#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qab h LEU 306 N 0.00 0.00 -0.89 -3.43 -0.00 -2.01 -3.27 115.31 105.70 2qab h LEU 306 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.83 2qab h LEU 306 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.65 2qab h LEU 306 CO 0.00 0.23 -0.23 0.00 -0.00 0.00 0.00 178.44 178.45 2qab h ALA 307 N 1.77 0.97 0.00 1.53 0.00 -1.98 -3.03 119.26 118.51 2qab h ALA 307 Ca -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2qab h ALA 307 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2qab h ALA 307 CO 0.02 0.28 0.00 -0.07 0.00 0.00 0.00 179.25 179.49 2qab h LEU 308 N 0.00 0.00 -1.05 0.00 4.07 -1.96 -3.20 115.31 113.17 2qab h LEU 308 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2qab h LEU 308 Cb 0.84 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.58 2qab h LEU 308 CO 0.03 0.00 -0.30 -1.54 -1.08 0.00 0.00 178.44 175.55 2qab n SER 309 N -2.52 1.85 -4.64 -0.43 3.41 -1.15 -4.98 113.62 105.15 2qab n SER 309 Ca 0.02 -1.42 -0.39 0.00 -0.26 0.00 0.00 58.87 56.82 2qab n SER 309 Cb 0.30 0.39 0.04 0.00 -0.26 0.00 0.00 64.21 64.68 2qab n SER 309 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qab n LEU 310 N 0.10 3.84 -4.93 1.04 4.32 -1.21 -5.02 117.00 115.15 2qab n LEU 310 Ca 0.08 0.90 -0.26 0.00 -0.02 0.00 0.00 56.01 56.70 2qab n LEU 310 Cb 0.38 -1.42 0.05 0.00 -1.62 0.00 0.00 43.42 40.81 2qab n LEU 310 CO 0.20 -1.49 0.58 0.42 -1.22 0.00 0.00 177.39 175.88 2qab s THR 311 N -1.41 2.78 0.12 -5.08 -4.23 -1.26 -4.89 115.64 101.68 2qab s THR 311 Ca 0.72 -0.17 -0.21 0.00 -1.18 0.00 0.00 61.69 60.84 2qab s THR 311 Cb -0.45 -3.17 -0.04 0.00 1.34 0.00 0.00 72.50 70.19 2qab s THR 311 CO 0.50 -0.17 1.70 0.00 -0.54 0.00 0.00 174.62 176.10 2qab h ALA 312 N -0.43 0.04 -0.84 3.99 0.00 -1.94 0.15 119.26 120.23 2qab h ALA 312 Ca -0.45 0.06 0.14 0.00 0.00 0.00 0.00 54.91 54.66 2qab h ALA 312 Cb 1.29 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 19.21 2qab h ALA 312 CO 0.60 -0.53 0.55 -0.44 0.00 0.00 0.00 179.25 179.43 2qab h ASP 313 N -0.08 0.58 1.58 0.00 3.32 -1.95 -2.19 116.42 117.67 2qab h ASP 313 Ca 0.08 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 2qab h ASP 313 Cb 0.20 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2qab h ASP 313 CO -0.19 0.30 -0.43 1.56 -1.72 0.00 0.00 179.24 178.76 2qab h GLN 314 N 0.61 0.00 0.00 3.56 4.20 -1.76 -2.17 115.11 119.55 2qab h GLN 314 Ca 0.42 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.13 2qab h GLN 314 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 2qab h GLN 314 CO -0.17 0.24 -0.00 1.98 -0.67 0.00 0.00 178.83 180.20 2qab h MET 315 N 0.00 -0.00 0.00 1.46 4.05 -0.38 -2.64 114.93 117.42 2qab h MET 315 Ca -0.02 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 59.43 2qab h MET 315 Cb 1.21 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.98 2qab h MET 315 CO 0.03 0.45 -0.15 0.28 0.23 0.00 0.00 176.91 177.75 2qab h VAL 316 N -0.46 0.63 -0.56 -5.77 2.07 -1.45 -0.91 116.25 109.80 2qab h VAL 316 Ca -0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 2qab h VAL 316 Cb 0.46 0.63 -0.09 0.00 -1.52 0.00 0.00 31.29 30.76 2qab h VAL 316 CO 0.00 0.00 0.03 0.28 0.02 0.00 0.00 177.57 177.90 2qab h SER 317 N -0.25 -0.18 -0.39 0.57 0.02 -1.48 0.27 113.55 112.10 2qab h SER 317 Ca 0.05 0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 2qab h SER 317 