#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cx6 n ILE 308 N 0.00 -1.07 -1.51 -0.08 5.41 -1.26 -5.04 119.36 115.81 3cx6 n ILE 308 Ca 0.00 0.00 -0.38 0.00 1.00 0.00 0.00 62.75 63.37 3cx6 n ILE 308 Cb 0.00 -1.34 0.05 0.00 -0.71 0.00 0.00 39.64 37.64 3cx6 n ILE 308 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 3cx6 n ILE 309 N 0.99 2.82 -3.41 1.39 -5.35 -1.26 -5.02 119.36 109.53 3cx6 n ILE 309 Ca 0.00 -0.49 -0.29 0.00 -0.27 0.00 0.00 62.75 61.70 3cx6 n ILE 309 Cb 0.00 -0.87 -0.03 0.00 -1.74 0.00 0.00 39.64 37.00 3cx6 n ILE 309 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3cx6 s GLY 310 N -1.25 1.91 0.39 3.28 0.00 -1.26 -5.00 107.32 105.39 3cx6 s GLY 310 Ca 0.72 -0.57 0.21 0.00 0.00 0.00 0.00 44.72 45.08 3cx6 s GLY 310 CO 0.51 -0.47 1.62 -0.56 0.00 0.00 0.00 173.10 174.21 3cx6 h PRO 311 N 1.88 0.00 0.00 2.90 0.13 -2.07 -3.41 132.00 131.43 3cx6 h PRO 311 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3cx6 h PRO 311 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3cx6 h PRO 311 CO 0.67 0.22 -0.02 0.39 -0.23 0.00 0.00 178.00 179.04 3cx6 n GLU 312 N -3.20 0.01 -1.39 0.86 1.02 -1.26 -5.37 120.64 111.31 3cx6 n GLU 312 Ca 0.02 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.18 3cx6 n GLU 312 Cb 0.57 -0.15 -0.01 0.00 -0.02 0.00 0.00 31.44 31.83 3cx6 n GLU 312 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3cx6 n GLU 313 N -2.73 -2.80 -3.20 3.49 1.02 -1.26 -5.28 120.64 109.88 3cx6 n GLU 313 Ca -0.00 2.19 0.00 0.00 -0.02 0.00 0.00 57.16 59.32 3cx6 n GLU 313 Cb 0.01 -2.94 0.00 0.00 -0.02 0.00 0.00 31.44 28.49 3cx6 n GLU 313 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3cx6 n GLU 323 N -2.60 -3.06 0.00 3.49 -0.58 -1.26 -5.19 120.64 111.44 3cx6 n GLU 323 Ca -0.01 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.86 3cx6 n GLU 323 Cb 0.35 0.00 0.25 0.00 -0.57 0.00 0.00 31.44 31.47 3cx6 n GLU 323 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 3cx6 n SER 324 N 0.60 1.97 0.28 1.62 7.64 -1.26 -3.97 113.62 120.50 3cx6 n SER 324 Ca 0.00 -1.53 0.13 0.00 1.01 0.00 0.00 58.87 58.48 3cx6 n SER 324 Cb 0.00 0.13 0.83 0.00 -1.01 0.00 0.00 64.21 64.17 3cx6 n SER 324 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 3cx6 h ASP 325 N 2.84 0.00 -0.57 6.43 3.58 -2.04 -0.61 116.42 126.05 3cx6 h ASP 325 Ca 0.00 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.35 3cx6 h ASP 325 Cb 0.71 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.74 3cx6 h ASP 325 CO 0.00 0.02 -0.05 0.40 -2.88 0.00 0.00 179.24 176.73 3cx6 h ILE 326 N 0.00 1.27 -0.07 2.25 2.04 -2.01 -1.84 117.51 119.15 3cx6 h ILE 326 Ca -0.00 -1.20 -0.20 0.00 1.00 0.00 0.00 64.86 64.46 3cx6 h ILE 326 Cb 0.05 0.87 0.01 0.00 -0.74 0.00 0.00 36.82 37.01 3cx6 h ILE 326 CO 0.00 0.43 -0.72 0.40 0.00 0.00 0.00 178.15 178.26 3cx6 h ILE 327 N 0.94 1.33 0.00 -0.67 2.04 -1.42 -3.30 117.51 116.44 3cx6 h ILE 327 Ca 0.16 -2.01 -0.02 0.00 1.00 0.00 0.00 64.86 63.99 3cx6 h ILE 327 Cb 0.61 2.27 -0.00 0.00 -0.74 0.00 0.00 36.82 38.95 3cx6 h ILE 327 CO 0.04 0.61 -0.07 -0.26 0.00 0.00 0.00 178.15 178.47 3cx6 h PHE 328 N 0.25 0.00 0.00 1.37 -1.00 -1.26 -3.23 116.94 113.07 3cx6 h PHE 328 Ca -0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.71 3cx6 h PHE 328 Cb 1.38 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.94 3cx6 h PHE 328 CO 0.11 0.07 -0.73 -0.56 -1.61 0.00 0.00 178.31 175.60 3cx6 h GLN 329 N 0.00 0.00 -5.16 1.51 3.07 -1.43 -3.46 115.11 109.65 3cx6 h GLN 329 Ca -0.00 0.00 -0.67 0.00 0.09 0.00 0.00 58.65 58.07 3cx6 h GLN 329 Cb 0.68 0.00 -0.32 0.00 0.08 0.00 0.00 27.48 27.93 3cx6 h GLN 329 CO 0.01 0.00 -0.82 0.34 0.09 0.00 0.00 178.83 178.45 3cx6 s ASP 330 N -4.25 3.52 0.36 0.06 2.15 -1.22 -5.00 116.67 112.29 3cx6 s ASP 330 Ca 0.05 -0.52 0.09 0.00 0.43 0.00 0.00 52.55 52.60 3cx6 s ASP 330 Cb 0.13 -1.54 0.67 0.00 -0.30 0.00 0.00 42.92 41.88 3cx6 s ASP 330 CO 0.74 0.06 1.84 0.25 -0.17 0.00 0.00 175.17 177.89 3cx6 h LEU 331 N 7.47 0.22 -0.60 -1.34 5.85 -1.88 -1.78 115.31 123.25 3cx6 h LEU 331 Ca -0.35 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.15 3cx6 h LEU 331 Cb 1.18 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 3cx6 h LEU 331 CO 0.58 0.47 -0.59 -0.08 -0.34 0.00 0.00 178.44 178.47 3cx6 h GLU 332 N 0.21 0.36 0.00 1.25 4.81 -1.95 -1.73 114.58 117.52 3cx6 h GLU 332 Ca 0.04 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 3cx6 h GLU 332 Cb 0.53 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.94 3cx6 h GLU 332 CO 0.04 0.85 -0.56 0.36 -0.73 0.00 0.00 179.01 178.96 3cx6 n LYS 333 N -3.90 0.19 0.05 1.92 2.85 -1.17 -3.40 118.16 114.69 3cx6 n LYS 333 Ca -0.03 0.06 -0.07 0.00 -1.05 0.00 0.00 58.31 57.22 3cx6 n LYS 333 Cb 0.62 -1.62 -0.12 0.00 -0.65 0.00 0.00 35.03 33.26 3cx6 n LYS 333 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 3cx6 h LEU 334 N 0.00 0.00 -0.77 -5.58 5.85 -1.19 -3.12 115.31 110.50 3cx6 h LEU 334 Ca 0.00 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.59 3cx6 h LEU 334 Cb 0.66 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 3cx6 h LEU 334 CO 0.00 0.98 -0.55 0.11 -0.34 0.00 0.00 178.44 178.64 3cx6 h LYS 335 N 0.00 0.19 0.00 1.25 1.57 -1.35 -2.93 116.57 115.30 3cx6 h LYS 335 Ca -0.06 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3cx6 h LYS 335 Cb 1.80 0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.12 3cx6 h LYS 335 CO 0.12 0.69 -0.10 -1.13 -0.57 0.00 0.00 179.45 178.46 3cx6 n SER 336 N -3.91 0.32 -3.93 0.86 3.41 -1.22 -4.29 113.62 104.86 3cx6 n SER 336 Ca -0.02 0.41 -0.33 0.00 -0.26 0.00 0.00 58.87 58.68 3cx6 n SER 336 Cb 0.57 -0.46 -0.08 0.00 -0.26 0.00 0.00 64.21 63.99 3cx6 n SER 336 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3cx6 n HIS 337 N -1.75 3.72 -0.38 7.33 8.25 -1.11 -4.95 115.22 126.34 3cx6 n HIS 337 Ca 0.06 -4.09 0.29 0.00 -0.26 0.00 0.00 57.72 53.73 3cx6 n HIS 337 Cb 0.37 -0.90 0.57 0.00 1.12 0.00 0.00 29.99 31.15 3cx6 n HIS 337 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3cx6 h PRO 338 N 5.46 0.23 -0.50 -0.41 0.13 -1.75 0.15 132.00 135.31 3cx6 h PRO 338 Ca 0.17 -0.01 -0.08 0.00 -0.87 0.00 0.00 66.00 65.21 3cx6 h PRO 338 Cb 0.75 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.81 3cx6 h PRO 338 CO 0.85 0.15 0.02 0.00 -0.23 0.00 0.00 178.00 178.79 3cx6 h ALA 339 N 1.66 0.67 -0.25 -0.56 0.00 -1.91 -0.59 119.26 118.28 3cx6 h ALA 339 Ca 0.72 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 55.19 3cx6 h ALA 339 