#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qgt h LEU 306 N 0.00 0.91 -0.18 -3.43 8.10 -2.02 -3.26 115.31 115.43 2qgt h LEU 306 Ca 0.00 -0.41 -0.12 0.00 0.11 0.00 0.00 57.88 57.46 2qgt h LEU 306 Cb 0.00 -0.25 -0.02 0.00 -0.44 0.00 0.00 40.66 39.95 2qgt h LEU 306 CO 0.00 1.18 -0.58 0.00 -4.11 0.00 0.00 178.44 174.93 2qgt h ALA 307 N 0.86 0.67 0.00 0.17 0.00 -1.98 -3.08 119.26 115.90 2qgt h ALA 307 Ca 0.06 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2qgt h ALA 307 Cb 0.95 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2qgt h ALA 307 CO 0.09 0.72 0.00 -0.07 0.00 0.00 0.00 179.25 179.99 2qgt h LEU 308 N 0.00 0.00 0.00 0.00 4.07 -1.97 -3.27 115.31 114.14 2qgt h LEU 308 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 2qgt h LEU 308 Cb 1.37 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.11 2qgt h LEU 308 CO 0.08 0.00 -0.81 -1.54 -1.08 0.00 0.00 178.44 175.09 2qgt n SER 309 N -2.66 0.72 -4.77 -0.43 3.41 -1.16 -4.94 113.62 103.79 2qgt n SER 309 Ca 0.02 -0.56 -0.41 0.00 -0.26 0.00 0.00 58.87 57.67 2qgt n SER 309 Cb 0.32 0.67 -0.00 0.00 -0.26 0.00 0.00 64.21 64.94 2qgt n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qgt s LEU 310 N -3.15 4.28 0.81 1.04 1.02 -1.23 -5.02 118.68 116.42 2qgt s LEU 310 Ca 0.08 2.96 -0.12 0.00 0.02 0.00 0.00 54.13 57.08 2qgt s LEU 310 Cb 0.16 -3.73 0.08 0.00 0.02 0.00 0.00 46.19 42.72 2qgt s LEU 310 CO 0.79 -0.90 1.17 0.42 0.02 0.00 0.00 176.35 177.85 2qgt s THR 311 N -1.15 2.15 0.19 5.49 -4.23 -1.26 -4.84 115.64 112.00 2qgt s THR 311 Ca 0.54 0.05 -0.12 0.00 -1.18 0.00 0.00 61.69 60.99 2qgt s THR 311 Cb -0.45 -3.03 0.11 0.00 1.34 0.00 0.00 72.50 70.47 2qgt s THR 311 CO 0.60 -0.07 1.76 0.00 -0.54 0.00 0.00 174.62 176.37 2qgt h ALA 312 N -1.05 0.68 -0.24 3.99 0.00 -1.94 0.11 119.26 120.81 2qgt h ALA 312 Ca -0.46 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 2qgt h ALA 312 Cb 1.32 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2qgt h ALA 312 CO 0.65 -0.17 -0.22 -0.44 0.00 0.00 0.00 179.25 179.07 2qgt h ASP 313 N 0.42 0.44 0.57 0.00 3.32 -1.96 -1.89 116.42 117.32 2qgt h ASP 313 Ca 0.26 -0.14 -0.16 0.00 0.02 0.00 0.00 57.03 57.01 2qgt h ASP 313 Cb 0.26 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2qgt h ASP 313 CO -0.24 0.67 -0.71 1.56 -1.72 0.00 0.00 179.24 178.79 2qgt h GLN 314 N 0.40 0.12 0.24 3.56 4.20 -1.85 -1.42 115.11 120.36 2qgt h GLN 314 Ca 0.06 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2qgt h GLN 314 Cb 0.61 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.42 2qgt h GLN 314 CO 0.04 0.78 -0.12 1.98 -0.67 0.00 0.00 178.83 180.85 2qgt h MET 315 N 0.08 -0.31 -0.61 1.46 4.05 -0.35 -0.47 114.93 118.78 2qgt h MET 315 Ca -0.02 0.02 0.07 0.00 -0.28 0.00 0.00 59.70 59.50 2qgt h MET 315 Cb 1.26 0.07 -0.06 0.00 -0.80 0.00 0.00 31.60 32.07 2qgt h MET 315 CO 0.10 -0.08 0.29 0.28 0.23 0.00 0.00 176.91 177.73 2qgt h VAL 316 N -0.51 0.87 -0.15 -5.77 2.07 -1.40 -0.86 116.25 110.51 2qgt h VAL 316 Ca -0.03 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.35 2qgt h VAL 316 Cb 0.38 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 2qgt h VAL 316 CO 0.05 0.10 -0.12 -1.28 0.02 0.00 0.00 177.57 176.34 2qgt h SER 317 N 0.52 -0.37 -0.62 0.57 0.87 -1.13 1.00 113.55 114.38 2qgt h SER 317 Ca 0.29 0.08 -0.06 0.00 -1.23 0.00 0.00 61.79 60.87 2qgt h SER 317 Cb 0.27 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.40 2qgt h SER 317 CO -0.23 -0.16 0.17 0.00 -0.53 0.00 0.00 176.83 176.08 2qgt h ALA 318 N 0.97 0.82 -0.29 6.23 0.00 -0.70 -1.84 119.26 124.45 2qgt h ALA 318 Ca 0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2qgt h ALA 318 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2qgt h ALA 318 CO -0.23 0.51 0.02 -0.07 0.00 0.00 0.00 179.25 179.49 2qgt h LEU 319 N 0.90 0.49 -0.63 0.00 3.38 -0.87 -1.15 115.31 117.43 2qgt h LEU 319 Ca 0.20 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.95 2qgt h LEU 319 Cb 0.32 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 2qgt h LEU 319 CO -0.00 0.65 0.33 -0.07 0.09 0.00 0.00 178.44 179.44 2qgt h LEU 320 N 0.31 0.47 -0.86 1.67 3.38 -0.73 -2.50 115.31 117.05 2qgt h LEU 320 Ca 0.09 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 2qgt h LEU 320 Cb 0.39 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2qgt h LEU 320 CO 0.01 0.30 -0.20 0.44 0.09 0.00 0.00 178.44 179.08 2qgt h ASP 321 N 0.61 0.00 0.67 -0.43 3.32 -1.23 -3.03 116.42 116.33 2qgt h ASP 321 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 2qgt h ASP 321 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2qgt h ASP 321 CO -0.20 0.20 -0.01 0.00 -1.72 0.00 0.00 179.24 177.51 2qgt n ALA 322 N -2.19 2.47 -1.67 3.45 0.00 -0.45 -4.95 120.51 117.18 2qgt n ALA 322 Ca 0.01 -0.14 -0.44 0.00 0.00 0.00 0.00 53.44 52.87 2qgt n ALA 322 Cb 0.47 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.42 2qgt n ALA 322 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qgt n GLU 323 N -1.33 2.05 -1.37 0.00 -0.58 -1.15 -4.45 120.64 113.81 2qgt n GLU 323 Ca 0.12 0.73 -0.31 0.00 -0.42 0.00 0.00 57.16 57.28 2qgt n GLU 323 Cb 0.27 -2.37 0.09 0.00 -0.57 0.00 0.00 31.44 28.86 2qgt n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2qgt s PRO 324 N -0.69 2.28 0.59 3.49 0.04 -1.26 -5.01 135.00 134.44 2qgt s PRO 324 Ca 0.66 1.00 -0.15 0.00 0.04 0.00 0.00 61.00 62.54 2qgt s PRO 324 Cb -0.63 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 2qgt s PRO 324 CO 0.52 -1.57 1.04 -1.25 0.04 0.00 0.00 177.00 175.78 2qgt s PRO 325 N -4.98 3.43 -0.31 0.56 0.04 -1.26 -5.02 135.00 127.46 2qgt s PRO 325 Ca 0.61 1.09 -0.22 0.00 0.04 0.00 0.00 61.00 62.52 2qgt s PRO 325 Cb -0.16 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.32 2qgt s PRO 325 CO 0.56 -0.71 0.70 0.42 0.04 0.00 0.00 177.00 178.00 2qgt s ILE 326 N -2.60 4.87 0.36 0.56 1.09 -1.26 -5.04 121.20 119.17 2qgt s ILE 326 Ca 0.61 0.95 -0.07 0.00 -1.10 0.00 0.00 60.65 61.05 2qgt s ILE 326 Cb -0.14 -4.08 -0.05 0.00 -1.06 0.00 0.00 42.46 37.13 2qgt s ILE 326 CO 0.39 -0.22 0.66 -0.76 -0.10 0.00 0.00 174.94 174.91 2qgt s LEU 327 N 2.78 3.92 0.32 2.97 1.43 -1.26 -4.99 118.68 123.85 2qgt s LEU 327 Ca 0.28 0.88 0.01 0.00 -1.03 0.00 0.00 54.13 54.28 2qgt s LEU 327 Cb -0.14 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.30 2qgt s LEU 327 CO 0.13 -0.33 0.51 -0.31 0.23 0.00 0.00 176.35 176.58 2qgt s TYR 328 N -2.29 3.49 0.36 0.29 1.51 -1.26 -4.37 117.35 115.09 2qgt s TYR 328 Ca 0.47 0.30 -0.13 0.00 -1.01 0.00 0.00 57.07 56.70 2qgt s TYR 328 Cb -0.10 -1.85 -0.08 0.00 -0.11 0.00 0.00 41.96 39.82 2qgt s TYR 328 CO 0.33 0.18 0.75 0.45 -1.11 0.00 0.00 175.55 176.15 2qgt s SER 329 N -3.96 6.65 -0.17 2.29 0.15 -1.26 -4.95 113.70 112.45 2qgt s SER 329 Ca 0.39 1.21 -0.02 0.00 0.70 0.00 0.00 55.95 58.23 2qgt s SER 329 Cb -0.10 -2.35 0.04 0.00 -1.71 0.00 0.00 66.02 61.90 2qgt s SER 329 CO 0.34 -0.30 2.40 -1.84 1.20 0.00 0.00 173.24 175.05 2qgt n GLU 330 N -0.82 1.65 -3.89 5.44 -0.00 -1.26 -4.93 120.64 116.83 2qgt n GLU 330 Ca 0.03 -1.04 -0.35 0.00 -0.00 0.00 0.00 57.16 55.79 2qgt n GLU 330 Cb 0.54 -1.55 -0.10 0.00 -0.00 0.00 0.00 31.44 30.33 2qgt n GLU 330 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 2qgt s TYR 331 N -0.69 3.26 -0.24 -1.84 6.14 -1.26 -5.08 117.35 117.63 2qgt s TYR 331 Ca 0.31 0.07 -0.12 0.00 0.64 0.00 0.00 57.07 57.97 2qgt s TYR 331 Cb 0.19 -2.14 -0.05 0.00 0.42 0.00 0.00 41.96 40.38 2qgt s TYR 331 CO -0.03 0.09 0.21 0.16 0.64 0.00 0.00 175.55 176.61 2qgt s ASP 332 N 0.65 6.15 0.00 4.32 3.84 -1.26 -5.00 116.67 125.37 2qgt s ASP 332 Ca 0.05 0.15 0.00 0.00 -0.00 0.00 0.00 52.55 52.75 2qgt s ASP 332 Cb -0.13 -2.13 0.00 0.00 -1.38 0.00 0.00 42.92 39.28 2qgt s ASP 332 CO 0.01 0.02 0.98 -0.81 -0.00 0.00 0.00 175.17 175.37 2qgt n PRO 333 N 4.48 0.98 0.00 2.11 -0.04 -1.26 -2.69 135.00 138.58 2qgt n PRO 333 Ca -0.14 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.42 2qgt n PRO 333 Cb 0.52 -1.00 -0.03 0.00 -0.04 0.00 0.00 33.50 32.94 2qgt n PRO 333 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2qgt n THR 334 N -0.50 0.00 -4.21 0.52 -2.24 -1.26 -4.93 114.28 101.67 2qgt n THR 334 Ca 0.00 -0.21 -0.34 0.00 -2.27 0.00 0.00 64.05 61.23 2qgt n THR 334 Cb 0.00 1.18 -0.12 0.00 -2.10 0.00 0.00 70.33 69.29 2qgt n THR 334 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qgt