0.14 0.39 -0.29 1.57 -1.08 0.00 0.00 179.45 180.18 2ds9 h LYS 674 N 0.00 0.00 -0.34 3.15 2.10 -1.61 -1.53 116.57 118.35 2ds9 h LYS 674 Ca -0.00 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.59 2ds9 h LYS 674 Cb 1.18 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.49 2ds9 h LYS 674 CO 0.05 0.29 -0.01 0.00 -2.00 0.00 0.00 179.45 177.77 2ds9 n SER 676 N -4.27 -0.24 0.00 0.00 3.41 -0.58 -5.02 113.62 106.92 2ds9 n SER 676 Ca 0.01 -1.55 0.00 0.00 -0.26 0.00 0.00 58.87 57.08 2ds9 n SER 676 Cb 0.25 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 2ds9 n SER 676 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2ds9 n LEU 681 N 0.05 0.66 -3.34 1.04 0.00 -1.26 -4.92 117.00 109.23 2ds9 n LEU 681 Ca -0.09 -0.66 0.02 0.00 0.00 0.00 0.00 56.01 55.29 2ds9 n LEU 681 Cb 0.65 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 44.04 2ds9 n LEU 681 CO -0.05 0.16 0.54 -1.61 0.00 0.00 0.00 177.39 176.43 2ds9 s GLU 682 N -0.25 0.32 0.06 1.96 2.02 -1.26 -5.15 118.70 116.40 2ds9 s GLU 682 Ca 0.00 0.72 0.00 0.00 0.02 0.00 0.00 54.97 55.71 2ds9 s GLU 682 Cb 0.00 0.43 0.00 0.00 0.10 0.00 0.00 34.13 34.66 2ds9 s GLU 682 CO 0.00 -0.18 0.00 0.00 0.02 0.00 0.00 175.26 175.10 2ds9 n ALA 683 N 5.16 0.43 -0.78 5.21 0.00 -1.26 -5.05 120.51 124.23 2ds9 n ALA 683 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2ds9 n ALA 683 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 2ds9 n ALA 683 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ds9 n ALA 685 N -0.13 0.33 -0.91 0.00 0.00 -1.26 -5.00 120.51 113.54 2ds9 n ALA 685 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ds9 n ALA 685 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2ds9 n ALA 685 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69