Cb 2.03 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.63 3cx6 h ALA 339 CO -0.41 0.46 -0.52 1.88 0.00 0.00 0.00 179.25 180.67 3cx6 h TYR 340 N 0.73 0.87 -0.15 0.00 0.05 -1.10 -3.04 116.97 114.34 3cx6 h TYR 340 Ca 0.14 -0.30 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 3cx6 h TYR 340 Cb 0.49 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 3cx6 h TYR 340 CO 0.04 1.07 0.07 1.25 -1.05 0.00 0.00 178.16 179.53 3cx6 h LEU 341 N 0.54 0.19 -1.22 3.88 5.85 -0.92 -2.07 115.31 121.57 3cx6 h LEU 341 Ca 0.02 -0.13 0.13 0.00 0.84 0.00 0.00 57.88 58.74 3cx6 h LEU 341 Cb 1.08 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.99 3cx6 h LEU 341 CO 0.11 0.26 0.58 0.58 -0.34 0.00 0.00 178.44 179.63 3cx6 h VAL 342 N 0.11 0.88 -0.49 1.05 2.07 -1.11 0.39 116.25 119.15 3cx6 h VAL 342 Ca 0.05 -0.27 -0.08 0.00 0.82 0.00 0.00 66.70 67.22 3cx6 h VAL 342 Cb 0.13 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 3cx6 h VAL 342 CO -0.01 0.14 0.00 0.58 0.02 0.00 0.00 177.57 178.31 3cx6 h VAL 343 N 0.79 1.26 -0.39 2.57 2.07 -1.36 -1.62 116.25 119.57 3cx6 h VAL 343 Ca 0.45 -1.06 -0.10 0.00 0.82 0.00 0.00 66.70 66.80 3cx6 h VAL 343 Cb 0.59 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 3cx6 h VAL 343 CO -0.21 0.37 -0.18 0.15 0.02 0.00 0.00 177.57 177.72 3cx6 h PHE 344 N 0.72 0.83 0.00 1.57 3.57 -0.28 -2.24 116.94 121.10 3cx6 h PHE 344 Ca 0.14 -0.17 -0.06 0.00 3.53 0.00 0.00 57.97 61.41 3cx6 h PHE 344 Cb 0.51 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 3cx6 h PHE 344 CO 0.04 0.87 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.63 3cx6 h LEU 345 N 0.66 0.00 -0.03 0.59 3.38 -0.08 -0.92 115.31 118.91 3cx6 h LEU 345 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3cx6 h LEU 345 Cb 0.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 3cx6 h LEU 345 CO 0.05 0.28 -0.00 -0.09 0.09 0.00 0.00 178.44 178.77 3cx6 h ARG 346 N 0.00 0.05 -0.26 1.13 2.43 -0.79 0.24 114.38 117.17 3cx6 h ARG 346 Ca -0.00 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 3cx6 h ARG 346 Cb 0.51 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 3cx6 h ARG 346 CO 0.04 0.36 0.10 -0.92 -1.51 0.00 0.00 179.97 178.04 3cx6 h TYR 347 N -0.27 0.19 0.28 2.20 3.20 -0.94 -1.94 116.97 119.69 3cx6 h TYR 347 Ca 0.01 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 3cx6 h TYR 347 Cb 0.34 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 3cx6 h TYR 347 CO 0.04 0.09 -0.24 0.82 -1.64 0.00 0.00 178.16 177.23 3cx6 h ILE 348 N 0.23 0.49 0.00 1.81 1.08 -1.09 0.55 117.51 120.58 3cx6 h ILE 348 Ca 0.11 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.58 3cx6 h ILE 348 Cb 0.07 0.49 -0.00 0.00 -3.07 0.00 0.00 36.82 34.31 3cx6 h ILE 348 CO -0.10 0.00 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.27 3cx6 h LEU 349 N -0.54 0.00 0.00 1.44 4.07 -0.82 0.66 115.31 120.12 3cx6 h LEU 349 Ca -0.01 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 57.63 3cx6 h LEU 349 Cb 0.48 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.17 3cx6 h LEU 349 CO -0.03 0.01 -1.79 -1.20 -1.08 0.00 0.00 178.44 174.36 3cx6 n SER 350 N -3.31 1.90 -0.52 -0.43 7.64 -0.74 -4.70 113.62 113.47 3cx6 n SER 350 Ca -0.03 0.39 0.12 0.00 1.01 0.00 0.00 58.87 60.36 3cx6 n SER 350 Cb 0.11 -0.89 0.09 0.00 -1.01 0.00 0.00 64.21 62.51 3cx6 n SER 350 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3cx6 n GLN 351 N -4.36 1.32 -0.73 1.43 1.13 0.19 -5.06 117.38 111.30 3cx6 n GLN 351 Ca -0.40 -1.05 0.00 0.00 -1.94 0.00 0.00 57.00 53.61 3cx6 n GLN 351 Cb 0.75 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.62 3cx6 n GLN 351 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3cx6 n ALA 352 N 0.07 0.00 -2.61 -1.58 0.00 0.22 -5.00 120.51 111.60 3cx6 n ALA 352 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.12 3cx6 n ALA 352 Cb 0.46 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.88 3cx6 n ALA 352 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3cx6 s ASP 353 N 0.21 6.73 0.40 0.00 2.15 -1.26 -4.63 116.67 120.26 3cx6 s ASP 353 Ca 0.00 0.70 0.21 0.00 0.43 0.00 0.00 52.55 53.88 3cx6 s ASP 353 Cb 0.00 -2.47 0.74 0.00 -0.30 0.00 0.00 42.92 40.89 3cx6 s ASP 353 CO 0.00 -0.83 1.75 -0.65 -0.17 0.00 0.00 175.17 175.28 3cx6 h PRO 354 N 8.34 0.00 0.00 4.34 0.11 -1.95 -3.39 132.00 139.45 3cx6 h PRO 354 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3cx6 h PRO 354 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3cx6 h PRO 354 CO 0.98 0.32 0.00 0.41 -0.21 0.00 0.00 178.00 179.50 3cx6 n GLY 355 N 0.25 -3.06 0.16 -0.55 0.00 -1.26 -1.68 105.19 99.05 3cx6 n GLY 355 Ca 0.00 0.60 -0.04 0.00 0.00 0.00 0.00 46.02 46.58 3cx6 n GLY 355 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3cx6 h PRO 356 N 0.00 -0.01 -0.36 1.61 0.11 -1.87 0.15 132.00 131.63 3cx6 h PRO 356 Ca 0.00 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.17 3cx6 h PRO 356 Cb 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.06 3cx6 h PRO 356 CO 0.00 -0.01 0.05 1.25 -0.21 0.00 0.00 178.00 179.09 3cx6 h LEU 357 N -0.01 -0.03 -1.18 2.35 5.85 -1.83 0.10 115.31 120.57 3cx6 h LEU 357 Ca 0.06 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3cx6 h LEU 357 Cb 0.16 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 3cx6 h LEU 357 CO -0.36 0.02 0.30 -0.07 -0.34 0.00 0.00 178.44 178.00 3cx6 h LEU 358 N 0.17 0.79 -0.61 2.25 3.38 -0.86 -0.53 115.31 119.90 3cx6 h LEU 358 Ca 0.17 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 3cx6 h LEU 358 Cb 0.21 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3cx6 h LEU 358 CO -0.24 0.67 -0.37 0.15 0.09 0.00 0.00 178.44 178.74 3cx6 h PHE 359 N 0.88 0.82 -0.28 1.13 3.57 -0.06 -2.51 116.94 120.49 3cx6 h PHE 359 Ca 0.22 -0.23 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 3cx6 h PHE 359 Cb 0.08 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 3cx6 h PHE 359 CO 0.01 0.96 0.10 -0.92 -2.23 0.00 0.00 178.31 176.23 3cx6 h TYR 360 N 0.58 0.44 -0.08 0.41 3.20 0.12 -2.04 116.97 119.59 3cx6 h TYR 360 Ca 0.06 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 3cx6 h TYR 360 Cb 0.89 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 39.03 3cx6 h TYR 360 CO 0.04 0.45 0.03 -0.07 -1.64 0.00 0.00 178.16 176.98 3cx6 h LEU 361 N 0.30 0.12 -0.53 2.82 3.38 -1.06 -1.04 115.31 119.28 3cx6 h LEU 361 Ca 0.09 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.90 3cx6 h LEU 361 Cb 0.21 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3cx6 