s ARG 335 N -2.50 3.74 0.92 -0.78 1.81 -1.10 -5.11 118.95 115.93 2qgt s ARG 335 Ca 0.15 -0.47 -0.11 0.00 -1.72 0.00 0.00 55.73 53.57 2qgt s ARG 335 Cb 0.16 -3.04 0.15 0.00 -0.45 0.00 0.00 34.95 31.77 2qgt s ARG 335 CO 0.61 0.18 1.11 -1.25 -0.68 0.00 0.00 175.30 175.28 2qgt s PRO 336 N 0.55 1.02 0.34 3.54 0.04 -1.26 -4.95 135.00 134.28 2qgt s PRO 336 Ca -0.01 1.27 -0.12 0.00 0.04 0.00 0.00 61.00 62.18 2qgt s PRO 336 Cb -0.14 -1.75 -0.07 0.00 0.04 0.00 0.00 34.50 32.58 2qgt s PRO 336 CO 0.02 -2.54 0.71 -0.06 0.04 0.00 0.00 177.00 175.17 2qgt s PHE 337 N -2.71 3.42 0.31 0.56 0.40 -1.26 -5.04 117.98 113.66 2qgt s PHE 337 Ca 0.65 1.06 0.04 0.00 -0.60 0.00 0.00 56.93 58.08 2qgt s PHE 337 Cb -0.21 -2.43 -0.06 0.00 0.51 0.00 0.00 43.02 40.83 2qgt s PHE 337 CO 0.58 0.05 0.03 -1.54 0.70 0.00 0.00 175.22 175.04 2qgt s SER 338 N -2.69 2.40 0.28 1.36 1.04 -1.26 -4.99 113.70 109.83 2qgt s SER 338 Ca 0.51 -1.33 0.02 0.00 0.48 0.00 0.00 55.95 55.63 2qgt s SER 338 Cb -0.10 -0.09 0.58 0.00 0.10 0.00 0.00 66.02 66.50 2qgt s SER 338 CO 0.24 -0.55 1.81 -0.08 0.98 0.00 0.00 173.24 175.64 2qgt h GLU 339 N 2.18 0.87 -0.03 4.02 4.81 -1.98 -0.29 114.58 124.16 2qgt h GLU 339 Ca -0.40 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.75 2qgt h GLU 339 Cb 1.24 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2qgt h GLU 339 CO 0.69 0.58 -0.06 0.00 -0.73 0.00 0.00 179.01 179.48 2qgt h ALA 340 N 1.56 0.05 -0.49 2.92 0.00 -1.88 -2.31 119.26 119.11 2qgt h ALA 340 Ca 0.50 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2qgt h ALA 340 Cb 0.58 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2qgt h ALA 340 CO -0.30 -0.11 0.11 0.66 0.00 0.00 0.00 179.25 179.61 2qgt h SER 341 N -0.41 0.75 -0.38 0.00 4.64 -1.82 0.10 113.55 116.43 2qgt h SER 341 Ca 0.00 -0.24 -0.04 0.00 -0.47 0.00 0.00 61.79 61.04 2qgt h SER 341 Cb 0.63 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2qgt h SER 341 CO 0.01 0.79 0.06 -0.03 -0.87 0.00 0.00 176.83 176.80 2qgt h MET 342 N 0.67 0.62 -0.26 4.77 -1.53 -1.12 0.13 114.93 118.21 2qgt h MET 342 Ca 0.15 -0.17 -0.03 0.00 -3.44 0.00 0.00 59.70 56.22 2qgt h MET 342 Cb 0.34 -0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.30 2qgt h MET 342 CO 0.00 0.68 0.04 0.52 0.14 0.00 0.00 176.91 178.30 2qgt h MET 343 N 0.47 0.38 -0.46 0.39 2.07 -1.31 -1.54 114.93 114.92 2qgt h MET 343 Ca 0.11 -0.06 -0.06 0.00 -2.07 0.00 0.00 59.70 57.63 2qgt h MET 343 Cb 0.36 -0.07 -0.02 0.00 -1.87 0.00 0.00 31.60 30.01 2qgt h MET 343 CO 0.01 0.38 0.05 0.78 1.07 0.00 0.00 176.91 179.19 2qgt h GLY 344 N 0.63 0.83 0.86 8.32 0.00 -0.33 -2.21 103.07 111.17 2qgt h GLY 344 Ca 0.09 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 2qgt h GLY 344 CO -0.00 0.53 0.03 1.41 0.00 0.00 0.00 176.54 178.51 2qgt h LEU 345 N 0.63 0.40 -0.08 3.11 3.38 -0.53 -1.44 115.31 120.77 2qgt h LEU 345 Ca 0.14 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2qgt h LEU 345 Cb 0.42 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 2qgt h LEU 345 CO 0.01 0.57 0.02 -0.07 0.09 0.00 0.00 178.44 179.06 2qgt h LEU 346 N 0.21 0.12 -0.63 1.67 3.38 -1.28 -1.47 115.31 117.30 2qgt h LEU 346 Ca 0.07 -0.23 -0.15 0.00 0.09 0.00 0.00 57.88 57.67 2qgt h LEU 346 Cb 0.35 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2qgt h LEU 346 CO 0.01 0.32 -0.54 0.71 0.09 0.00 0.00 178.44 179.02 2qgt h THR 347 N -0.08 1.34 -0.38 0.22 1.35 -1.47 -1.26 112.91 112.62 2qgt h THR 347 Ca 0.02 -1.81 -0.01 0.00 -0.55 0.00 0.00 66.41 64.06 2qgt h THR 347 Cb 0.24 1.83 -0.02 0.00 -1.73 0.00 0.00 68.15 68.48 2qgt h THR 347 CO 0.00 0.55 0.19 -1.13 -0.25 0.00 0.00 175.52 174.88 2qgt h ASN 348 N 0.31 0.50 -0.01 5.36 -0.73 -1.22 -0.17 115.58 119.61 2qgt h ASN 348 Ca 0.01 -0.11 0.02 0.00 1.87 0.00 0.00 56.30 58.08 2qgt h ASN 348 Cb 1.05 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 39.49 2qgt h ASN 348 CO 0.09 0.47 -0.08 0.25 -0.37 0.00 0.00 177.43 177.79 2qgt h LEU 349 N 0.49 -0.23 -1.07 0.34 5.85 -1.17 -2.62 115.31 116.90 2qgt h LEU 349 Ca 0.13 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.91 2qgt h LEU 349 Cb 0.10 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 2qgt h LEU 349 CO -0.02 -0.12 0.63 0.00 -0.34 0.00 0.00 178.44 178.59 2qgt h ALA 350 N 0.86 1.34 -0.43 1.25 0.00 -1.02 -0.48 119.26 120.79 2qgt h ALA 350 Ca 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2qgt h ALA 350 Cb 0.18 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2qgt h ALA 350 CO -0.09 0.60 0.15 0.22 0.00 0.00 0.00 179.25 180.13 2qgt h ASP 351 N 1.26 0.61 -0.49 0.00 3.58 -0.90 -0.09 116.42 120.38 2qgt h ASP 351 Ca 0.36 -0.19 -0.08 0.00 0.42 0.00 0.00 57.03 57.54 2qgt h ASP 351 Cb -0.10 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 2qgt h ASP 351 CO -0.09 0.63 0.01 0.03 -2.88 0.00 0.00 179.24 176.94 2qgt h ARG 352 N 0.55 0.91 -0.60 0.28 3.08 -1.05 -2.98 114.38 114.58 2qgt h ARG 352 Ca 0.14 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.88 2qgt h ARG 352 Cb 0.22 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 2qgt h ARG 352 CO -0.01 0.90 0.18 0.93 -1.07 0.00 0.00 179.97 180.90 2qgt h GLU 353 N 0.85 0.90 -0.91 0.04 5.08 -0.72 -2.86 114.58 116.96 2qgt h GLU 353 Ca 0.16 -0.17 0.07 0.00 -1.00 0.00 0.00 59.36 58.41 2qgt h GLU 353 Cb 0.49 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 2qgt h GLU 353 CO 0.02 0.78 0.59 -0.07 -1.00 0.00 0.00 179.01 179.34 2qgt h LEU 354 N 0.87 0.90 -0.46 1.33 3.38 -0.85 0.11 115.31 120.59 2qgt h LEU 354 Ca 0.20 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 2qgt h LEU 354 Cb 0.27 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2qgt h LEU 354 CO -0.01 0.58 0.18 0.58 0.09 0.00 0.00 178.44 179.86 2qgt h VAL 355 N 1.03 1.21 -0.11 1.22 2.07 -1.55 -1.75 116.25 118.37 2qgt h VAL 355 Ca 0.39 -0.64 -0.10 0.00 0.82 0.00 0.00 66.70 67.16 2qgt h VAL 355 Cb 0.20 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2qgt h VAL 355 CO -0.15 0.24 -0.39 0.45 0.02 0.00 0.00 177.57 177.74 2qgt h HIS 356 N 0.59 0.27 -0.93 1.57 3.86 -1.52 -2.94 115.15 116.06 2qgt h HIS 356 Ca 0.15 -0.07 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 2qgt h HIS 356 Cb 0.20 -0.06 -0.05 0.00 1.06 0.00 0.00 27.41 28.56 2qgt h HIS 356 CO 0.00 0.59 0.58 1.98 0.86 0.00 0.00 177.93 181.94 2qgt h MET 357 N 0.20 1.25 -0.60 2.45 -1.53 -0.46 -1.67 114.93 114.57 2qgt h MET 357 Ca 0.02 -0.10 0.03 0.00 -3.44 0.00 0.00 59.70 56.20 2qgt h MET 357 Cb 0.78 -0.27 -0.04 0.00 -0.55 0.00 0.00 31.60 31.52 2qgt h MET 357 CO 0.06 0.87 0.36 0.82 0.14 0.00 0.00 176.91 179.16 2qgt h ILE 358 N 1.28 1.06 -0.59 1.77 5.03 -1.15 0.10 117.51 125.02 2qgt h ILE 358 Ca 0.34 -0.24 -0.07 0.00 -0.12 0.00 0.00 64.86 64.76 2qgt h ILE 358 Cb -0.08 0.29 -0.02 0.00 -3.03 0.00 0.00 36.82 33.98 2qgt h ILE 358 CO -0.07 0.13 0.09 0.78 -0.68 0.00 0.00 178.15 178.40 2qgt h ASN 359 N 0.71 0.90 0.08 1.72 2.35 -1.47 -2.11 115.58 117.75 2qgt h ASN 359 Ca 0.24 -0.20 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2qgt h ASN 359 Cb 0.03 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.16 2qgt h ASN 359 CO -0.11 0.91 -0.04 -0.25 -1.65 0.00 0.00 177.43 176.30 2qgt h TRP 360 N 0.89 -0.09 -0.80 1.19 7.01 -1.05 -3.05 115.95 120.05 2qgt h TRP 360 Ca 0.18 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.19 2qgt h TRP 360 Cb 0.40 0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.45 2qgt h TRP 360 CO 0.03 -0.05 0.53 0.00 -2.79 0.00 0.00 178.44 176.15 2qgt h ALA 361 N 0.82 1.02 0.00 2.65 0.00 -0.53 0.34 119.26 123.57 2qgt h ALA 361 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qgt h ALA 361 Cb 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2qgt h ALA 361 CO 0.02 0.40 0.00 0.87 0.00 0.00 0.00 179.25 180.54 2qgt h LYS 362 N 1.06 0.00 -0.01 0.00 1.57 -1.37 -1.18 116.57 116.65 2qgt h LYS 362 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2qgt h LYS 362 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.22 2qgt h LYS 362 CO -0.08 0.00 -0.77 0.54 -0.57 0.00 0.00 179.45 178.57 2qgt n ARG 363 N -2.35 0.48 -2.01 3.15 1.74 0.05 -4.45 116.66 113.27 2qgt n ARG 363 Ca -0.00 -0.40 -0.42 0.00 -0.77 0.00 0.00 57.85 56.26 2qgt n ARG 363 Cb 0.12 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 2qgt n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2qgt s VAL 364 N -2.79 