h LEU 361 CO -0.01 0.27 0.33 0.00 0.09 0.00 0.00 178.44 179.12 3cx6 h SER 363 N 0.66 0.00 0.45 0.00 0.02 -1.22 -0.82 113.55 112.64 3cx6 h SER 363 Ca 0.21 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.87 3cx6 h SER 363 Cb -0.01 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.55 3cx6 h SER 363 CO -0.08 0.00 -1.27 -0.08 -1.14 0.00 0.00 176.83 174.26 3cx6 h GLU 364 N 0.00 0.40 -0.30 3.45 4.57 0.56 -2.28 114.58 120.98 3cx6 h GLU 364 Ca 0.00 -0.62 -0.08 0.00 -1.18 0.00 0.00 59.36 57.48 3cx6 h GLU 364 Cb 0.15 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.95 3cx6 h GLU 364 CO 0.00 1.28 -0.16 0.28 -1.18 0.00 0.00 179.01 179.23 3cx6 h VAL 365 N 0.14 1.24 0.25 0.32 2.07 -0.25 -2.59 116.25 117.43 3cx6 h VAL 365 Ca -0.16 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 3cx6 h VAL 365 Cb 1.97 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 3cx6 h VAL 365 CO 0.22 0.36 -0.12 0.22 0.02 0.00 0.00 177.57 178.27 3cx6 h TYR 366 N 0.47 -0.31 -0.47 1.57 3.20 -1.27 0.17 116.97 120.33 3cx6 h TYR 366 Ca 0.08 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.08 3cx6 h TYR 366 Cb 0.55 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 3cx6 h TYR 366 CO 0.02 0.01 0.52 1.96 -1.64 0.00 0.00 178.16 179.03 3cx6 h GLN 367 N -0.66 0.00 0.00 1.82 1.08 -1.24 0.10 115.11 116.21 3cx6 h GLN 367 Ca -0.03 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3cx6 h GLN 367 Cb 0.47 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 3cx6 h GLN 367 CO 0.06 0.00 -0.93 1.04 -0.95 0.00 0.00 178.83 178.05 3cx6 n GLN 368 N -3.67 1.55 -2.88 1.46 6.02 -0.99 -4.96 117.38 113.91 3cx6 n GLN 368 Ca 0.09 -0.03 -0.40 0.00 -0.01 0.00 0.00 57.00 56.65 3cx6 n GLN 368 Cb 0.71 -1.27 -0.05 0.00 1.02 0.00 0.00 30.24 30.64 3cx6 n GLN 368 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3cx6 s THR 369 N -2.61 4.54 0.19 5.09 2.01 0.59 -5.00 115.64 120.46 3cx6 s THR 369 Ca 0.04 1.82 -0.32 0.00 0.31 0.00 0.00 61.69 63.54 3cx6 s THR 369 Cb 0.12 -4.20 -0.11 0.00 0.01 0.00 0.00 72.50 68.31 3cx6 s THR 369 CO 0.65 0.39 1.67 0.21 -0.69 0.00 0.00 174.62 176.85 3cx6 s ASN 370 N -0.31 6.45 -0.02 3.53 3.84 -1.26 -4.90 114.94 122.28 3cx6 s ASN 370 Ca 0.41 2.78 -0.33 0.00 0.21 0.00 0.00 52.86 55.93 3cx6 s ASN 370 Cb -0.22 -2.60 -0.11 0.00 -0.55 0.00 0.00 41.25 37.77 3cx6 s ASN 370 CO 0.26 -0.92 1.87 -2.65 -2.79 0.00 0.00 177.10 172.87 3cx6 n PRO 371 N 3.96 2.39 0.00 0.43 -0.02 -1.26 -3.99 135.00 136.51 3cx6 n PRO 371 Ca 0.15 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 3cx6 n PRO 371 Cb 0.36 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 3cx6 n PRO 371 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 3cx6 n LYS 372 N 6.46 0.00 0.00 -0.52 2.85 -1.26 -5.05 118.16 120.64 3cx6 n LYS 372 Ca 0.21 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 3cx6 n LYS 372 Cb 0.33 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.71 3cx6 n LYS 372 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3cx6 n SER 374 N 0.00 0.00 0.04 -5.58 2.88 -1.26 -4.84 113.62 104.86 3cx6 n SER 374 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3cx6 n SER 374 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 3cx6 n SER 374 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3cx6 h ARG 375 N 0.00 -0.31 -0.46 -1.46 2.47 -1.97 -2.59 114.38 110.07 3cx6 h ARG 375 Ca 0.00 0.02 0.09 0.00 -1.26 0.00 0.00 59.98 58.83 3cx6 h ARG 375 Cb 0.00 0.07 -0.09 0.00 -1.65 0.00 0.00 29.97 28.30 3cx6 h ARG 375 CO 0.00 -0.20 -0.15 0.66 0.56 0.00 0.00 179.97 180.84 3cx6 h SER 376 N -0.32 -0.53 0.47 7.04 4.64 -2.00 -1.05 113.55 121.80 3cx6 h SER 376 Ca 0.07 0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 61.53 3cx6 h SER 376 Cb 0.42 0.32 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 3cx6 h SER 376 CO -0.23 -0.18 -0.45 0.25 -0.87 0.00 0.00 176.83 175.35 3cx6 h LEU 377 N -0.04 -1.21 -1.03 5.97 5.85 -1.94 -1.40 115.31 121.50 3cx6 h LEU 377 Ca 0.22 0.09 0.32 0.00 0.84 0.00 0.00 57.88 59.36 3cx6 h LEU 377 Cb 0.38 0.40 -0.14 0.00 0.37 0.00 0.00 40.66 41.66 3cx6 h LEU 377 CO -0.50 -0.60 0.59 1.23 -0.34 0.00 0.00 178.44 178.83 3cx6 h GLY 378 N -0.90 2.00 0.91 3.75 0.00 -1.08 0.26 103.07 108.00 3cx6 h GLY 378 Ca -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 3cx6 h GLY 378 CO -0.04 -0.46 0.10 0.50 0.00 0.00 0.00 176.54 176.64 3cx6 h LYS 379 N 0.33 0.40 -0.25 4.80 1.79 -0.39 -2.27 116.57 120.98 3cx6 h LYS 379 Ca 0.73 -0.07 -0.09 0.00 -2.18 0.00 0.00 60.65 59.04 3cx6 h LYS 379 Cb 1.68 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 32.26 3cx6 h LYS 379 CO -0.58 0.43 -0.22 -0.44 -1.08 0.00 0.00 179.45 177.56 3cx6 h ASP 380 N 0.28 0.46 -0.83 0.86 3.32 0.46 -2.74 116.42 118.21 3cx6 h ASP 380 Ca 0.09 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 3cx6 h ASP 380 Cb 0.18 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 3cx6 h ASP 380 CO -0.01 0.68 0.45 0.40 -1.72 0.00 0.00 179.24 179.04 3cx6 h ILE 381 N 0.42 1.25 -0.20 0.35 2.04 -0.79 -0.90 117.51 119.68 3cx6 h ILE 381 Ca 0.07 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 3cx6 h ILE 381 Cb 0.61 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3cx6 h ILE 381 CO 0.04 0.28 0.11 -0.25 0.00 0.00 0.00 178.15 178.33 3cx6 h TRP 382 N 1.17 0.27 0.00 1.37 2.91 -1.12 -1.11 115.95 119.44 3cx6 h TRP 382 Ca 0.29 -0.01 -0.11 0.00 1.13 0.00 0.00 58.89 60.20 3cx6 h TRP 382 Cb 0.05 -0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 28.60 3cx6 h TRP 382 CO 0.01 0.25 -0.50 -0.91 -1.03 0.00 0.00 178.44 176.26 3cx6 h ASN 383 N 0.21 0.00 0.54 2.65 4.21 -1.33 0.12 115.58 121.98 3cx6 h ASN 383 Ca 0.07 0.00 -0.29 0.00 1.21 0.00 0.00 56.30 57.29 3cx6 h ASN 383 Cb 0.07 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.24 3cx6 h ASN 383 CO -0.01 0.50 -1.56 0.40 -1.29 0.00 0.00 177.43 175.47 3cx6 h ILE 384 N 0.00 1.06 0.00 2.81 2.04 -1.08 -3.39 117.51 118.95 3cx6 h ILE 384 Ca -0.01 -2.82 -0.02 0.00 1.00 0.00 0.00 64.86 63.01 3cx6 h ILE 384 Cb 1.01 2.59 -0.00 0.00 -0.74 0.00 0.00 36.82 39.67 3cx6 h ILE 384 CO 0.07 0.70 -1.08 0.49 0.00 0.00 0.00 178.15 178.33 3cx6 n PHE 385 N -3.25 0.00 -0.03 1.37 3.01 -0.43 -2.12 117.46 116.01 3cx6 n PHE 385 Ca -0.15 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.15 3cx6 n PHE 385 Cb 1.03 -0.05 -0.14 0.00 -0.01 0.00 0.00 39.48 40.31 3cx6 n PHE 385 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 3cx6 n LEU 386 N -2.66 1.85 -4.75 4.37 4.77 -0.88 -0.63 117.00 119.07 3cx6 n LEU 386 Ca -0.02 0.20 -0.30 0.00 -0.03 0.00 0.00 56.01 55.85 3cx6 n LEU 386 Cb 0.52 -0.51 0.11 0.00 -2.33 0.00 0.00 43.42 41.21 3cx6 n LEU 386 CO 0.01 0.68 0.69 -1.83 -1.33 0.00 0.00 177.39 175.61 3cx6 s GLU 387 N -2.56 1.88 0.00 3.23 4.04 0.36 -4.92 118.70 120.73 3cx6 s GLU 387 Ca -0.17 1.01 0.00 0.00 0.04 0.00 0.00 54.97 55.84 3cx6 s GLU 387 Cb 0.07 -1.87 0.00 0.00 0.02 0.00 0.00 34.13 32.36 3cx6 s GLU 387 CO 0.77 -1.86 0.11 1.63 -1.84 0.00 0.00 175.26 174.07 3cx6 n LYS 388 N -3.65 0.00 -1.58 -4.83 4.76 -1.26 -1.96 118.16 109.64 3cx6 n LYS 388 Ca 0.08 0.11 -0.30 0.00 -2.87 0.00 0.00 58.31 55.34 3cx6 n LYS 388 Cb 0.54 -0.28 -0.04 0.00 -1.84 0.00 0.00 35.03 33.42 3cx6 n LYS 388 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3cx6 n ASN 389 N -0.45 6.70 -4.75 4.39 3.02 -1.26 -4.98 115.26 117.92 3cx6 n ASN 389 Ca 0.00 -3.33 -0.41 0.00 -0.03 0.00 0.00 54.58 50.81 3cx6 n ASN 389 Cb 0.00 -1.20 -0.03 0.00 -0.61 0.00 0.00 39.78 37.93 3cx6 n ASN 389 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cx6 s ALA 390 N -2.17 3.46 0.19 5.41 0.00 -0.83 -4.94 121.76 122.89 3cx6 s ALA 390 Ca 0.58 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 53.45 3cx6 s ALA 390 Cb 0.39 -3.42 0.18 0.00 0.00 0.00 0.00 23.12 20.27 3cx6 s ALA 390 CO -0.26 -0.41 1.78 -1.00 0.00 0.00 0.00 175.76 175.87 3cx6 h PRO 391 N 4.66 0.51 -0.90 0.00 0.13 -1.75 -2.55 132.00 132.10 3cx6 h PRO 391 Ca -0.46 -0.03 -0.58 0.00 -0.87 0.00 0.00 66.00 64.06 3cx6 h PRO 391 Cb 1.22 -0.11 -0.40 0.00 0.13 0.00 0.00 31.00 31.83 3cx6 h PRO 391 CO 0.72 0.34 -0.47 1.28 -0.23 0.00 0.00 178.00 179.64 3cx6 n LEU 392 N -4.88 5.46 -4.60 1.56 4.77 -0.90 -4.97 117.00 113.44 3cx6 n LEU 392 Ca 0.06 -4.72 -0.48 0.00 -0.03 0.00 0.00 56.01 50.84 3cx6 n LEU 392 Cb 0.16 -0.48 -0.04 0.00 -2.33 0.00 0.00 43.42 40.73 3cx6 n LEU 392 CO 0.28 2.00 0.81 -1.14 -1.33 0.00 0.00 177.39 178.01 3cx6 n ARG 393 N -0.72 1.36 -4.17 3.23 0.63 -0.96 -4.52 116.66 111.51 3cx6 n ARG 393 Ca 0.47 0.48 -0.28 0.00 -0.92 0.00 0.00 57.85 57.61 3cx6 n ARG 393 Cb 0.87 -2.03 -0.08 0.00 0.45 0.00 0.00 32.46 31.67 3cx6 n ARG 393 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3cx6 s VAL 394 N -0.07 3.89 -0.31 5.15 0.11 0.20 -4.92 120.40 124.45 3cx6 s VAL 394 Ca 0.73 -1.25 -0.12 0.00 -2.93 0.00 0.00 61.98 58.42 3cx6 s VAL 394 Cb -0.82 -2.93 -0.03 0.00 -1.53 0.00 0.00 36.38 31.08 3cx6 s VAL 394 CO 0.51 -0.04 0.21 -0.54 -3.33 0.00 0.00 175.10 171.91 3cx6 s LYS 395 N -2.76 3.64 0.20 1.54 1.02 -1.26 -4.80 119.74 117.32 3cx6 s LYS 395 Ca 0.27 -0.54 0.03 0.00 0.02 0.00 0.00 55.97 55.76 3cx6 s LYS 395 Cb -0.10 -3.71 -0.05 0.00 -0.52 0.00 0.00 37.83 33.45 3cx6 s LYS 395 CO 0.19 -0.34 -0.02 0.96 -0.92 0.00 0.00 175.35 175.22 3cx6 s ILE 396 N 1.72 0.98 0.13 2.17 -4.36 -1.26 -4.80 121.20 115.78 3cx6 s ILE 396 Ca 0.06 -2.03 -0.34 0.00 -0.26 0.00 0.00 60.65 58.08 3cx6 s ILE 396 Cb -0.17 -2.22 -0.14 0.00 1.25 0.00 0.00 42.46 41.18 3cx6 s ILE 396 CO 0.10 -0.42 1.58 -2.65 0.24 0.00 0.00 174.94 173.78 3cx6 n PRO 397 N -0.34 2.05 -0.35 0.37 -0.02 -1.26 -4.85 135.00 130.60 3cx6 n PRO 397 Ca -0.06 0.74 0.15 0.00 -2.02 0.00 0.00 63.50 62.31 3cx6 n PRO 397 Cb 0.63 -2.50 0.35 0.00 -0.02 0.00 0.00 33.50 31.96 3cx6 n PRO 397 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3cx6 h GLU 398 N 6.02 0.65 -0.10 -0.52 5.08 -1.99 -1.39 114.58 122.33 3cx6 h GLU 398 Ca -0.45 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 57.90 3cx6 h GLU 398 Cb 1.26 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.32 3cx6 h GLU 398 CO 0.88 0.43 -0.14 1.98 -1.00 0.00 0.00 179.01 181.17 3cx6 h MET 399 N 0.67 -0.17 -0.13 2.33 4.05 -2.00 -0.76 114.93 118.92 3cx6 h MET 399 Ca 0.60 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 60.03 3cx6 h MET 399 Cb 1.04 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.87 3cx6 h MET 399 CO -0.43 -0.11 0.06 1.25 0.23 0.00 0.00 176.91 177.91 3cx6 h LEU 400 N -0.18 0.16 -0.09 3.39 5.85 -1.63 -1.59 115.31 121.22 3cx6 h LEU 400 Ca 0.08 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 3cx6 h LEU 400 Cb 0.29 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 3cx6 h LEU 400 CO -0.21 0.15 -0.13 -0.61 -0.34 0.00 0.00 178.44 177.29 3cx6 h GLN 401 N 0.18 0.24 -0.67 1.25 4.15 -0.78 -1.76 115.11 117.73 3cx6 h GLN 401 Ca 0.05 -0.15 0.04 0.00 0.77 0.00 0.00 58.65 59.36 3cx6 h GLN 401 Cb 0.04 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.69 3cx6 h GLN 401 CO -0.01 0.72 0.40 0.00 -1.93 0.00 0.00 178.83 178.01 3cx6 h ALA 402 N 0.52 0.89 -0.37 3.38 0.00 -0.77 -0.71 119.26 122.20 3cx6 h ALA 402 Ca 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3cx6 h ALA 402 Cb 0.69 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3cx6 h ALA 402 CO 0.03 0.14 0.04 1.49 0.00 0.00 0.00 179.25 180.95 3cx6 h GLU 403 N 0.77 0.63 -0.30 0.00 4.81 -1.31 -1.65 114.58 117.54 3cx6 h GLU 403 Ca 0.28 -0.18 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 3cx6 h GLU 403 Cb 0.08 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3cx6 h GLU 403 CO -0.13 0.71 0.17 0.82 -0.73 0.00 0.00 179.01 179.85 3cx6 h ILE 404 N 0.47 1.03 -0.85 2.32 2.04 -0.95 -2.23 117.51 119.35 3cx6 h ILE 404 Ca 0.11 -0.12 0.07 0.00 1.00 0.00 0.00 64.86 65.92 3cx6 h ILE 404 Cb 0.40 0.65 -0.06 0.00 -0.74 0.00 0.00 36.82 37.07 3cx6 h ILE 404 CO 0.01 0.07 0.55 -0.78 0.00 0.00 0.00 178.15 178.00 3cx6 h ASP 405 N 0.36 0.82 0.62 1.72 3.58 -1.00 -2.60 116.42 119.92 3cx6 h ASP 405 Ca 0.12 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.54 3cx6 h ASP 405 Cb -0.00 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 40.89 3cx6 h ASP 405 CO -0.05 0.52 -0.30 0.25 -2.88 0.00 0.00 179.24 176.77 3cx6 h LEU 406 N 0.92 -0.71 -5.27 2.28 5.85 -0.71 -2.72 115.31 114.97 3cx6 h LEU 406 Ca 0.37 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 59.01 3cx6 h LEU 406 Cb 0.26 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 3cx6 h LEU 406 CO -0.14 -0.50 0.99 0.54 -0.34 0.00 0.00 178.44 178.99 3cx6 n ARG 407 N -5.45 0.67 0.00 1.25 5.12 -0.98 -0.14 116.66 117.13 3cx6 n ARG 407 Ca -0.13 -0.57 0.00 0.00 -1.93 0.00 0.00 57.85 55.22 3cx6 n ARG 407 Cb 0.34 -1.90 0.00 0.00 -1.16 0.00 0.00 32.46 29.74 3cx6 n ARG 407 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3cx6 n ARG 409 N 3.78 0.00 -0.09 5.56 1.74 -1.03 -2.12 116.66 124.50 3cx6 n ARG 409 Ca 0.14 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.26 3cx6 n ARG 409 Cb 0.13 0.00 0.13 0.00 -1.02 0.00 0.00 32.46 31.70 3cx6 n ARG 409 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3cx6 n ASN 410 N 0.00 1.05 -4.16 0.55 5.03 0.80 -4.89 115.26 113.63 3cx6 n ASN 410 Ca 0.00 -1.95 -0.33 0.00 0.87 0.00 0.00 54.58 53.17 3cx6 n ASN 410 Cb 0.00 -0.12 -0.04 0.00 -1.02 0.00 0.00 39.78 38.60 3cx6 n ASN 410 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 3cx6 n ASN 411 N 0.05 -1.83 -3.55 6.41 4.05 -0.90 -4.96 115.26 114.53 3cx6 n ASN 411 Ca 0.08 -1.05 -0.11 0.00 0.45 0.00 0.00 54.58 53.95 3cx6 n ASN 411 Cb 0.17 -2.67 0.03 0.00 1.23 0.00 0.00 39.78 38.54 3cx6 n ASN 411 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 3cx6 n GLU 412 N -4.40 0.85 -2.45 1.20 1.02 -1.17 -5.06 120.64 110.63 3cx6 n GLU 412 Ca -0.09 -1.70 -0.43 0.00 -0.02 0.00 0.00 57.16 54.93 3cx6 n GLU 412 Cb 0.57 -0.06 -0.02 0.00 -0.02 0.00 0.00 31.44 31.91 3cx6 n GLU 412 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3cx6 s ASP 413 N -2.87 6.77 -0.01 1.62 2.15 -1.26 -4.90 116.67 118.16 3cx6 s ASP 413 Ca 0.29 1.28 0.22 0.00 0.43 0.00 0.00 52.55 54.77 3cx6 s ASP 413 Cb -0.02 -2.54 -0.29 0.00 -0.30 0.00 0.00 42.92 39.76 3cx6 s ASP 413 CO 0.18 -0.99 0.59 -0.81 -0.17 0.00 0.00 175.17 173.98 3cx6 n PRO 414 N 7.10 0.53 -0.27 4.34 -0.04 -1.26 -4.61 135.00 140.79 3cx6 n PRO 414 Ca 0.14 -0.15 0.21 0.00 -0.04 0.00 0.00 63.50 63.67 3cx6 n PRO 414 Cb 0.46 -1.53 0.40 0.00 -0.04 0.00 0.00 33.50 32.79 3cx6 n PRO 414 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3cx6 n ARG 415 N -2.14 -0.05 -0.12 0.54 1.74 -1.26 -0.50 116.66 114.86 3cx6 n ARG 415 Ca -0.02 1.16 -0.09 0.00 -0.77 0.00 0.00 57.85 58.13 3cx6 n ARG 415 Cb 0.52 -1.99 -0.01 0.00 -1.02 0.00 0.00 32.46 29.97 3cx6 n ARG 415 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 3cx6 h ASN 416 N 0.00 0.49 1.29 0.55 -0.00 -2.00 -1.79 115.58 114.11 3cx6 h ASN 416 Ca 0.62 -0.11 0.00 0.00 -0.00 0.00 0.00 56.30 56.81 3cx6 h ASN 416 Cb 1.54 -0.12 0.00 0.00 -0.00 0.00 0.00 38.32 39.74 3cx6 h ASN 416 CO -0.67 0.46 -0.65 -0.37 -0.00 0.00 0.00 177.43 176.20 3cx6 h VAL 417 N 0.48 0.00 0.00 2.57 -1.51 -1.12 -3.22 116.25 113.45 3cx6 h VAL 417 Ca 0.13 -0.94 -0.11 0.00 -1.23 0.00 0.00 66.70 64.55 3cx6 h VAL 417 Cb 0.09 1.60 -0.02 0.00 -2.13 0.00 0.00 31.29 30.84 3cx6 h VAL 417 CO -0.02 0.00 -0.53 0.25 -1.23 0.00 0.00 177.57 176.04 3cx6 h LEU 418 N 0.00 0.00 -0.65 4.19 7.12 -0.88 -2.76 115.31 122.34 3cx6 h LEU 418 Ca 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 57.88 57.91 3cx6 h LEU 418 Cb 0.97 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.09 3cx6 h LEU 418 CO 0.00 0.53 -0.46 0.00 -0.13 0.00 0.00 178.44 178.38 3cx6 h GLU 420 N 0.00 0.27 -0.69 0.00 5.08 -1.58 -2.30 114.58 115.36 3cx6 h GLU 420 Ca -0.00 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 57.98 3cx6 h GLU 420 Cb 1.08 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 3cx6 h GLU 420 CO 0.06 1.04 0.19 0.00 -1.00 0.00 0.00 179.01 179.29 3cx6 h ALA 421 N 0.85 0.90 -0.61 3.43 0.00 -1.20 -0.78 119.26 121.85 3cx6 h ALA 421 Ca -0.07 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 3cx6 h ALA 421 Cb 1.59 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 3cx6 h ALA 421 CO 0.15 0.61 0.21 1.96 0.00 0.00 0.00 179.25 182.18 3cx6 h GLN 422 N 1.02 0.92 -0.02 0.00 4.20 -1.24 -2.45 115.11 117.54 3cx6 h GLN 422 Ca 0.22 -0.17 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 3cx6 h GLN 422 Cb 0.34 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 3cx6 h GLN 422 CO -0.00 0.78 -0.72 0.93 -0.67 0.00 0.00 178.83 179.15 3cx6 h GLU 423 N 0.89 0.11 -0.22 1.46 5.08 -0.97 -2.78 114.58 118.15 3cx6 h GLU 423 Ca 0.20 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 3cx6 h GLU 423 Cb 0.23 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3cx6 h GLU 423 CO -0.01 0.78 -0.15 0.00 -1.00 0.00 0.00 179.01 178.63 3cx6 h ALA 424 N 1.19 1.34 0.00 3.43 0.00 -0.70 -2.38 119.26 122.14 3cx6 h ALA 424 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3cx6 h ALA 424 Cb 1.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3cx6 h ALA 424 CO 0.10 0.45 -0.40 1.55 0.00 0.00 0.00 179.25 180.95 3cx6 n VAL 425 N -4.22 0.06 -0.25 0.00 3.14 -1.02 -4.11 118.33 111.94 3cx6 n VAL 425 Ca -0.00 -0.05 -0.05 0.00 -2.96 0.00 0.00 64.34 61.29 3cx6 n VAL 425 Cb 0.31 0.01 0.06 0.00 -1.06 0.00 0.00 33.84 33.17 3cx6 n VAL 425 CO 0.00 0.00 0.00 -0.03 -6.46 0.00 0.00 176.83 170.34 3cx6 h MET 426 N 0.00 0.89 -0.98 1.45 -1.53 -1.13 -2.21 114.93 111.41 3cx6 h MET 426 Ca 0.00 -0.05 0.11 0.00 -3.44 0.00 0.00 59.70 56.32 3cx6 h MET 426 Cb 0.54 -0.20 -0.08 0.00 -0.55 0.00 0.00 31.60 31.31 3cx6 h MET 426 CO 0.00 0.59 0.61 -0.07 0.14 0.00 0.00 176.91 178.18 3cx6 h LEU 427 N 0.92 0.90 -0.40 3.39 -0.00 -1.71 0.15 115.31 118.55 3cx6 h LEU 427 Ca 0.26 0.05 -0.10 0.00 -0.00 0.00 0.00 57.88 58.09 3cx6 h LEU 427 Cb -0.08 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 40.44 3cx6 h LEU 427 CO -0.07 0.48 -0.13 -0.08 -0.00 0.00 0.00 178.44 178.64 3cx6 h GLU 428 N 0.97 0.81 -0.21 1.13 4.81 -1.72 -1.70 114.58 118.67 3cx6 h GLU 428 Ca 0.48 -0.33 -0.04 0.00 -0.13 0.00 0.00 59.36 59.34 3cx6 h GLU 428 Cb 0.46 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 3cx6 h GLU 428 CO -0.26 0.95 -0.06 0.82 -0.73 0.00 0.00 179.01 179.72 3cx6 h ILE 429 N 0.62 1.17 0.09 2.32 2.04 -0.63 -2.22 117.51 120.90 3cx6 h ILE 429 Ca 0.10 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 3cx6 h ILE 429 Cb 0.67 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 3cx6 h ILE 429 CO 0.05 0.23 -0.04 1.56 0.00 0.00 0.00 178.15 179.94 3cx6 h GLN 430 N 0.31 -0.12 -0.72 2.37 1.08 -0.48 -1.49 115.11 116.05 3cx6 h GLN 430 Ca 0.07 0.01 0.16 0.00 -1.45 0.00 0.00 58.65 57.43 3cx6 h GLN 430 Cb 0.31 0.03 -0.11 0.00 -0.05 0.00 0.00 27.48 27.66 3cx6 h GLN 430 CO 0.01 0.27 0.12 1.49 -0.95 0.00 0.00 178.83 179.78 3cx6 h GLU 431 N -0.55 0.21 -0.07 1.46 4.81 -1.06 0.43 114.58 119.82 3cx6 h GLU 431 Ca -0.01 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 3cx6 h GLU 431 Cb 0.45 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 3cx6 h GLU 431 CO 0.02 0.14 -0.27 1.96 -0.73 0.00 0.00 179.01 180.13 3cx6 h GLN 432 N 0.22 0.12 -0.08 1.92 4.20 -1.34 0.38 115.11 120.53 3cx6 h GLN 432 Ca 0.40 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 59.06 3cx6 h GLN 432 Cb 0.69 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.46 3cx6 h GLN 432 CO -0.54 0.38 -0.02 0.82 -0.67 0.00 0.00 