3.58 0.12 1.55 1.01 -0.45 -4.82 120.40 118.60 2qgt s VAL 364 Ca 0.12 0.69 -0.35 0.00 0.00 0.00 0.00 61.98 62.44 2qgt s VAL 364 Cb 0.17 -3.50 -0.17 0.00 0.00 0.00 0.00 36.38 32.88 2qgt s VAL 364 CO 0.74 -0.12 1.19 -2.65 0.00 0.00 0.00 175.10 174.26 2qgt n PRO 365 N 7.36 0.98 0.00 2.72 -0.02 -1.26 -1.27 135.00 143.51 2qgt n PRO 365 Ca 0.18 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2qgt n PRO 365 Cb 0.44 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 2qgt n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qgt n GLY 366 N 2.14 3.10 0.28 -1.23 0.00 -1.26 -4.90 105.19 103.32 2qgt n GLY 366 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 2qgt n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2qgt h PHE 367 N 0.00 1.01 0.00 1.61 3.57 -1.47 -2.91 116.94 118.76 2qgt h PHE 367 Ca 0.00 -0.22 0.00 0.00 3.53 0.00 0.00 57.97 61.28 2qgt h PHE 367 Cb 0.00 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.49 2qgt h PHE 367 CO 0.00 0.99 0.00 -0.39 -2.23 0.00 0.00 178.31 176.68 2qgt h VAL 368 N 0.79 0.00 0.00 1.41 -1.51 -1.78 -2.33 116.25 112.83 2qgt h VAL 368 Ca 0.12 -0.36 -0.03 0.00 -1.23 0.00 0.00 66.70 65.19 2qgt h VAL 368 Cb 0.71 1.20 -0.00 0.00 -2.13 0.00 0.00 31.29 31.06 2qgt h VAL 368 CO 0.05 0.00 -0.16 0.44 -1.23 0.00 0.00 177.57 176.67 2qgt h ASP 369 N 0.00 0.00 -4.20 4.19 3.32 -1.90 -3.46 116.42 114.37 2qgt h ASP 369 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 2qgt h ASP 369 Cb 0.47 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.05 2qgt h ASP 369 CO 0.00 0.16 0.38 -0.76 -1.72 0.00 0.00 179.24 177.30 2qgt s LEU 370 N -6.50 3.56 0.70 1.55 1.43 -0.88 -5.03 118.68 113.51 2qgt s LEU 370 Ca 0.02 1.64 -0.15 0.00 -1.03 0.00 0.00 54.13 54.61 2qgt s LEU 370 Cb 0.09 -4.51 0.02 0.00 0.03 0.00 0.00 46.19 41.81 2qgt s LEU 370 CO 0.63 -0.80 1.15 0.42 0.23 0.00 0.00 176.35 177.98 2qgt s THR 371 N -2.60 2.79 0.24 5.49 -4.23 -1.26 -4.77 115.64 111.30 2qgt s THR 371 Ca 0.60 0.37 -0.04 0.00 -1.18 0.00 0.00 61.69 61.44 2qgt s THR 371 Cb -0.12 -2.90 0.21 0.00 1.34 0.00 0.00 72.50 71.03 2qgt s THR 371 CO 0.34 -0.22 1.73 0.25 -0.54 0.00 0.00 174.62 176.19 2qgt h LEU 372 N -0.16 0.30 -0.74 4.79 5.85 -1.95 0.50 115.31 123.90 2qgt h LEU 372 Ca -0.47 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.40 2qgt h LEU 372 Cb 1.27 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 42.32 2qgt h LEU 372 CO 0.52 0.12 0.45 -0.74 -0.34 0.00 0.00 178.44 178.44 2qgt h HIS 373 N 0.46 0.82 -0.23 1.25 2.76 -2.00 -0.52 115.15 117.70 2qgt h HIS 373 Ca 0.41 0.03 -0.19 0.00 -2.20 0.00 0.00 60.37 58.41 2qgt h HIS 373 Cb 0.60 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 29.29 2qgt h HIS 373 CO -0.16 0.43 -0.60 -0.44 -1.30 0.00 0.00 177.93 175.86 2qgt h ASP 374 N 0.83 0.86 -0.36 3.26 3.32 -1.58 -2.02 116.42 120.74 2qgt h ASP 374 Ca 0.32 -0.49 0.03 0.00 0.02 0.00 0.00 57.03 56.92 2qgt h ASP 374 Cb 0.13 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 2qgt h ASP 374 CO -0.16 1.26 0.15 1.56 -1.72 0.00 0.00 179.24 180.34 2qgt h GLN 375 N 0.57 0.31 -0.13 3.56 4.20 -0.62 -1.43 115.11 121.57 2qgt h GLN 375 Ca -0.00 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.72 2qgt h GLN 375 Cb 1.20 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.88 2qgt h GLN 375 CO 0.13 0.20 -0.05 0.28 -0.67 0.00 0.00 178.83 178.72 2qgt h VAL 376 N 0.32 0.84 -0.55 -0.54 2.07 -1.03 -1.85 116.25 115.51 2qgt h VAL 376 Ca 0.16 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.74 2qgt h VAL 376 Cb 0.11 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 2qgt h VAL 376 CO -0.14 0.00 0.26 -0.74 0.02 0.00 0.00 177.57 176.97 2qgt h HIS 377 N -0.02 0.48 -0.45 1.57 -0.00 -1.19 0.72 115.15 116.26 2qgt h HIS 377 Ca 0.07 0.02 -0.08 0.00 -0.00 0.00 0.00 60.37 60.38 2qgt h HIS 377 Cb 0.12 -0.13 -0.02 0.00 -0.00 0.00 0.00 27.41 27.39 2qgt h HIS 377 CO -0.18 0.21 -0.04 -0.07 -0.00 0.00 0.00 177.93 177.85 2qgt h LEU 378 N 0.50 0.81 -0.29 0.26 3.38 -1.03 -1.37 115.31 117.58 2qgt h LEU 378 Ca 0.25 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2qgt h LEU 378 Cb 0.20 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2qgt h LEU 378 CO -0.20 0.95 -0.17 -0.07 0.09 0.00 0.00 178.44 179.05 2qgt h LEU 379 N 0.66 0.64 -0.95 1.67 3.38 -1.20 -1.85 115.31 117.66 2qgt h LEU 379 Ca 0.12 -0.42 0.09 0.00 0.09 0.00 0.00 57.88 57.76 2qgt h LEU 379 Cb 0.56 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.06 2qgt h LEU 379 CO 0.03 0.93 0.59 -0.33 0.09 0.00 0.00 178.44 179.75 2qgt h GLU 380 N 0.36 0.98 -0.24 1.13 5.08 -0.82 0.55 114.58 121.63 2qgt h GLU 380 Ca 0.06 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.23 2qgt h GLU 380 Cb 0.70 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 2qgt h GLU 380 CO 0.05 0.65 -0.38 0.00 -1.00 0.00 0.00 179.01 178.33 2qgt n ALA 382 N -2.52 4.44 -0.22 0.00 0.00 -0.71 -4.72 120.51 116.79 2qgt n ALA 382 Ca -0.05 -0.58 0.03 0.00 0.00 0.00 0.00 53.44 52.84 2qgt n ALA 382 Cb 0.52 -0.73 0.14 0.00 0.00 0.00 0.00 19.45 19.38 2qgt n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2qgt h TRP 383 N 0.37 0.29 -0.00 0.00 5.08 -1.06 -0.50 115.95 120.13 2qgt h TRP 383 Ca 0.00 0.04 -0.16 0.00 1.08 0.00 0.00 58.89 59.84 2qgt h TRP 383 Cb 0.51 -0.03 -0.02 0.00 -3.00 0.00 0.00 29.16 26.62 2qgt h TRP 383 CO 0.00 -0.02 -0.78 1.25 -1.28 0.00 0.00 178.44 177.61 2qgt h LEU 384 N 0.31 0.01 -0.82 0.11 5.85 -1.86 -1.62 115.31 117.29 2qgt h LEU 384 Ca 0.36 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.08 2qgt h LEU 384 Cb 0.55 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 2qgt h LEU 384 CO -0.42 0.78 0.52 -0.33 -0.34 0.00 0.00 178.44 178.64 2qgt h GLU 385 N 0.00 1.09 -0.37 1.25 5.08 -1.62 -0.77 114.58 119.25 2qgt h GLU 385 Ca -0.01 -0.08 -0.12 0.00 -1.00 0.00 0.00 59.36 58.14 2qgt h GLU 385 Cb 1.38 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 2qgt h GLU 385 CO 0.10 0.75 -0.25 0.82 -1.00 0.00 0.00 179.01 179.43 2qgt h ILE 386 N 1.11 1.28 -0.66 3.13 2.04 -0.88 -1.47 117.51 122.06 2qgt h ILE 386 Ca 0.30 -1.41 -0.04 0.00 1.00 0.00 0.00 64.86 64.71 2qgt h ILE 386 Cb -0.08 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 2qgt h ILE 386 CO -0.06 0.47 0.27 -0.07 0.00 0.00 0.00 178.15 178.75 2qgt h LEU 387 N 0.62 0.89 -0.14 1.44 3.38 -1.08 -2.80 115.31 117.62 2qgt h LEU 387 Ca 0.07 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 2qgt h LEU 387 Cb 0.82 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2qgt h LEU 387 CO 0.07 0.79 -0.36 0.24 0.09 0.00 0.00 178.44 179.27 2qgt h MET 388 N 0.95 0.49 -0.49 1.13 2.86 -0.93 -0.92 114.93 118.01 2qgt h MET 388 Ca 0.22 -0.34 -0.05 0.00 -2.06 0.00 0.00 59.70 57.47 2qgt h MET 388 Cb 0.18 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2qgt h MET 388 CO -0.02 0.96 0.09 0.97 1.06 0.00 0.00 176.91 179.97 2qgt h ILE 389 N 0.10 1.22 -0.23 -1.22 2.10 -1.30 0.79 117.51 118.96 2qgt h ILE 389 Ca -0.01 -0.82 0.01 0.00 1.08 0.00 0.00 64.86 65.12 2qgt h ILE 389 Cb 0.98 0.75 -0.02 0.00 -1.09 0.00 0.00 36.82 37.44 2qgt h ILE 389 CO 0.08 0.30 0.12 1.23 -1.08 0.00 0.00 178.15 178.80 2qgt h GLY 390 N 0.94 0.31 0.78 8.18 0.00 -1.45 -0.35 103.07 111.47 2qgt h GLY 390 Ca 0.16 -0.09 0.02 0.00 0.00 0.00 0.00 47.33 47.42 2qgt h GLY 390 CO 0.00 0.08 -0.09 -2.00 0.00 0.00 0.00 176.54 174.53 2qgt h LEU 391 N 0.25 -0.25 -0.32 3.11 5.85 -0.59 -0.90 115.31 122.46 2qgt h LEU 391 Ca 0.09 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.87 2qgt h LEU 391 Cb 0.02 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2qgt h LEU 391 CO -0.06 -0.13 0.17 0.58 -0.34 0.00 0.00 178.44 178.66 2qgt h VAL 392 N -0.15 1.00 -0.11 1.05 2.07 -0.77 -1.45 116.25 117.88 2qgt h VAL 392 Ca 0.03 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.46 2qgt h VAL 392 Cb 0.19 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2qgt h VAL 392 CO -0.09 0.06 -0.06 -0.25 0.02 0.00 0.00 177.57 177.25 2qgt h TRP 393 N 0.35 -0.14 0.00 1.57 2.91 -0.87 -2.43 115.95 117.34 2qgt h TRP 393 Ca 0.13 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.16 2qgt h TRP 393 Cb 0.03 0.08 0.00 0.00 -0.51 0.00 0.00 29.16 28.76 2qgt h TRP 393 CO -0.09 -0.10 0.00 2.89 -1.03 0.00 0.00 178.44 180.11 2qgt n ARG 394 N -5.19 0.02 0.00 2.65 1.85 -0.36 -2.24 116.66 113.39 2qgt n ARG 394 Ca -0.04 0.14 0.13 0.00 -1.00 