178.83 178.80 3cx6 h ILE 433 N 0.11 1.30 -0.52 2.54 1.08 0.67 -0.99 117.51 121.70 3cx6 h ILE 433 Ca 0.02 -0.95 -0.03 0.00 -0.39 0.00 0.00 64.86 63.51 3cx6 h ILE 433 Cb 0.54 1.77 -0.02 0.00 -3.07 0.00 0.00 36.82 36.03 3cx6 h ILE 433 CO 0.04 0.26 0.18 0.78 -0.69 0.00 0.00 178.15 178.72 3cx6 h ASN 434 N -0.18 0.69 -0.04 1.72 -0.26 0.15 -1.88 115.58 115.78 3cx6 h ASN 434 Ca 0.02 -0.09 0.00 0.00 -0.56 0.00 0.00 56.30 55.67 3cx6 h ASN 434 Cb 0.43 -0.18 -0.00 0.00 -1.06 0.00 0.00 38.32 37.50 3cx6 h ASN 434 CO 0.01 0.65 0.01 0.44 -1.06 0.00 0.00 177.43 177.48 3cx6 h ASP 435 N 0.75 0.02 0.43 5.81 5.19 0.02 -1.97 116.42 126.67 3cx6 h ASP 435 Ca 0.18 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.48 3cx6 h ASP 435 Cb 0.19 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 3cx6 h ASP 435 CO -0.01 0.02 -0.49 0.22 -3.12 0.00 0.00 179.24 175.86 3cx6 h TYR 436 N 0.03 0.08 -0.18 4.55 3.20 -0.93 -2.57 116.97 121.15 3cx6 h TYR 436 Ca 0.02 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.78 3cx6 h TYR 436 Cb 0.01 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 3cx6 h TYR 436 CO -0.09 0.54 -0.28 0.00 -1.64 0.00 0.00 178.16 176.69 3cx6 h ARG 437 N 0.05 0.34 -0.46 1.82 3.08 -1.13 -0.58 114.38 117.50 3cx6 h ARG 437 Ca -0.00 -0.13 -0.10 0.00 0.07 0.00 0.00 59.98 59.82 3cx6 h ARG 437 Cb 0.88 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 3cx6 h ARG 437 CO 0.07 0.60 -0.12 1.03 -1.07 0.00 0.00 179.97 180.48 3cx6 h SER 438 N 0.31 0.84 0.10 7.04 0.87 -0.98 -1.92 113.55 119.81 3cx6 h SER 438 Ca 0.04 -0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.25 3cx6 h SER 438 Cb 0.65 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 3cx6 h SER 438 CO 0.05 0.97 -0.31 0.11 -0.53 0.00 0.00 176.83 177.12 3cx6 h LYS 439 N 0.76 0.32 -0.05 2.24 6.56 -1.02 -1.93 116.57 123.45 3cx6 h LYS 439 Ca 0.12 -0.13 -0.10 0.00 -1.06 0.00 0.00 60.65 59.49 3cx6 h LYS 439 Cb 0.62 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.25 3cx6 h LYS 439 CO 0.04 0.61 -0.42 0.00 -2.06 0.00 0.00 179.45 177.62 3cx6 h ARG 440 N 0.28 0.12 -0.18 3.15 3.08 -0.63 -1.76 114.38 118.44 3cx6 h ARG 440 Ca 0.04 -0.05 -0.13 0.00 0.07 0.00 0.00 59.98 59.90 3cx6 h ARG 440 Cb 0.69 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 3cx6 h ARG 440 CO 0.05 0.52 -0.45 1.15 -1.07 0.00 0.00 179.97 180.17 3cx6 h THR 441 N 0.10 1.32 0.00 2.04 2.02 -0.76 -1.67 112.91 115.96 3cx6 h THR 441 Ca 0.01 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 65.54 3cx6 h THR 441 Cb 0.79 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 3cx6 h THR 441 CO 0.06 0.51 0.00 0.18 0.37 0.00 0.00 175.52 176.64 3cx6 n LEU 442 N -4.00 0.00 -1.04 2.58 4.77 -0.78 -4.83 117.00 113.69 3cx6 n LEU 442 Ca -0.02 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.84 3cx6 n LEU 442 Cb 0.53 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.58 3cx6 n LEU 442 CO 0.45 0.00 -0.13 0.61 -1.33 0.00 0.00 177.39 176.99 3cx6 n GLY 443 N 0.33 0.94 1.36 -0.72 0.00 -0.63 -4.91 105.19 101.57 3cx6 n GLY 443 Ca 0.10 -0.44 0.05 0.00 0.00 0.00 0.00 46.02 45.73 3cx6 n GLY 443 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3cx6 n LEU 444 N -1.47 4.78 -0.24 0.99 4.77 -0.71 -4.60 117.00 120.51 3cx6 n LEU 444 Ca -0.13 -3.09 0.01 0.00 -0.03 0.00 0.00 56.01 52.78 3cx6 n LEU 444 Cb 0.45 -0.62 0.24 0.00 -2.33 0.00 0.00 43.42 41.16 3cx6 n LEU 444 CO 0.18 0.73 1.25 1.23 -1.33 0.00 0.00 177.39 179.44 3cx6 h GLY 445 N 2.48 1.12 2.00 -0.72 0.00 -1.81 -2.33 103.07 103.81 3cx6 h GLY 445 Ca 0.06 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 3cx6 h GLY 445 CO 0.39 0.37 -0.02 1.48 0.00 0.00 0.00 176.54 178.77 3cx6 h SER 446 N 1.03 0.00 0.19 0.19 4.64 -1.91 -1.34 113.55 116.35 3cx6 h SER 446 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3cx6 h SER 446 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3cx6 h SER 446 CO -0.08 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.08 3cx6 n LEU 447 N -3.76 0.00 -0.49 5.97 4.77 -0.88 -2.13 117.00 120.49 3cx6 n LEU 447 Ca -0.03 0.32 0.06 0.00 -0.03 0.00 0.00 56.01 56.34 3cx6 n LEU 447 Cb 0.10 -0.32 0.12 0.00 -2.33 0.00 0.00 43.42 40.98 3cx6 n LEU 447 CO 0.27 -0.23 0.38 -1.22 -1.33 0.00 0.00 177.39 175.27 3cx6 n TYR 448 N -1.32 0.00 -0.67 -1.77 4.02 -0.52 -4.97 117.16 111.93 3cx6 n TYR 448 Ca 0.04 -0.87 0.00 0.00 -0.01 0.00 0.00 57.90 57.06 3cx6 n TYR 448 Cb 0.08 -0.16 0.00 0.00 -0.02 0.00 0.00 39.34 39.24 3cx6 n TYR 448 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3cx6 n GLY 449 N -0.81 0.76 0.34 2.72 0.00 -0.91 -4.63 105.19 102.66 3cx6 n GLY 449 Ca 0.12 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.32 3cx6 n GLY 449 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3cx6 h GLU 450 N 2.89 0.00 0.00 1.61 4.81 -1.69 0.44 114.58 122.65 3cx6 h GLU 450 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3cx6 h GLU 450 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3cx6 h GLU 450 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 179.01 176.57 3cx6 n ASN 451 N -3.62 0.00 -0.38 1.04 5.15 -1.26 -1.68 115.26 114.51 3cx6 n ASN 451 Ca 0.01 0.42 0.12 0.00 -0.60 0.00 0.00 54.58 54.53 3cx6 n ASN 451 Cb 0.33 -0.46 0.49 0.00 -0.53 0.00 0.00 39.78 39.61 3cx6 n ASN 451 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3cx6 n ASP 452 N -1.46 1.16 -0.00 1.20 8.00 0.15 -3.66 116.55 121.94 3cx6 n ASP 452 Ca 0.04 -1.54 0.10 0.00 0.71 0.00 0.00 54.79 54.09 3cx6 n ASP 452 Cb 0.13 -0.05 -0.13 0.00 -0.02 0.00 0.00 41.12 41.05 3cx6 n ASP 452 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3cx6 n LEU 453 N -0.04 0.68 -0.17 0.64 4.77 -0.68 -4.70 117.00 117.50 3cx6 n LEU 453 Ca 0.17 -0.35 -0.07 0.00 -0.03 0.00 0.00 56.01 55.73 3cx6 n LEU 453 Cb 0.26 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.30 3cx6 n LEU 453 CO 0.14 0.17 0.49 -0.07 -1.33 0.00 0.00 177.39 176.79 3cx6 h LEU 454 N 0.00 -1.18 -4.52 2.23 3.38 -1.73 -2.90 115.31 110.59 3cx6 h LEU 454 Ca 0.00 0.17 -0.43 0.00 0.09 0.00 0.00 57.88 57.71 3cx6 h LEU 454 Cb 0.64 0.50 -0.09 0.00 0.09 0.00 0.00 40.66 41.80 3cx6 h LEU 454 CO 0.00 -0.18 0.95 0.61 0.09 0.00 0.00 178.44 179.91 3cx6 n GLY 455 N -1.18 3.85 3.39 0.83 0.00 -1.26 -4.91 105.19 105.91 3cx6 n GLY 455 Ca -0.00 -1.