0.00 0.00 57.85 57.08 2qgt n ARG 394 Cb 0.12 -1.53 0.38 0.00 -1.05 0.00 0.00 32.46 30.38 2qgt n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2qgt n SER 395 N -1.57 0.83 -0.28 2.89 7.64 -0.58 -4.54 113.62 118.01 2qgt n SER 395 Ca 0.05 -0.69 0.10 0.00 1.01 0.00 0.00 58.87 59.33 2qgt n SER 395 Cb 0.26 0.13 0.25 0.00 -1.01 0.00 0.00 64.21 63.84 2qgt n SER 395 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 2qgt h MET 396 N 0.85 0.37 -0.59 1.43 4.05 -0.98 -0.01 114.93 120.05 2qgt h MET 396 Ca 0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 2qgt h MET 396 Cb 0.49 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 2qgt h MET 396 CO 0.00 0.24 0.00 0.39 0.23 0.00 0.00 176.91 177.77 2qgt n GLU 397 N -5.07 2.62 -3.61 0.39 -0.58 -1.26 -4.50 120.64 108.64 2qgt n GLU 397 Ca 0.18 -1.69 -0.27 0.00 -0.42 0.00 0.00 57.16 54.96 2qgt n GLU 397 Cb 0.55 -1.64 -0.10 0.00 -0.57 0.00 0.00 31.44 29.69 2qgt n GLU 397 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2qgt n HIS 398 N 0.57 2.28 -1.60 -0.32 8.25 -0.02 -5.09 115.22 119.30 2qgt n HIS 398 Ca 0.15 -4.02 -0.54 0.00 -0.26 0.00 0.00 57.72 53.05 2qgt n HIS 398 Cb 0.58 -0.43 -0.06 0.00 1.12 0.00 0.00 29.99 31.20 2qgt n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2qgt n PRO 399 N 1.74 0.99 -0.99 -0.41 -0.02 -1.26 -1.20 135.00 133.84 2qgt n PRO 399 Ca 0.25 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2qgt n PRO 399 Cb 0.41 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 2qgt n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qgt n GLY 400 N 2.66 0.49 3.13 -1.23 0.00 -1.26 -5.00 105.19 103.97 2qgt n GLY 400 Ca 0.20 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.05 2qgt n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qgt s LYS 401 N -0.28 0.76 -0.29 1.61 1.02 -0.34 -3.88 119.74 118.34 2qgt s LYS 401 Ca 0.00 -0.82 -0.06 0.00 0.02 0.00 0.00 55.97 55.11 2qgt s LYS 401 Cb 0.00 -0.71 0.01 0.00 -0.52 0.00 0.00 37.83 36.61 2qgt s LYS 401 CO 0.00 0.16 0.06 -0.51 -0.92 0.00 0.00 175.35 174.14 2qgt s LEU 402 N -1.47 3.73 -1.12 3.17 1.43 0.63 -4.80 118.68 120.25 2qgt s LEU 402 Ca -0.03 -0.71 -0.16 0.00 -1.03 0.00 0.00 54.13 52.21 2qgt s LEU 402 Cb -0.09 -1.85 0.15 0.00 0.03 0.00 0.00 46.19 44.43 2qgt s LEU 402 CO 0.01 -0.17 1.35 -0.22 0.23 0.00 0.00 176.35 177.55 2qgt s LEU 403 N 1.48 4.96 0.15 1.79 0.20 -1.26 -0.80 118.68 125.20 2qgt s LEU 403 Ca 0.02 -2.64 -0.14 0.00 0.69 0.00 0.00 54.13 52.06 2qgt s LEU 403 Cb -0.17 -2.41 0.02 0.00 -0.43 0.00 0.00 46.19 43.20 2qgt s LEU 403 CO 0.02 -0.88 1.68 -0.26 -0.29 0.00 0.00 176.35 176.62 2qgt h PHE 404 N 7.76 0.74 -3.95 5.38 0.04 -1.60 -3.42 116.94 121.88 2qgt h PHE 404 Ca 0.27 -0.07 -0.11 0.00 2.80 0.00 0.00 57.97 60.86 2qgt h PHE 404 Cb 0.92 -0.22 -0.13 0.00 2.20 0.00 0.00 35.95 38.73 2qgt h PHE 404 CO 1.14 0.64 -0.35 0.00 -0.60 0.00 0.00 178.31 179.14 2qgt s ALA 405 N -5.48 0.12 0.53 2.45 0.00 -1.02 -4.91 121.76 113.46 2qgt s ALA 405 Ca -0.13 -0.98 0.30 0.00 0.00 0.00 0.00 51.96 51.15 2qgt s ALA 405 Cb 0.11 0.90 1.73 0.00 0.00 0.00 0.00 23.12 25.87 2qgt s ALA 405 CO 0.77 -0.64 2.20 -1.35 0.00 0.00 0.00 175.76 176.74 2qgt h PRO 406 N 2.56 0.00 -0.56 0.00 0.11 -1.88 -0.47 132.00 131.76 2qgt h PRO 406 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2qgt h PRO 406 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2qgt h PRO 406 CO 0.49 0.04 0.00 0.27 -0.21 0.00 0.00 178.00 178.59 2qgt n ASN 407 N -3.74 4.54 -3.24 -2.05 6.94 -1.26 -4.70 115.26 111.76 2qgt n ASN 407 Ca -0.03 -2.52 -0.21 0.00 -0.02 0.00 0.00 54.58 51.81 2qgt n ASN 407 Cb 0.13 -0.55 -0.07 0.00 -2.36 0.00 0.00 39.78 36.93 2qgt n ASN 407 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2qgt s LEU 408 N -1.98 0.53 -0.33 -4.53 2.96 -0.18 -4.92 118.68 110.23 2qgt s LEU 408 Ca 0.47 -2.54 -0.06 0.00 -0.22 0.00 0.00 54.13 51.78 2qgt s LEU 408 Cb 0.32 0.24 0.03 0.00 0.50 0.00 0.00 46.19 47.28 2qgt s LEU 408 CO 0.21 -0.16 0.10 -0.22 -1.32 0.00 0.00 176.35 174.95 2qgt s LEU 409 N 0.46 4.22 -0.09 -0.68 2.96 -1.25 -1.45 118.68 122.86 2qgt s LEU 409 Ca 0.30 -1.07 0.00 0.00 -0.22 0.00 0.00 54.13 53.14 2qgt s LEU 409 Cb -0.01 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 2qgt s LEU 409 CO -0.13 -0.30 -0.08 -0.76 -1.32 0.00 0.00 176.35 173.75 2qgt s LEU 410 N 1.41 3.05 0.68 -0.68 1.43 0.02 -4.88 118.68 119.71 2qgt s LEU 410 Ca -0.01 -0.11 -0.06 0.00 -1.03 0.00 0.00 54.13 52.92 2qgt s LEU 410 Cb -0.19 -1.67 0.06 0.00 0.03 0.00 0.00 46.19 44.41 2qgt s LEU 410 CO 0.03 0.30 0.98 -1.81 0.23 0.00 0.00 176.35 176.07 2qgt s ASP 411 N -0.41 4.90 0.31 2.29 1.01 -1.26 -0.27 116.67 123.24 2qgt s ASP 411 Ca 0.06 0.42 -0.00 0.00 0.71 0.00 0.00 52.55 53.73 2qgt s ASP 411 Cb -0.12 -1.11 0.48 0.00 1.01 0.00 0.00 42.92 43.17 2qgt s ASP 411 CO 0.02 -1.52 1.92 0.08 0.21 0.00 0.00 175.17 175.88 2qgt h ARG 412 N -0.51 0.89 0.00 8.23 0.11 -1.97 -1.99 114.38 119.14 2qgt h ARG 412 Ca -0.44 -0.11 -0.03 0.00 0.10 0.00 0.00 59.98 59.50 2qgt h ARG 412 Cb 1.31 -0.17 -0.00 0.00 1.11 0.00 0.00 29.97 32.21 2qgt h ARG 412 CO 0.59 0.68 -0.15 -0.91 0.10 0.00 0.00 179.97 180.29 2qgt h ASN 413 N 0.89 0.00 1.55 0.08 2.35 -1.94 -1.22 115.58 117.29 2qgt h ASN 413 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2qgt h ASN 413 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2qgt h ASN 413 CO -0.03 0.15 0.00 1.56 -1.65 0.00 0.00 177.43 177.46 2qgt h GLN 414 N 0.00 0.00 0.00 0.81 4.20 -1.74 -2.72 115.11 115.66 2qgt h GLN 414 Ca -0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 2qgt h GLN 414 Cb 0.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2qgt h GLN 414 CO 0.02 0.00 -0.19 0.78 -0.67 0.00 0.00 178.83 178.77 2qgt h GLY 415 N 3.34 0.00 2.00 3.46 0.00 -1.05 -2.94 103.07 107.87 2qgt h GLY 415 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qgt h GLY 415 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.04 2qgt h LYS 416 N 0.00 0.00 0.00 4.80 1.57 -1.48 -2.76 116.57 118.70 2qgt h LYS 416 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qgt h LYS 416 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2qgt h LYS 416 CO 0.02 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.90 2qgt s VAL 418 N -4.04 2.04 0.18 0.00 1.01 -1.05 -3.37 120.40 115.17 2qgt s VAL 418 Ca -0.04 -0.99 -0.33 0.00 0.00 0.00 0.00 61.98 60.61 2qgt s VAL 418 Cb 0.12 -1.78 -0.14 0.00 0.00 0.00 0.00 36.38 34.57 2qgt s VAL 418 CO 0.41 0.55 1.43 1.21 0.00 0.00 0.00 175.10 178.70 2qgt n GLU 419 N 3.74 1.82 -0.99 2.72 2.13 -1.26 -1.69 120.64 127.10 2qgt n GLU 419 Ca -0.19 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.28 2qgt n GLU 419 Cb 0.52 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 29.91 2qgt n GLU 419 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qgt n GLY 420 N 2.64 0.31 0.12 8.31 0.00 -1.26 -4.90 105.19 110.42 2qgt n GLY 420 Ca 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.00 2qgt n GLY 420 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2qgt n MET 421 N -1.44 0.70 0.26 1.61 0.00 -0.68 -4.18 117.12 113.39 2qgt n MET 421 Ca 0.00 0.22 0.13 0.00 0.00 0.00 0.00 57.70 58.06 2qgt n MET 421 Cb 0.19 -1.67 0.80 0.00 0.00 0.00 0.00 33.22 32.54 2qgt n MET 421 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 175.97 175.73 2qgt h VAL 422 N 0.04 0.69 -0.36 1.12 3.04 -1.73 -0.53 116.25 118.51 2qgt h VAL 422 Ca -0.43 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 65.14 2qgt h VAL 422 Cb 2.02 0.97 -0.01 0.00 -2.01 0.00 0.00 31.29 32.26 2qgt h VAL 422 CO 0.05 0.00 -0.24 -0.33 -1.01 0.00 0.00 177.57 176.04 2qgt h GLU 423 N 0.00 0.72 -0.12 4.17 3.07 -1.93 -0.65 114.58 119.85 2qgt h GLU 423 Ca 0.02 -0.29 -0.08 0.00 -0.50 0.00 0.00 59.36 58.51 2qgt h GLU 423 Cb 0.11 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 2qgt h GLU 423 CO -0.00 0.89 -0.24 0.82 -1.40 0.00 0.00 179.01 179.08 2qgt h ILE 424 N 0.63 1.38 -0.71 3.13 2.04 -1.32 -2.90 117.51 119.76 2qgt h ILE 424 Ca 0.09 -1.53 0.13 0.00 1.00 0.00 0.00 64.86 64.55 2qgt h ILE 424 Cb 0.74 2.09 -0.09 0.00 -0.74 0.00 0.00 36.82 38.81 2qgt h ILE 424 CO 0.06 0.45 0.25 -0.26 0.00 0.00 0.00 178.15 178.65 2qgt h PHE 425 N -0.06 0.43 -0.87 1.37 -1.00 -1.15 -1.16 116.94 114.51 2qgt h PHE 425 Ca 0.00 0.04 0.04 0.00 2.81 0.00 0.00 57.97 60.86 2qgt h PHE 425 Cb 0.84 -0.08 -0.05 0.00 3.61 0.00 0.00 35.95 40.26 2qgt h PHE 425 CO 0.11 0.05 0.55 -0.44 -1.61 0.00 0.00 178.31 176.97 2qgt h ASP 426 N 0.40 0.91 -0.37 2.17 3.32 -1.12 0.18 116.42 121.92 2qgt h ASP 426 Ca 0.38 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.39 2qgt h ASP 426 Cb 0.56 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 2qgt h ASP 426 CO -0.39 0.61 0.09 0.24 -1.72 0.00 0.00 179.24 178.07 2qgt h MET 427 N 1.06 0.59 -0.81 3.56 2.86 -1.08 -1.43 114.93 119.68 2qgt h MET 427 Ca 0.35 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.84 2qgt h MET 427 Cb 0.05 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 2qgt h MET 427 CO -0.13 0.63 0.44 -0.07 1.06 0.00 0.00 176.91 178.84 2qgt h LEU 428 N 0.44 1.01 -0.45 1.22 3.38 -0.88 -1.92 115.31 118.10 2qgt h LEU 428 Ca 0.11 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2qgt h LEU 428 Cb 0.31 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2qgt h LEU 428 CO 0.00 0.82 -0.13 -0.07 0.09 0.00 0.00 178.44 179.15 2qgt h LEU 429 N 1.12 0.89 -1.01 1.67 3.38 -0.55 -1.75 115.31 119.06 2qgt h LEU 429 Ca 0.28 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2qgt h LEU 429 Cb 0.03 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 2qgt h LEU 429 CO -0.05 1.05 0.37 0.00 0.09 0.00 0.00 178.44 179.91 2qgt h ALA 430 N 0.87 1.23 -0.46 1.53 0.00 -1.11 -0.52 119.26 120.79 2qgt h ALA 430 Ca 0.11 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2qgt h ALA 430 Cb 0.67 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2qgt h ALA 430 CO 0.05 0.60 -0.12 1.15 0.00 0.00 0.00 179.25 180.93 2qgt h THR 431 N 1.07 1.26 -0.30 0.00 2.02 -1.25 -1.86 112.91 113.85 2qgt h THR 431 Ca 0.26 -1.21 -0.13 0.00 0.77 0.00 0.00 66.41 66.11 2qgt h THR 431 Cb 0.10 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2qgt h THR 431 CO -0.03 0.42 -0.33 -1.28 0.37 0.00 0.00 175.52 174.66 2qgt h SER 432 N 0.76 0.69 -0.03 4.18 0.87 -0.82 -1.33 113.55 117.87 2qgt h SER 432 Ca 0.12 -0.28 -0.08 0.00 -1.23 0.00 0.00 61.79 60.32 2qgt h SER 432 Cb 0.62 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.38 2qgt h SER 432 CO 0.04 0.97 -0.21 0.28 -0.53 0.00 0.00 176.83 177.38 2qgt h SER 433 N 0.56 0.40 -0.32 6.23 0.02 -1.00 -1.44 113.55 118.00 2qgt h SER 433 Ca 0.06 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2qgt h SER 433 Cb 0.84 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 2qgt h SER 433 CO 0.07 0.62 0.08 -0.09 -1.14 0.00 0.00 176.83 176.38 2qgt h ARG 434 N 0.37 0.51 -0.41 3.45 9.65 -0.83 0.13 114.38 127.25 2qgt h ARG 434 Ca 0.06 -0.12 0.07 0.00 -1.10 0.00 0.00 59.98 58.89 2qgt h ARG 434 Cb 0.58 -0.07 -0.06 0.00 -1.39 0.00 0.00 29.97 29.03 2qgt h ARG 434 CO 0.04 0.57 0.04 0.74 2.80 0.00 0.00 179.97 184.16 2qgt h PHE 435 N 0.36 0.06 -0.44 2.20 -1.00 -0.98 0.87 116.94 118.01 2qgt h PHE 435 Ca 0.10 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.90 2qgt h PHE 435 Cb 0.28 0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 2qgt h PHE 435 CO 0.01 -0.04 0.23 -0.09 -1.61 0.00 0.00 178.31 176.82 2qgt h ARG 436 N 0.16 0.62 -0.67 1.51 2.43 -1.11 -0.50 114.38 116.81 2qgt h ARG 436 Ca 0.20 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2qgt h ARG 436 Cb 0.26 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 2qgt h ARG 436 CO -0.30 0.51 0.43 1.98 -1.51 0.00 0.00 179.97 181.08 2qgt h MET 437 N 0.57 0.90 0.00 0.20 4.05 -0.18 -1.53 114.93 118.94 2qgt h MET 437 Ca 0.15 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.51 2qgt h MET 437 Cb 0.08 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 30.68 2qgt h MET 437 CO -0.02 0.62 0.00 -1.33 0.23 0.00 0.00 176.91 176.40 2qgt n MET 438 N -4.59 0.02 -3.57 0.39 2.81 0.25 -4.91 117.12 107.52 2qgt n MET 438 Ca 0.06 0.19 -0.20 0.00 -1.81 0.00 0.00 57.70 55.93 2qgt n MET 438 Cb 0.04 -1.53 0.07 0.00 -0.71 0.00 0.00 33.22 31.08 2qgt n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2qgt n ASN 439 N -1.56 -2.65 -4.73 7.83 5.15 -0.58 -4.89 115.26 113.84 2qgt n ASN 439 Ca 0.04 -0.68 -0.42 0.00 -0.60 0.00 0.00 54.58 52.92 2qgt n ASN 439 Cb 0.23 -4.71 -0.02 0.00 -0.53 0.00 0.00 39.78 34.75 2qgt n ASN 439 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2qgt n LEU 440 N -4.35 4.08 -4.91 1.20 0.00 -0.28 -4.98 117.00 107.76 2qgt n LEU 440 Ca -0.22 1.15 -0.25 0.00 0.00 0.00 0.00 56.01 56.68 2qgt n LEU 440 Cb 0.64 -1.56 -0.03 0.00 0.00 0.00 0.00 43.42 42.47 2qgt n LEU 440 CO 0.65 0.01 -0.11 -1.10 0.00 0.00 0.00 177.39 176.83 2qgt s GLN 441 N -0.48 3.30 0.31 1.96 -1.52 -1.26 -4.98 119.66 116.99 2qgt s GLN 441 Ca 0.65 -0.72 -0.01 0.00 -1.95 0.00 0.00 55.36 53.34 2qgt s GLN 441 Cb -0.53 -2.86 0.48 0.00 -0.22 0.00 0.00 33.01 29.88 2qgt s GLN 441 CO 0.49 0.49 1.94 0.78 -0.25 0.00 0.00 175.29 178.73 2qgt h GLY 442 N 1.95 1.02 1.48 3.09 0.00 -2.00 -0.94 103.07 107.67 2qgt h GLY 442 Ca -0.49 -0.43 -0.13 0.00 0.00 0.00 0.00 47.33 46.28 2qgt h GLY 442 CO 0.65 0.42 -0.37 0.83 0.00 0.00 0.00 176.54 178.07 2qgt h GLU 443 N 0.96 0.58 -0.24 4.80 3.07 -1.99 -2.64 114.58 119.13 2qgt h GLU 443 Ca 0.25 -0.28 -0.05 0.00 -0.50 0.00 0.00 59.36 58.78 2qgt h GLU 443 Cb -0.00 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2qgt h GLU 443 CO -0.04 0.86 -0.05 0.93 -1.40 0.00 0.00 179.01 179.31 2qgt h GLU 444 N 0.48 0.45 -0.33 2.33 5.08 -1.83 -2.82 114.58 117.94 2qgt h GLU 444 Ca 0.05 -0.17 0.07 0.00 -1.00 0.00 0.00 59.36 58.31 2qgt h GLU 444 Cb 0.86 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.00 2qgt h GLU 444 CO 0.07 0.67 -0.27 0.35 -1.00 0.00 0.00 179.01 178.83 2qgt h PHE 445 N 0.19 -0.73 -0.25 4.33 3.57 -1.09 -0.47 116.94 122.50 2qgt h PHE 445 Ca 0.06 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 2qgt h PHE 445 Cb 0.50 0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 2qgt h PHE 445 CO 0.05 -0.34 -0.01 -0.39 -2.23 0.00 0.00 178.31 175.39 2qgt h VAL 446 N -0.24 1.16 0.42 1.41 -1.51 -1.51 0.16 116.25 116.15 2qgt h VAL 446 Ca 0.16 -0.62 -0.02 0.00 -1.23 0.00 0.00 66.70 64.99 2qgt h VAL 446 Cb 0.49 0.98 0.00 0.00 -2.13 0.00 0.00 31.29 30.64 2qgt h VAL 446 CO -0.46 0.21 -0.20 0.00 -1.23 0.00 0.00 177.57 175.88 2qgt h LEU 448 N -0.66 0.69 -0.80 0.00 3.38 -0.54 -1.22 115.31 116.15 2qgt h LEU 448 Ca -0.06 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2qgt h LEU 448 Cb 0.48 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 2qgt h LEU 448 CO 0.09 0.44 0.33 0.50 0.09 0.00 0.00 178.44 179.90 2qgt h LYS 449 N 0.82 1.18 -0.68 1.13 3.64 -1.01 -1.89 116.57 119.76 2qgt h LYS 449 Ca 0.33 -0.21 -0.05 0.00 -1.27 0.00 0.00 60.65 59.45 2qgt h LYS 449 Cb 0.17 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2qgt h LYS 449 CO -0.17 0.95 0.22 0.77 -2.27 0.00 0.00 179.45 178.94 2qgt h SER 450 N 1.15 0.99 -0.48 4.20 0.02 -0.90 -2.49 113.55 116.05 2qgt h SER 450 Ca 0.27 -0.21 0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2qgt h SER 450 Cb 0.19 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2qgt h SER 450 CO -0.02 0.93 0.28 0.40 -1.14 0.00 0.00 176.83 177.28 2qgt h ILE 451 N 1.00 1.05 -0.18 3.27 2.04 -0.95 -2.18 117.51 121.56 2qgt h ILE 451 Ca 0.22 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.93 2qgt h ILE 451 Cb 0.29 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 2qgt h ILE 451 CO -0.01 0.10 -0.11 0.40 0.00 0.00 0.00 178.15 178.53 2qgt h ILE 452 N 0.57 0.66 -0.42 -0.67 2.04 -1.22 0.43 117.51 118.90 2qgt h ILE 452 Ca 0.19 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.13 2qgt h ILE 452 Cb 0.02 0.66 -0.09 0.00 -0.74 0.00 0.00 36.82 36.66 2qgt h ILE 452 CO -0.09 0.00 -0.31 0.25 0.00 0.00 0.00 178.15 178.00 2qgt h LEU 453 N -0.11 -1.04 -0.26 1.44 5.85 -1.22 -1.56 115.31 118.41 2qgt h LEU 453 Ca 0.10 0.19 -0.16 0.00 0.84 0.00 0.00 57.88 58.86 2qgt h LEU 453 Cb 0.27 0.50 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 2qgt h LEU 453 CO -0.25 -0.31 -0.75 -0.07 -0.34 0.00 0.00 178.44 176.72 2qgt h LEU 454 N -0.23 0.00 0.05 2.25 3.38 -1.01 -3.39 115.31 116.36 2qgt h LEU 454 Ca 0.18 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.80 2qgt h LEU 454 Cb 0.53 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2qgt h LEU 454 CO -0.55 0.75 -1.96 -3.20 0.09 0.00 0.00 178.44 173.58 2qgt n ASN 455 N -3.43 2.00 -0.32 -0.43 5.15 0.15 -4.14 115.26 114.23 2qgt n ASN 455 Ca 0.00 0.23 0.04 0.00 -0.60 0.00 0.00 54.58 