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.18 3cx6 n GLY 455 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cx6 s LEU 456 N -0.79 2.31 -0.01 0.99 1.43 -1.10 -5.08 118.68 116.43 3cx6 s LEU 456 Ca 0.64 -0.74 -0.00 0.00 -1.03 0.00 0.00 54.13 52.99 3cx6 s LEU 456 Cb 0.29 -1.22 0.01 0.00 0.03 0.00 0.00 46.19 45.31 3cx6 s LEU 456 CO -0.08 0.18 0.02 1.51 0.23 0.00 0.00 176.35 178.21 3cx6 s ASP 457 N -2.03 0.03 0.00 2.29 1.47 -1.26 -5.04 116.67 112.13 3cx6 s ASP 457 Ca 0.14 0.02 0.00 0.00 1.18 0.00 0.00 52.55 53.89 3cx6 s ASP 457 Cb -0.10 -0.03 0.00 0.00 -0.34 0.00 0.00 42.92 42.45 3cx6 s ASP 457 CO 0.06 -0.06 0.30 0.61 0.68 0.00 0.00 175.17 176.76 3cx6 n GLY 458 N 3.59 0.00 2.67 2.12 0.00 -1.26 -4.73 105.19 107.58 3cx6 n GLY 458 Ca -0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 3cx6 n GLY 458 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3cx6 s ASP 459 N 2.08 2.64 0.00 1.61 2.15 -1.26 -5.08 116.67 118.81 3cx6 s ASP 459 Ca 0.00 -0.73 0.00 0.00 0.43 0.00 0.00 52.55 52.25 3cx6 s ASP 459 Cb 0.00 -0.41 0.00 0.00 -0.30 0.00 0.00 42.92 42.21 3cx6 s ASP 459 CO 0.00 -0.33 0.46 -2.65 -0.17 0.00 0.00 175.17 172.48 3cx6 n PRO 460 N 5.17 0.00 -0.31 4.34 -0.02 -1.26 -1.94 135.00 140.97 3cx6 n PRO 460 Ca -0.08 0.46 0.07 0.00 -2.02 0.00 0.00 63.50 61.94 3cx6 n PRO 460 Cb 0.48 -0.86 0.18 0.00 -0.02 0.00 0.00 33.50 33.28 3cx6 n PRO 460 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3cx6 h LEU 461 N 0.00 -0.63 -0.12 2.45 5.85 -1.97 -1.43 115.31 119.45 3cx6 h LEU 461 Ca 0.00 0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 3cx6 h LEU 461 Cb 0.00 0.49 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 3cx6 h LEU 461 CO 0.00 -0.29 0.03 -0.09 -0.34 0.00 0.00 178.44 177.75 3cx6 h ARG 462 N 0.03 0.19 0.02 1.25 9.65 -1.88 -3.06 114.38 120.58 3cx6 h ARG 462 Ca 0.48 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 59.33 3cx6 h ARG 462 Cb 0.84 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.37 3cx6 h ARG 462 CO -0.87 0.35 -0.13 1.49 2.80 0.00 0.00 179.97 183.62 3cx6 h GLU 463 N -0.00 -0.21 0.00 0.20 4.81 -0.66 -0.91 114.58 117.81 3cx6 h GLU 463 Ca 0.04 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3cx6 h GLU 463 Cb 0.25 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3cx6 h GLU 463 CO 0.00 -0.14 0.00 2.89 -0.73 0.00 0.00 179.01 181.03 3cx6 n ARG 464 N -5.25 0.30 -0.08 1.92 1.85 -0.62 -0.46 116.66 114.32 3cx6 n ARG 464 Ca -0.06 0.00 -0.14 0.00 -1.00 0.00 0.00 57.85 56.65 3cx6 n ARG 464 Cb 0.18 -1.04 -0.14 0.00 -1.05 0.00 0.00 32.46 30.41 3cx6 n ARG 464 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 3cx6 n GLN 465 N -0.54 0.68 0.21 2.89 7.27 -0.35 -3.93 117.38 123.61 3cx6 n GLN 465 Ca 0.01 0.14 0.14 0.00 0.07 0.00 0.00 57.00 57.35 3cx6 n GLN 465 Cb 0.00 -1.60 0.39 0.00 2.41 0.00 0.00 30.24 31.44 3cx6 n GLN 465 CO 0.00 0.00 0.00 1.98 0.07 0.00 0.00 177.06 179.11 3cx6 h MET 466 N 0.01 0.00 -0.75 3.69 4.05 -0.73 -3.11 114.93 118.09 3cx6 h MET 466 Ca -0.49 0.00 0.07 0.00 -0.28 0.00 0.00 59.70 59.00 3cx6 h MET 466 Cb 2.06 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 32.80 3cx6 h MET 466 CO 0.01 0.00 0.42 0.00 0.23 0.00 0.00 176.91 177.58 3cx6 h ALA 467 N 2.11 1.03 -2.41 0.39 0.00 -1.62 -3.12 119.26 115.64 3cx6 h ALA 467 Ca 0.00 0.02 -0.45 0.00 0.00 0.00 0.00 54.91 54.48 3cx6 h ALA 467 Cb 0.75 -0.14 0.14 0.00 0.00 0.00 0.00 17.79 18.55 3cx6 h ALA 467 CO 0.00 0.09 0.28 -1.21 0.00 0.00 0.00 179.25 178.41 3cx6 s GLU 468 N -6.07 0.84 0.00 0.00 2.02 -1.18 -0.59 118.70 113.72 3cx6 s GLU 468 Ca -0.13 0.24 0.00 0.00 0.02 0.00 0.00 54.97 55.11 3cx6 s GLU 468 Cb 0.18 -1.81 0.00 0.00 0.10 0.00 0.00 34.13 32.60 3cx6 s GLU 468 CO 0.77 -2.39 0.00 1.17 0.02 0.00 0.00 175.26 174.83 3cx6 n LYS 469 N -3.89 0.00 -0.07 1.61 0.00 -1.26 -4.12 118.16 110.43 3cx6 n LYS 469 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 58.31 58.26 3cx6 n LYS 469 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.56 3cx6 n LYS 469 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 3cx6 h GLN 470 N 0.00 0.44 0.00 1.64 1.08 -1.47 -2.65 115.11 114.14 3cx6 h GLN 470 Ca 0.00 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 57.00 3cx6 h GLN 470 Cb 0.00 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.42 3cx6 h GLN 470 CO 0.00 0.75 0.00 -0.11 -0.95 0.00 0.00 178.83 178.52 3cx6 n LEU 471 N -4.53 0.23 0.03 1.46 7.94 0.24 -1.35 117.00 121.01 3cx6 n LEU 471 Ca -0.05 0.58 0.03 0.00 -1.11 0.00 0.00 56.01 55.46 3cx6 n LEU 471 Cb 0.35 -0.57 -0.09 0.00 0.53 0.00 0.00 43.42 43.64 3cx6 n LEU 471 CO 0.40 -0.51 -0.39 0.00 -1.11 0.00 0.00 177.39 175.78 3cx6 n ALA 472 N -1.60 2.16 1.81 1.96 0.00 -1.02 -3.81 120.51 120.00 3cx6 n ALA 472 Ca 0.01 -0.55 0.08 0.00 0.00 0.00 0.00 53.44 52.98 3cx6 n ALA 472 Cb 0.11 -0.88 0.47 0.00 0.00 0.00 0.00 19.45 19.16 3cx6 n ALA 472 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cx6 n ALA 473 N -2.36 2.50 0.01 0.00 0.00 -0.46 -2.83 120.51 117.36 3cx6 n ALA 473 Ca -0.09 -0.10 -0.15 0.00 0.00 0.00 0.00 53.44 53.10 3cx6 n ALA 473 Cb 0.77 -1.26 -0.14 0.00 0.00 0.00 0.00 19.45 18.82 3cx6 n ALA 473 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3cx6 h LEU 474 N 0.00 0.24 -1.98 0.00 3.38 -1.66 -3.32 115.31 111.98 3cx6 h LEU 474 Ca 0.00 -0.48 0.14 0.00 0.09 0.00 0.00 57.88 57.63 3cx6 h LEU 474 Cb 0.00 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3cx6 h LEU 474 CO 0.00 1.42 0.47 1.23 0.09 0.00 0.00 178.44 181.65 3cx6 h GLY 475 N 2.19 0.00 1.60 0.83 0.00 -1.74 0.33 103.07 106.28 3cx6 h GLY 475 Ca -0.32 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 3cx6 h GLY 475 CO 0.10 0.00 0.10 -0.55 0.00 0.00 0.00 176.54 176.19 3cx6 h ASP 476 N 0.00 0.47 0.11 0.19 5.19 -1.76 -0.89 116.42 119.74 3cx6 h ASP 476 Ca 0.24 -0.06 -0.37 0.00 -0.62 0.00 0.00 57.03 56.22 3cx6 h ASP 476 Cb 1.17 -0.12 -0.04 0.00 0.18 0.00 0.00 39.33 40.51 3cx6 h ASP 476 CO -0.00 0.47 -2.17 -0.38 -3.12 0.00 0.00 179.24 174.04 3cx6 n ILE 477 N -4.35 1.63 0.35 0.35 5.41 0.96 -4.40 119.36 119.31 3cx6 n ILE 477 Ca 0.02 -0.66 -0.18 0.00 1.00 0.00 0.00 62.75 62.93 3cx6 n ILE 477 Cb 0.17 -1.43 -0.09 0.00 -0.71 0.00 0.00 39.64 37.59 3cx6 n ILE 477 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3cx6 h LEU 478 N 0.03 -0.94 -0.96 1.39 3.38 -0.89 -2.70 115.31 114.62 3cx6 h LEU 478 Ca -0.47 0.05 0.10 0.00 0.09 0.00 0.00 57.88 57.65 3cx6 h LEU 478 Cb 2.01 0.27 -0.01 0.00 0.09 0.00 0.00 40.66 43.01 3cx6 h LEU 478 CO 0.02 -0.59 0.86 0.77 0.09 0.00 0.00 178.44 179.59 3cx6 h SER 479 N -0.94 0.00 -0.72 -0.43 4.64 -1.37 0.38 113.55 115.11 3cx6 h SER 479 Ca -0.08 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.84 3cx6 