54.25 2qgt n ASN 455 Cb 0.78 -0.81 0.19 0.00 -0.53 0.00 0.00 39.78 39.42 2qgt n ASN 455 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2qgt h SER 456 N -0.41 0.79 -0.67 1.20 0.02 -1.47 -1.04 113.55 111.96 2qgt h SER 456 Ca -0.47 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2qgt h SER 456 Cb 1.74 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 64.17 2qgt h SER 456 CO -0.11 0.44 0.00 0.61 -1.14 0.00 0.00 176.83 176.63 2qgt n GLY 457 N -1.33 2.64 0.22 -3.77 0.00 -1.26 -4.71 105.19 96.98 2qgt n GLY 457 Ca 0.16 -0.79 0.06 0.00 0.00 0.00 0.00 46.02 45.45 2qgt n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2qgt h VAL 458 N 4.01 0.97 -0.00 1.61 3.04 -1.34 -2.75 116.25 121.79 2qgt h VAL 458 Ca 0.00 -0.99 0.00 0.00 -1.01 0.00 0.00 66.70 64.70 2qgt h VAL 458 Cb 1.14 1.57 0.00 0.00 -2.01 0.00 0.00 31.29 31.99 2qgt h VAL 458 CO 0.08 0.26 -0.59 -1.22 -1.01 0.00 0.00 177.57 175.09 2qgt n TYR 459 N -3.91 0.00 1.85 3.17 4.01 -1.26 -3.67 117.16 117.36 2qgt n TYR 459 Ca -0.02 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.81 2qgt n TYR 459 Cb 0.35 -0.20 0.52 0.00 -0.31 0.00 0.00 39.34 39.69 2qgt n TYR 459 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2qgt n THR 460 N -1.50 0.00 -1.77 -0.72 -1.04 -1.04 -5.26 114.28 102.96 2qgt n THR 460 Ca 0.05 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.76 2qgt n THR 460 Cb 0.33 -0.33 0.22 0.00 -1.82 0.00 0.00 70.33 68.73 2qgt n THR 460 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2qgt s PHE 461 N -2.00 1.07 -0.25 -1.42 0.08 -1.24 -5.18 117.98 109.05 2qgt s PHE 461 Ca 0.26 0.25 0.02 0.00 0.12 0.00 0.00 56.93 57.58 2qgt s PHE 461 Cb 0.12 -4.12 0.06 0.00 -0.57 0.00 0.00 43.02 38.51 2qgt s PHE 461 CO 0.20 -3.08 -0.09 0.15 -0.10 0.00 0.00 175.22 172.30 2qgt s LYS 467 N -5.88 2.02 -0.64 0.44 -0.14 -1.26 -5.18 119.74 109.10 2qgt s LYS 467 Ca 0.76 -1.22 -0.05 0.00 -1.36 0.00 0.00 55.97 54.10 2qgt s LYS 467 Cb -0.03 -2.78 0.17 0.00 -1.68 0.00 0.00 37.83 33.50 2qgt s LYS 467 CO 0.54 -0.58 0.48 -1.12 -0.76 0.00 0.00 175.35 173.91 2qgt s SER 468 N 1.21 5.46 0.02 2.83 0.01 -1.26 -4.89 113.70 117.08 2qgt s SER 468 Ca -0.08 -2.79 0.27 0.00 1.31 0.00 0.00 55.95 54.66 2qgt s SER 468 Cb -0.20 -1.91 0.80 0.00 0.21 0.00 0.00 66.02 64.93 2qgt s SER 468 CO -0.05 -0.41 1.63 -0.11 0.41 0.00 0.00 173.24 174.71 2qgt n LEU 469 N 3.62 0.33 0.21 2.44 0.00 -1.26 -3.50 117.00 118.84 2qgt n LEU 469 Ca 0.08 0.24 0.14 0.00 0.00 0.00 0.00 56.01 56.48 2qgt n LEU 469 Cb 0.39 -0.35 0.45 0.00 0.00 0.00 0.00 43.42 43.92 2qgt n LEU 469 CO 0.34 0.05 0.90 -0.33 0.00 0.00 0.00 177.39 178.34 2qgt h GLU 470 N 0.00 0.00 0.13 1.96 3.07 -1.99 -2.72 114.58 115.02 2qgt h GLU 470 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 2qgt h GLU 470 Cb 0.53 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 2qgt h GLU 470 CO 0.00 0.00 -0.06 0.93 -1.40 0.00 0.00 179.01 178.48 2qgt h GLU 471 N 0.00 -0.16 -0.86 2.33 4.39 -1.99 -1.52 114.58 116.77 2qgt h GLU 471 Ca 0.00 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.75 2qgt h GLU 471 Cb 0.67 0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 29.30 2qgt h GLU 471 CO 0.00 0.03 0.55 0.87 -1.16 0.00 0.00 179.01 179.29 2qgt h LYS 472 N -0.33 1.01 -0.31 2.33 1.57 -1.73 -2.12 116.57 117.00 2qgt h LYS 472 Ca -0.02 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.62 2qgt h LYS 472 Cb 0.27 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2qgt h LYS 472 CO 0.03 0.67 -0.14 0.22 -0.57 0.00 0.00 179.45 179.66 2qgt h ASP 473 N 1.04 0.65 -0.09 0.86 3.58 -1.45 -1.28 116.42 119.74 2qgt h ASP 473 Ca 0.35 -0.40 0.02 0.00 0.42 0.00 0.00 57.03 57.43 2qgt h ASP 473 Cb 0.06 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 2qgt h ASP 473 CO -0.13 0.91 -0.06 -0.74 -2.88 0.00 0.00 179.24 176.34 2qgt h HIS 474 N 0.40 -0.14 -0.58 0.28 2.76 -1.20 -1.01 115.15 115.66 2qgt h HIS 474 Ca 0.07 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.28 2qgt h HIS 474 Cb 0.65 0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.66 2qgt h HIS 474 CO 0.06 -0.09 0.38 0.97 -1.30 0.00 0.00 177.93 177.95 2qgt h ILE 475 N -0.06 1.07 -0.11 6.26 -0.00 -1.30 -0.72 117.51 122.64 2qgt h ILE 475 Ca 0.06 -0.23 -0.14 0.00 -0.00 0.00 0.00 64.86 64.54 2qgt h ILE 475 Cb 0.15 0.34 -0.01 0.00 -0.00 0.00 0.00 36.82 37.29 2qgt h ILE 475 CO -0.13 0.12 -0.56 0.45 -0.00 0.00 0.00 178.15 178.04 2qgt h HIS 476 N 0.67 0.43 -0.30 2.19 3.86 -0.75 -1.42 115.15 119.84 2qgt h HIS 476 Ca 0.23 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 2qgt h HIS 476 Cb 0.09 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.47 2qgt h HIS 476 CO -0.00 0.82 0.19 0.00 0.86 0.00 0.00 177.93 179.80 2qgt h ARG 477 N 0.27 0.40 -0.89 2.45 3.08 -0.31 -1.86 114.38 117.51 2qgt h ARG 477 Ca 0.00 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2qgt h ARG 477 Cb 1.06 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.98 2qgt h ARG 477 CO 0.09 0.29 0.53 0.28 -1.07 0.00 0.00 179.97 180.09 2qgt h VAL 478 N 0.40 1.25 -0.85 2.04 2.07 -0.95 -1.05 116.25 119.16 2qgt h VAL 478 Ca 0.11 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2qgt h VAL 478 Cb -0.02 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.71 2qgt h VAL 478 CO -0.02 0.27 0.53 -0.07 0.02 0.00 0.00 177.57 178.30 2qgt h LEU 479 N 1.23 1.00 -0.60 2.57 -0.00 -1.14 -2.11 115.31 116.25 2qgt h LEU 479 Ca 0.32 -0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 58.13 2qgt h LEU 479 Cb -0.04 -0.25 -0.03 0.00 -0.00 0.00 0.00 40.66 40.35 2qgt h LEU 479 CO -0.06 0.75 0.31 0.44 -0.00 0.00 0.00 178.44 179.88 2qgt h ASP 480 N 1.16 0.77 -1.00 -0.43 3.32 -0.47 -1.41 116.42 118.36 2qgt h ASP 480 Ca 0.31 -0.11 0.09 0.00 0.02 0.00 0.00 57.03 57.34 2qgt h ASP 480 Cb -0.08 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 39.19 2qgt h ASP 480 CO -0.06 0.67 0.64 0.11 -1.72 0.00 0.00 179.24 178.87 2qgt h LYS 481 N 0.82 1.05 -0.25 3.56 1.79 -0.94 -0.59 116.57 122.02 2qgt h LYS 481 Ca 0.21 -0.06 -0.15 0.00 -2.18 0.00 0.00 60.65 58.47 2qgt h LYS 481 Cb 0.08 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 30.49 2qgt h LYS 481 CO -0.03 0.69 -0.46 0.82 -1.08 0.00 0.00 179.45 179.40 2qgt h ILE 482 N 1.08 1.30 -0.31 1.86 1.08 -0.85 -0.53 117.51 121.15 2qgt h ILE 482 Ca 0.46 -1.65 0.03 0.00 -0.39 0.00 0.00 64.86 63.31 2qgt h ILE 482 Cb 0.33 1.60 -0.03 0.00 -3.07 0.00 0.00 36.82 35.65 2qgt h ILE 482 CO -0.22 0.52 0.11 0.74 -0.69 0.00 0.00 178.15 178.62 2qgt h THR 483 N 0.51 0.93 -0.46 -0.27 2.02 -0.83 0.19 112.91 114.99 2qgt h THR 483 Ca 0.03 -0.09 0.01 0.00 0.77 0.00 0.00 66.41 67.14 2qgt h THR 483 Cb 0.99 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 2qgt h THR 483 CO 0.09 0.05 0.31 0.44 0.37 0.00 0.00 175.52 176.78 2qgt h ASP 484 N 0.25 0.51 -0.20 4.18 3.32 -0.81 -1.32 116.42 122.35 2qgt h ASP 484 Ca 0.14 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 2qgt h ASP 484 Cb 0.10 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 2qgt h ASP 484 CO -0.13 0.37 -0.33 0.74 -1.72 0.00 0.00 179.24 178.16 2qgt h THR 485 N 0.60 1.33 -0.58 0.35 2.02 -0.36 -0.87 112.91 115.40 2qgt h THR 485 Ca 0.17 -1.55 0.02 0.00 0.77 0.00 0.00 66.41 65.83 2qgt h THR 485 Cb -0.03 1.