h SER 479 Cb 0.76 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.63 3cx6 h SER 479 CO 0.08 0.00 0.51 2.29 -0.87 0.00 0.00 176.83 178.85 3cx6 n LYS 480 N -2.96 1.98 -4.43 4.77 2.85 -1.02 -4.81 118.16 114.54 3cx6 n LYS 480 Ca 0.07 -2.21 -0.20 0.00 -1.05 0.00 0.00 58.31 54.92 3cx6 n LYS 480 Cb 0.99 -1.87 -0.14 0.00 -0.65 0.00 0.00 35.03 33.36 3cx6 n LYS 480 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3cx6 s TYR 481 N -2.47 1.13 0.95 5.58 2.02 0.13 -5.11 117.35 119.58 3cx6 s TYR 481 Ca 0.42 -0.28 -0.11 0.00 -0.37 0.00 0.00 57.07 56.74 3cx6 s TYR 481 Cb 0.35 -0.70 0.15 0.00 -0.40 0.00 0.00 41.96 41.36 3cx6 s TYR 481 CO 0.06 0.00 1.03 0.39 -1.57 0.00 0.00 175.55 175.46 3cx6 n GLU 482 N 2.33 -0.61 0.02 -0.62 -0.58 -1.26 -4.48 120.64 115.44 3cx6 n GLU 482 Ca -0.16 -0.12 0.02 0.00 -0.42 0.00 0.00 57.16 56.48 3cx6 n GLU 482 Cb 0.55 -2.29 0.35 0.00 -0.57 0.00 0.00 31.44 29.49 3cx6 n GLU 482 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 3cx6 h GLU 483 N -1.93 0.49 0.00 3.49 4.22 -1.96 0.21 114.58 119.10 3cx6 h GLU 483 Ca -0.45 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 58.92 3cx6 h GLU 483 Cb 1.28 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3cx6 h GLU 483 CO 0.41 0.46 0.00 -0.40 -2.18 0.00 0.00 179.01 177.30 3cx6 n ASP 484 N -4.35 0.00 -0.03 1.04 5.68 -1.26 -1.99 116.55 115.65 3cx6 n ASP 484 Ca 0.02 0.23 -0.04 0.00 -0.50 0.00 0.00 54.79 54.49 3cx6 n ASP 484 Cb 0.18 -0.38 -0.02 0.00 -1.14 0.00 0.00 41.12 39.76 3cx6 n ASP 484 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3cx6 n ARG 485 N -1.38 0.13 -0.04 0.11 1.74 -0.95 -4.52 116.66 111.75 3cx6 n ARG 485 Ca 0.07 0.04 -0.03 0.00 -0.77 0.00 0.00 57.85 57.16 3cx6 n ARG 485 Cb 0.19 -1.00 0.21 0.00 -1.02 0.00 0.00 32.46 30.84 3cx6 n ARG 485 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3cx6 h SER 486 N -0.06 0.59 0.89 0.55 4.64 -0.66 -2.10 113.55 117.40 3cx6 h SER 486 Ca -0.13 -0.16 -0.04 0.00 -0.47 0.00 0.00 61.79 60.99 3cx6 h SER 486 Cb 1.17 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 63.11 3cx6 h SER 486 CO -0.04 0.73 -0.43 0.00 -0.87 0.00 0.00 176.83 176.23 3cx6 h ALA 487 N 1.33 -1.27 -0.95 5.18 0.00 -1.60 -0.84 119.26 121.11 3cx6 h ALA 487 Ca 0.10 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 54.84 3cx6 h ALA 487 Cb 0.51 0.46 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 3cx6 h ALA 487 CO 0.03 -1.18 0.61 -1.00 0.00 0.00 0.00 179.25 177.71 3cx6 h PRO 488 N -1.24 0.98 0.37 0.00 0.13 -1.78 -0.23 132.00 130.22 3cx6 h PRO 488 Ca -0.12 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.95 3cx6 h PRO 488 Cb 0.91 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 31.80 3cx6 h PRO 488 CO 0.20 0.65 -0.35 0.52 -0.23 0.00 0.00 178.00 178.79 3cx6 h MET 489 N 1.01 -0.71 -1.00 0.86 2.86 -1.25 0.39 114.93 117.09 3cx6 h MET 489 Ca 0.44 0.05 0.13 0.00 -2.06 0.00 0.00 59.70 58.26 3cx6 h MET 489 Cb 0.35 0.16 -0.09 0.00 0.06 0.00 0.00 31.60 32.08 3cx6 h MET 489 CO -0.20 -0.47 0.63 0.22 1.06 0.00 0.00 176.91 178.15 3cx6 h ASP 490 N -0.73 0.89 -0.14 1.22 3.58 -0.62 0.12 116.42 120.74 3cx6 h ASP 490 Ca -0.03 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.48 3cx6 h ASP 490 Cb 0.66 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 3cx6 h ASP 490 CO -0.05 0.46 0.09 0.15 -2.88 0.00 0.00 179.24 177.01 3cx6 h PHE 491 N 0.95 0.18 0.12 0.28 3.57 -0.01 -2.40 116.94 119.63 3cx6 h PHE 491 Ca 0.50 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 62.00 3cx6 h PHE 491 Cb 0.55 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.23 3cx6 h PHE 491 CO -0.00 0.11 -0.06 0.00 -2.23 0.00 0.00 178.31 176.13 3cx6 h ALA 492 N 1.05 -0.17 -0.11 2.41 0.00 0.16 -1.78 119.26 120.84 3cx6 h ALA 492 Ca 0.05 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3cx6 h ALA 492 Cb -0.02 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3cx6 h ALA 492 CO -0.01 -0.54 -0.22 0.28 0.00 0.00 0.00 179.25 178.76 3cx6 h VAL 493 N -0.27 0.47 -0.15 0.00 2.07 -0.83 -2.59 116.25 114.96 3cx6 h VAL 493 Ca -0.02 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 3cx6 h VAL 493 Cb 0.22 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3cx6 h VAL 493 CO 0.03 0.00 -0.24 0.78 0.02 0.00 0.00 177.57 178.16 3cx6 h ASN 494 N -0.29 0.25 -0.43 0.57 2.35 -1.43 0.09 115.58 116.69 3cx6 h ASN 494 Ca 0.09 -0.07 0.03 0.00 -0.55 0.00 0.00 56.30 55.80 3cx6 h ASN 494 Cb 0.42 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 3cx6 h ASN 494 CO -0.27 0.50 0.24 0.74 -1.65 0.00 0.00 177.43 176.99 3cx6 h THR 495 N 0.24 1.00 0.14 2.81 2.02 -0.93 0.50 112.91 118.68 3cx6 h THR 495 Ca 0.04 -0.16 -0.29 0.00 0.77 0.00 0.00 66.41 66.76 3cx6 h THR 495 Cb 0.55 0.49 0.03 0.00 -1.74 0.00 0.00 68.15 67.48 3cx6 h THR 495 CO 0.04 0.09 -1.24 0.15 0.37 0.00 0.00 175.52 174.93 3cx6 h PHE 496 N 0.47 0.98 -0.65 3.16 3.57 -1.26 -2.83 116.94 120.38 3cx6 h PHE 496 Ca 0.18 -0.63 0.01 0.00 3.53 0.00 0.00 57.97 61.06 3cx6 h PHE 496 Cb 0.06 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 3cx6 h PHE 496 CO -0.09 1.47 0.43 0.52 -2.23 0.00 0.00 178.31 178.42 3cx6 h MET 497 N 0.22 0.85 -1.00 1.11 2.86 -0.80 -0.17 114.93 118.00 3cx6 h MET 497 Ca -0.19 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.40 3cx6 h MET 497 Cb 1.92 -0.19 -0.05 0.00 0.06 0.00 0.00 31.60 33.34 3cx6 h MET 497 CO 0.24 0.56 0.66 1.03 1.06 0.00 0.00 176.91 180.45 3cx6 h SER 498 N 0.87 1.15 1.11 1.22 0.87 -0.06 0.28 113.55 119.00 3cx6 h SER 498 Ca 0.24 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 3cx6 h SER 498 Cb -0.08 -0.29 0.00 0.00 -0.44 0.00 0.00 62.40 61.59 3cx6 h SER 498 CO -0.06 0.84 0.00 -0.74 -0.53 0.00 0.00 176.83 176.34 3cx6 h HIS 499 N 1.36 0.00 -0.00 2.24 6.17 -1.12 -1.29 115.15 122.51 3cx6 h HIS 499 Ca 0.37 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.45 3cx6 h HIS 499 Cb -0.15 0.00 0.00 0.00 2.52 0.00 0.00 27.41 29.78 3cx6 h HIS 499 CO 0.00 0.00 -0.62 0.00 0.71 0.00 0.00 177.93 178.02 3cx6 n ALA 500 N -1.99 3.86 -1.78 5.26 0.00 -0.04 -5.00 120.51 120.82 3cx6 n ALA 500 Ca 0.02 -0.47 -0.01 0.00 0.00 0.00 0.00 53.44 52.98 3cx6 n ALA 500 Cb 0.33 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.80 3cx6 n ALA 500 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cx6 n GLY 501 N 1.46 -0.61 0.00 0.00 0.00 0.80 -5.06 105.19 101.78 3cx6 n GLY 501 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3cx6 n GLY 501 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71