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.17 2qgt h THR 485 CO -0.04 0.48 0.36 -0.07 0.37 0.00 0.00 175.52 176.62 2qgt h LEU 486 N 0.26 0.60 -0.61 2.58 3.38 -0.60 -1.89 115.31 119.02 2qgt h LEU 486 Ca 0.02 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2qgt h LEU 486 Cb 0.92 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 2qgt h LEU 486 CO 0.08 0.42 0.28 0.40 0.09 0.00 0.00 178.44 179.71 2qgt h ILE 487 N 0.72 1.22 -0.40 1.22 1.08 -1.21 -1.89 117.51 118.25 2qgt h ILE 487 Ca 0.23 -0.63 0.07 0.00 -0.39 0.00 0.00 64.86 64.14 2qgt h ILE 487 Cb -0.00 0.50 -0.06 0.00 -3.07 0.00 0.00 36.82 34.19 2qgt h ILE 487 CO -0.09 0.25 0.04 -0.74 -0.69 0.00 0.00 178.15 176.92 2qgt h HIS 488 N 0.84 0.05 -0.78 1.37 2.76 -0.93 0.84 115.15 119.30 2qgt h HIS 488 Ca 0.21 0.03 0.05 0.00 -2.20 0.00 0.00 60.37 58.46 2qgt h HIS 488 Cb 0.13 0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.08 2qgt h HIS 488 CO 0.00 -0.03 0.48 -0.07 -1.30 0.00 0.00 177.93 177.00 2qgt h LEU 489 N 0.15 0.75 -0.25 0.26 3.38 -1.09 -0.21 115.31 118.31 2qgt h LEU 489 Ca 0.19 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 58.04 2qgt h LEU 489 Cb 0.26 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2qgt h LEU 489 CO -0.29 0.49 -0.37 0.24 0.09 0.00 0.00 178.44 178.60 2qgt h MET 490 N 0.89 0.70 -0.74 1.13 2.86 -0.69 -1.89 114.93 117.20 2qgt h MET 490 Ca 0.33 -0.41 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2qgt h MET 490 Cb 0.12 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.79 2qgt h MET 490 CO -0.16 1.03 0.45 0.00 1.06 0.00 0.00 176.91 179.30 2qgt h ALA 491 N 0.66 0.94 -0.50 6.32 0.00 -0.66 -2.30 119.26 123.72 2qgt h ALA 491 Ca 0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2qgt h ALA 491 Cb 0.96 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2qgt h ALA 491 CO 0.09 0.40 0.23 -0.22 0.00 0.00 0.00 179.25 179.74 2qgt h LYS 492 N 1.01 0.70 0.00 0.00 3.64 -0.95 -1.44 116.57 119.53 2qgt h LYS 492 Ca 0.27 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2qgt h LYS 492 Cb -0.05 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 2qgt h LYS 492 CO -0.05 0.56 0.00 0.00 -2.27 0.00 0.00 179.45 177.69 2qgt n ALA 493 N -2.46 2.45 -0.36 5.00 0.00 -0.72 -4.91 120.51 119.52 2qgt n ALA 493 Ca 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2qgt n ALA 493 Cb 0.13 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.12 2qgt n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qgt n GLY 494 N 1.03 0.81 3.77 0.00 0.00 -0.54 -5.06 105.19 105.21 2qgt n GLY 494 Ca 0.16 -0.07 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 2qgt n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qgt s LEU 495 N 0.00 4.27 0.97 0.99 1.02 -0.94 -5.02 118.68 119.98 2qgt s LEU 495 Ca 0.00 2.53 -0.12 0.00 0.02 0.00 0.00 54.13 56.56 2qgt s LEU 495 Cb 0.00 -3.88 0.17 0.00 0.02 0.00 0.00 46.19 42.51 2qgt s LEU 495 CO 0.00 -0.69 1.09 0.42 0.02 0.00 0.00 176.35 177.19 2qgt s THR 496 N -1.28 2.34 0.12 5.49 -4.23 -1.26 -4.63 115.64 112.19 2qgt s THR 496 Ca 0.55 0.11 -0.23 0.00 -1.18 0.00 0.00 61.69 60.94 2qgt s THR 496 Cb -0.35 -2.50 -0.05 0.00 1.34 0.00 0.00 72.50 70.94 2qgt s THR 496 CO 0.46 -0.15 1.68 -0.07 -0.54 0.00 0.00 174.62 176.00 2qgt h LEU 497 N -1.85 -0.42 -1.07 4.79 3.38 -1.99 -0.13 115.31 118.01 2qgt h LEU 497 Ca -0.53 0.07 0.15 0.00 0.09 0.00 0.00 57.88 57.66 2qgt h LEU 497 Cb 1.30 0.19 -0.09 0.00 0.09 0.00 0.00 40.66 42.16 2qgt h LEU 497 CO 0.54 -0.19 0.62 -0.61 0.09 0.00 0.00 178.44 178.89 2qgt h GLN 498 N -0.19 0.84 -0.12 1.13 4.15 -2.00 -1.24 115.11 117.68 2qgt h GLN 498 Ca 0.07 -0.05 -0.18 0.00 0.77 0.00 0.00 58.65 59.26 2qgt h GLN 498 Cb 0.30 -0.19 -0.00 0.00 0.21 0.00 0.00 27.48 27.79 2qgt h GLN 498 CO -0.19 0.56 -0.68 1.96 -1.93 0.00 0.00 178.83 178.55 2qgt h GLN 499 N 0.87 0.51 -0.29 1.69 4.20 -1.68 -1.66 115.11 118.75 2qgt h GLN 499 Ca 0.51 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2qgt h GLN 499 Cb 0.66 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 2qgt h GLN 499 CO -0.28 1.01 0.18 1.96 -0.67 0.00 0.00 178.83 181.03 2qgt h GLN 500 N 0.36 0.39 -0.28 1.46 4.20 -0.23 -0.64 115.11 120.38 2qgt h GLN 500 Ca -0.02 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.59 2qgt h GLN 500 Cb 1.25 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.94 2qgt h GLN 500 CO 0.12 0.29 -0.10 0.45 -0.67 0.00 0.00 178.83 178.92 2qgt h HIS 501 N 0.38 0.63 -0.75 2.96 3.86 -1.18 0.79 115.15 121.85 2qgt h HIS 501 Ca 0.11 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2qgt h HIS 501 Cb -0.01 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.27 2qgt h HIS 501 CO -0.05 0.78 0.49 1.96 0.86 0.00 0.00 177.93 181.97 2qgt h GLN 502 N 0.30 0.99 -0.15 2.45 4.20 -1.28 -2.22 115.11 119.40 2qgt h GLN 502 Ca 0.07 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2qgt h GLN 502 Cb 0.59 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2qgt h GLN 502 CO 0.03 0.67 -0.27 -0.09 -0.67 0.00 0.00 178.83 178.50 2qgt h ARG 503 N 1.02 0.45 -0.54 1.46 2.43 -0.88 -1.63 114.38 116.69 2qgt h ARG 503 Ca 0.27 -0.28 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 2qgt h ARG 503 Cb -0.10 0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 29.38 2qgt h ARG 503 CO -0.06 0.88 -0.10 1.25 -1.51 0.00 0.00 179.97 180.43 2qgt h LEU 504 N 0.07 -0.44 -0.75 3.80 5.85 -0.81 0.14 115.31 123.16 2qgt h LEU 504 Ca 0.01 0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 2qgt h LEU 504 Cb 0.85 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 2qgt h LEU 504 CO 0.06 -0.16 0.33 0.00 -0.34 0.00 0.00 178.44 178.33 2qgt h ALA 505 N 1.53 0.97 -0.84 1.25 0.00 -1.28 -1.71 119.26 119.17 2qgt h ALA 505 Ca 0.27 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2qgt h ALA 505 Cb 0.41 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2qgt h ALA 505 CO -0.54 0.57 0.44 1.96 0.00 0.00 0.00 179.25 181.69 2qgt h GLN 506 N 1.07 1.19 -0.14 0.00 4.20 -0.34 -1.00 115.11 120.09 2qgt h GLN 506 Ca 0.25 -0.15 -0.07 0.00 0.06 0.00 0.00 58.65 58.74 2qgt h GLN 506 Cb 0.17 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 2qgt h GLN 506 CO -0.03 0.89 -0.17 -0.07 -0.67 0.00 0.00 178.83 178.79 2qgt h LEU 507 N 1.18 0.39 -1.29 1.46 3.38 -0.75 -3.12 115.31 116.58 2qgt h LEU 507 Ca 0.29 -0.50 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 2qgt h LEU 507 Cb 0.06 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2qgt h LEU 507 CO -0.04 0.81 -0.07 -0.07 0.09 0.00 0.00 178.44 179.16 2qgt h LEU 508 N -0.01 0.38 -1.95 1.67 3.38 -1.19 -2.46 115.31 115.12 2qgt h LEU 508 Ca 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2qgt h LEU 508 Cb 0.71 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 2qgt h LEU 508 CO 0.04 0.49 -0.04 -0.07 0.09 0.00 0.00 178.44 178.95 2qgt h LEU 509 N 0.38 0.00 -1.22 1.67 3.38 -1.14 -2.05 115.31 116.33 2qgt h LEU 509 Ca 0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2qgt h LEU 509 Cb 0.36 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2qgt h LEU 509 CO 0.02 0.04 0.26 0.40 0.09 0.00 0.00 178.44 179.25 2qgt h ILE 510 N 0.00 1.19 0.00 1.22 1.08 -1.38 -2.61 117.51 117.02 2qgt h ILE 510 Ca -0.00 -0.56 -0.00 0.00 -0.39 0.00 0.00 64.86 63.91 2qgt h ILE 510 Cb 0.35 0.48 -0.00 0.00 -3.07 0.00 0.00 36.82 34.58 2qgt h ILE 510 CO 0.01 0.23 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.61 2qgt h LEU 511 N 0.80 0.00 -0.26 1.44 3.38 -1.47 0.95 115.31 120.15 2qgt h LEU 511 Ca 0.20 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.97 2qgt h LEU 511 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2qgt h LEU 511 CO -0.02 0.01 -0.66 -1.28 0.09 0.00 0.00 178.44 176.58 2qgt h SER 512 N 0.00 0.92 -0.03 -0.43 0.87 -1.58 -1.93 113.55 111.38 2qgt h SER 512 Ca -0.00 -0.55 -0.17 0.00 -1.23 0.00 0.00 61.79 59.85 2qgt h SER 512 Cb 0.29 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.98 2qgt h SER 512 CO 0.00 1.34 -0.56 0.45 -0.53 0.00 0.00 176.83 177.54 2qgt h HIS 513 N 0.59 0.78 -0.57 2.24 3.86 -1.23 -1.84 115.15 118.98 2qgt h HIS 513 Ca -0.02 -0.28 -0.04 0.00 -1.16 0.00 0.00 60.37 58.87 2qgt h HIS 513 Cb 1.27 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 29.57 2qgt h HIS 513 CO 0.08 1.03 0.20 0.82 0.86 0.00 0.00 177.93 180.92 2qgt h ILE 514 N 0.47 1.23 -0.58 2.45 2.04 -0.87 -2.11 117.51 120.15 2qgt h ILE 514 Ca 0.01 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 2qgt h ILE 514 Cb 1.12 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 2qgt h ILE 514 CO 0.11 0.29 0.28 -0.09 0.00 0.00 0.00 178.15 178.73 2qgt h ARG 515 N 0.79 0.83 -0.64 2.37 9.65 -1.23 -1.29 114.38 124.85 2qgt h ARG 515 Ca 0.19 -0.12 0.04 0.00 -1.10 0.00 0.00 59.98 58.99 2qgt h ARG 515 Cb 0.25 -0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 28.63 2qgt h ARG 515 CO -0.01 0.68 0.37 1.25 2.80 0.00 0.00 179.97 185.06 2qgt h HIS 516 N 0.78 0.69 -0.22 2.20 2.76 -1.16 -1.91 115.15 118.28 2qgt h HIS 516 Ca 0.20 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.26 2qgt h HIS 516 Cb 0.12 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 2qgt h HIS 516 CO -0.00 0.36 -0.40 0.52 -1.30 0.00 0.00 177.93 177.11 2qgt h MET 517 N 0.70 0.51 -0.16 5.26 2.86 -1.05 -1.97 114.93 121.08 2qgt h MET 517 Ca 0.27 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2qgt h MET 517 Cb 0.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 2qgt h MET 517 CO -0.15 0.83 0.07 1.03 1.06 0.00 0.00 176.91 179.75 2qgt h SER 518 N 0.42 0.22 -0.70 1.22 0.87 -0.94 0.28 113.55 114.93 2qgt h SER 518 Ca 0.04 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2qgt h SER 518 Cb 0.88 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.75 2qgt h SER 518 CO 0.08 0.30 0.45 0.78 -0.53 0.00 0.00 176.83 177.90 2qgt h ASN 519 N 0.13 0.83 -0.19 6.23 2.35 -1.17 0.35 115.58 124.09 2qgt h ASN 519 Ca 0.06 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 2qgt h ASN 519 Cb 0.14 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 2qgt h ASN 519 CO -0.01 0.62 0.05 0.11 -1.65 0.00 0.00 177.43 176.55 2qgt h LYS 520 N 0.96 0.30 -0.99 0.81 6.56 -1.32 -2.41 116.57 120.48 2qgt h LYS 520 Ca 0.26 -0.07 0.09 0.00 -1.06 0.00 0.00 60.65 59.86 2qgt h LYS 520 Cb -0.07 -0.04 -0.07 0.00 -0.57 0.00 0.00 32.23 31.47 2qgt h LYS 520 CO -0.05 0.43 0.63 0.78 -2.06 0.00 0.00 179.45 179.18 2qgt h GLY 521 N 0.12 1.53 1.21 3.86 0.00 0.02 -0.99 103.07 108.82 2qgt h GLY 521 Ca 0.06 -0.44 -0.14 0.00 0.00 0.00 0.00 47.33 46.81 2qgt h GLY 521 CO 0.00 0.25 -0.31 1.98 0.00 0.00 0.00 176.54 178.47 2qgt h MET 522 N 1.07 0.88 -0.92 4.80 -1.53 -0.25 0.05 114.93 119.03 2qgt h MET 522 Ca 0.45 -0.41 0.00 0.00 -3.44 0.00 0.00 59.70 56.30 2qgt h MET 522 Cb 0.32 -0.01 -0.05 0.00 -0.55 0.00 0.00 31.60 31.32 2qgt h MET 522 CO -0.21 1.06 0.59 0.93 0.14 0.00 0.00 176.91 179.43 2qgt h GLU 523 N 0.74 1.23 0.34 0.39 5.08 -0.90 -1.73 114.58 119.72 2qgt h GLU 523 Ca 0.08 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2qgt h GLU 523 Cb 0.87 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2qgt h GLU 523 CO 0.08 0.83 -0.16 1.25 -1.00 0.00 0.00 179.01 180.00 2qgt h HIS 524 N 1.25 -0.42 -1.01 4.33 2.76 -0.99 -1.43 115.15 119.65 2qgt h HIS 524 Ca 0.33 -0.01 0.31 0.00 -2.20 0.00 0.00 60.37 58.81 2qgt h HIS 524 Cb -0.11 0.14 -0.14 0.00 1.55 0.00 0.00 27.41 28.84 2qgt h HIS 524 CO -0.00 -0.10 0.58 1.25 -1.30 0.00 0.00 177.93 178.36 2qgt h LEU 525 N -0.98 0.54 -0.26 0.26 5.85 -1.02 0.59 115.31 120.28 2qgt h LEU 525 Ca -0.05 0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 2qgt h LEU 525 Cb 0.50 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2qgt h LEU 525 CO 0.08 -0.09 -0.21 0.22 -0.34 0.00 0.00 178.44 178.09 2qgt h TYR 526 N 0.36 0.72 -0.78 1.25 3.20 -1.21 -0.36 116.97 120.15 2qgt h TYR 526 Ca 0.72 -0.20 0.02 0.00 3.14 0.00 0.00 58.73 62.40 2qgt h TYR 526 Cb 1.62 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 39.69 2qgt h TYR 526 CO -0.01 0.90 0.51 1.03 -1.64 0.00 0.00 178.16 178.96 2qgt h SER 527 N 0.33 0.88 -0.73 -2.11 0.87 -0.04 -1.33 113.55 111.41 2qgt h SER 527 Ca 0.05 -0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.55 2qgt h SER 527 Cb 0.76 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.47 2qgt h SER 527 CO 0.05 0.63 0.29 0.24 -0.53 0.00 0.00 176.83 177.51 2qgt h MET 528 N 1.03 1.09 0.83 2.24 2.86 -0.75 -2.44 114.93 119.79 2qgt h MET 528 Ca 0.30 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 2qgt h MET 528 Cb -0.08 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.41 2qgt h MET 528 CO -0.08 0.90 -0.44 -0.22 1.06 0.00 0.00 176.91 178.13 2qgt h LYS 529 N 1.05 -1.12 -0.11 1.72 3.64 -0.52 -2.08 116.57 119.16 2qgt h LYS 529 Ca 0.24 0.08 0.02 0.00 -1.27 0.00 0.00 60.65 59.72 2qgt h LYS 529 Cb 0.22 0.25 -0.04 0.00 -0.41 0.00 0.00 32.23 32.25 2qgt h LYS 529 CO -0.02 -0.75 -0.34 0.00 -2.27 0.00 0.00 179.45 176.08 2qgt n LYS 531 N -4.33 0.39 -3.44 0.00 0.00 -0.92 -4.83 118.16 105.02 2qgt n LYS 531 Ca -0.04 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.02 2qgt n LYS 531 Cb 0.23 -1.02 0.02 0.00 -0.00 0.00 0.00 35.03 34.26 2qgt n LYS 531 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2qgt n ASN 532 N -0.41 -4.76 0.17 -5.58 5.03 -0.04 -4.87 115.26 104.81 2qgt n ASN 532 Ca 0.00 -0.48 0.03 0.00 0.87 0.00 0.00 54.58 55.00 2qgt n ASN 532 Cb 0.01 -3.86 0.29 0.00 -1.02 0.00 0.00 39.78 35.20 2qgt n ASN 532 CO 0.00 0.00 0.00 -0.37 -1.83 0.00 0.00 177.26 175.06 2qgt h VAL 533 N -1.46 1.12 -3.37 2.41 -1.51 -1.61 -3.44 116.25 108.38 2qgt h VAL 533 Ca -0.50 -1.68 -0.21 0.00 -1.23 0.00 0.00 66.70 63.08 2qgt h VAL 533 Cb 1.34 1.96 -0.28 0.00 -2.13 0.00 0.00 31.29 32.18 2qgt h VAL 533 CO 0.59 0.45 -0.57 -0.69 -1.23 0.00 0.00 177.57 176.11 2qgt s VAL 534 N -3.70 -0.01 -0.09 7.19 1.01 -1.25 -4.59 120.40 118.96 2qgt s VAL 534 Ca -0.01 0.04 -0.27 0.00 0.00 0.00 0.00 61.98 61.75 2qgt s VAL 534 Cb 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.27 2qgt s VAL 534 CO 0.72 0.02 0.86 -2.16 0.00 0.00 0.00 175.10 174.53 2qgt s PRO 535 N 0.32 4.42 0.06 2.72 0.04 -1.26 -4.65 135.00 136.65 2qgt s PRO 535 Ca -0.02 1.14 0.02 0.00 0.04 0.00 0.00 61.00 62.17 2qgt s PRO 535 Cb -0.03 -3.50 -0.04 0.00 0.04 0.00 0.00 34.50 30.96 2qgt s PRO 535 CO -0.01 -0.14 0.12 -0.51 0.04 0.00 0.00 177.00 176.50 2qgt s LEU 536 N 1.44 4.01 0.99 -3.56 1.43 -1.26 -5.03 118.68 116.70 2qgt s LEU 536 Ca 0.43 0.11 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 2qgt s LEU 536 Cb -0.18 -2.62 0.13 0.00 0.03 0.00 0.00 46.19 43.55 2qgt s LEU 536 CO 0.19 0.18 0.78 -1.54 0.23 0.00 0.00 176.35 176.19 2qgt n SER 537 N 0.49 -1.04 -0.24 2.29 3.41 -1.26 -4.74 113.62 112.52 2qgt n SER 537 Ca -0.08 0.24 -0.07 0.00 -0.26 0.00 0.00 58.87 58.69 2qgt n SER 537 Cb 0.52 -1.30 0.04 0.00 -0.26 0.00 0.00 64.21 63.20 2qgt n SER 537 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2qgt h ASP 538 N -1.96 1.02 -0.16 4.04 3.32 -1.99 -1.44 116.42 119.26 2qgt h ASP 538 Ca -0.47 -0.23 0.04 0.00 0.02 0.00 0.00 57.03 56.39 2qgt h ASP 538 Cb 1.29 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 40.53 2qgt h ASP 538 CO 0.40 0.98 -0.15 0.25 -1.72 0.00 0.00 179.24 179.00 2qgt h LEU 539 N 1.01 -0.46 -0.26 1.55 5.85 -1.99 -0.78 115.31 120.23 2qgt h LEU 539 Ca 0.21 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.03 2qgt h LEU 539 Cb 0.35 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2qgt h LEU 539 CO -0.00 -0.19 0.17 -0.07 -0.34 0.00 0.00 178.44 178.01 2qgt h LEU 540 N -0.17 0.31 -1.07 2.25 4.07 -1.87 0.29 115.31 119.12 2qgt h LEU 540 Ca 0.10 -0.03 0.10 0.00 0.08 0.00 0.00 57.88 58.13 2qgt h LEU 540 Cb 0.32 -0.08 -0.07 0.00 1.08 0.00 0.00 40.66 41.91 2qgt h LEU 540 CO -0.26 0.24 0.62 -0.07 -1.08 0.00 0.00 178.44 177.90 2qgt h LEU 541 N 0.35 0.93 -0.14 1.67 3.38 -1.13 0.25 115.31 120.60 2qgt h LEU 541 Ca 0.10 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 2qgt h LEU 541 Cb -0.02 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2qgt h LEU 541 CO -0.02 0.54 -0.21 -0.33 0.09 0.00 0.00 178.44 178.51 2qgt h GLU 542 N 1.02 0.39 -0.42 1.13 5.08 -0.61 0.10 114.58 121.27 2qgt h GLU 542 Ca 0.45 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 2qgt h GLU 542 Cb 0.37 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2qgt h GLU 542 CO -0.21 0.82 0.23 0.52 -1.00 0.00 0.00 179.01 179.36 2qgt h MET 543 N -0.00 0.57 -0.07 2.33 2.86 -0.04 -2.64 114.93 117.95 2qgt h MET 543 Ca 0.01 -0.05 -0.19 0.00 -2.06 0.00 0.00 59.70 57.41 2qgt h MET 543 Cb 0.78 -0.12 0.01 0.00 0.06 0.00 0.00 31.60 32.33 2qgt h MET 543 CO 0.05 0.43 -0.72 1.25 1.06 0.00 0.00 176.91 178.98 2qgt h LEU 544 N 0.58 0.75 -2.39 1.22 5.85 -0.48 -3.26 115.31 117.58 2qgt h LEU 544 Ca 0.15 -0.69 0.01 0.00 0.84 0.00 0.00 57.88 58.19 2qgt h LEU 544 Cb 0.02 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.83 2qgt h LEU 544 CO -0.02 1.33 0.04 0.44 -0.34 0.00 0.00 178.44 179.88 2qgt h ASP 545 N 0.23 0.00 0.30 1.25 3.45 -0.49 -2.28 116.42 118.87 2qgt h ASP 545 Ca -0.07 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.36 2qgt h ASP 545 Cb 1.38 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.14 2qgt h ASP 545 CO 0.14 0.00 -0.12 0.00 -1.57 0.00 0.00 179.24 177.70 2qgt h ALA 546 N 1.96 1.37 -0.03 3.45 0.00 -1.52 -2.45 119.26 122.03 2qgt h ALA 546 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2qgt h ALA 546 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2qgt h ALA 546 CO -0.00 0.14 0.00 0.72 0.00 0.00 0.00 179.25 180.11 2qgt n HIS 547 N -3.76 0.02 0.00 0.00 8.25 -0.86 -5.04 115.22 113.83 2qgt n HIS 547 Ca -0.02 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 2qgt n HIS 547 Cb 0.22 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.33 2qgt n HIS 547 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52