Cb 0.32 0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 2qab h SER 317 CO -0.15 -0.07 0.14 0.00 -1.14 0.00 0.00 176.83 175.61 2qab h ALA 318 N 1.49 0.51 -0.39 3.77 0.00 -1.12 -0.17 119.26 123.35 2qab h ALA 318 Ca 0.29 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2qab h ALA 318 Cb 0.45 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2qab h ALA 318 CO -0.45 0.14 -0.04 -0.07 0.00 0.00 0.00 179.25 178.83 2qab h LEU 319 N 0.48 0.71 -1.01 0.00 3.38 -0.61 -1.00 115.31 117.27 2qab h LEU 319 Ca 0.13 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.77 2qab h LEU 319 Cb 0.23 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 2qab h LEU 319 CO -0.01 0.88 0.63 -0.07 0.09 0.00 0.00 178.44 179.96 2qab h LEU 320 N 0.53 1.13 -0.68 1.67 3.38 -0.37 -2.57 115.31 118.41 2qab h LEU 320 Ca 0.11 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2qab h LEU 320 Cb 0.54 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2qab h LEU 320 CO 0.03 0.83 -0.31 0.44 0.09 0.00 0.00 178.44 179.52 2qab h ASP 321 N 1.33 0.70 0.73 -0.43 3.45 -0.75 -3.09 116.42 118.36 2qab h ASP 321 Ca 0.35 -0.28 0.00 0.00 0.43 0.00 0.00 57.03 57.53 2qab h ASP 321 Cb -0.13 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 38.45 2qab h ASP 321 CO -0.07 0.97 0.00 0.00 -1.57 0.00 0.00 179.24 178.56 2qab n ALA 322 N -2.50 2.03 -1.63 3.45 0.00 -0.40 -4.89 120.51 116.56 2qab n ALA 322 Ca -0.01 -0.08 -0.48 0.00 0.00 0.00 0.00 53.44 52.88 2qab n ALA 322 Cb 0.47 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 2qab n ALA 322 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qab n GLU 323 N -1.48 1.66 -1.45 0.00 -0.58 -1.09 -4.55 120.64 113.15 2qab n GLU 323 Ca 0.06 0.59 -0.31 0.00 -0.42 0.00 0.00 57.16 57.09 2qab n GLU 323 Cb 0.25 -2.24 0.08 0.00 -0.57 0.00 0.00 31.44 28.96 2qab n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2qab s PRO 324 N 0.15 2.36 0.72 3.49 0.04 -1.26 -5.03 135.00 135.46 2qab s PRO 324 Ca 0.76 0.90 -0.11 0.00 0.04 0.00 0.00 61.00 62.59 2qab s PRO 324 Cb -0.77 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 31.86 2qab s PRO 324 CO 0.46 -1.49 1.07 -1.25 0.04 0.00 0.00 177.00 175.83 2qab s PRO 325 N -5.03 2.71 -0.44 0.56 0.04 -1.26 -5.00 135.00 126.58 2qab s PRO 325 Ca 0.60 1.00 -0.25 0.00 0.04 0.00 0.00 61.00 62.39 2qab s PRO 325 Cb -0.15 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.45 2qab s PRO 325 CO 0.55 -1.28 0.92 0.42 0.04 0.00 0.00 177.00 177.66 2qab s ILE 326 N -3.01 4.50 0.40 0.56 1.01 -1.26 -5.04 121.20 118.36 2qab s ILE 326 Ca 0.59 0.83 -0.19 0.00 0.00 0.00 0.00 60.65 61.88 2qab s ILE 326 Cb -0.15 -4.41 -0.10 0.00 0.01 0.00 0.00 42.46 37.81 2qab s ILE 326 CO 0.55 -0.77 0.89 -0.76 0.00 0.00 0.00 174.94 174.86 2qab s LEU 327 N 3.68 3.98 0.31 2.97 1.43 -1.26 -4.98 118.68 124.81 2qab s LEU 327 Ca 0.37 1.58 -0.04 0.00 -1.03 0.00 0.00 54.13 55.01 2qab s LEU 327 Cb -0.11 -4.40 -0.05 0.00 0.03 0.00 0.00 46.19 41.67 2qab s LEU 327 CO 0.25 -0.31 0.56 -0.31 0.23 0.00 0.00 176.35 176.76 2qab s TYR 328 N -2.11 3.49 0.52 0.29 2.02 -1.26 -4.43 117.35 115.87 2qab s TYR 328 Ca 0.60 0.58 0.01 0.00 -0.37 0.00 0.00 57.07 57.89 2qab s TYR 328 Cb -0.10 -2.06 0.02 0.00 -0.40 0.00 0.00 41.96 39.42 2qab s TYR 328 CO 0.14 0.15 0.75 -1.54 -1.57 0.00 0.00 175.55 173.48 2qab s SER 329 N -3.38 5.43 0.11 2.29 1.04 -1.26 -4.98 113.70 112.94 2qab s SER 329 Ca 0.43 0.07 0.08 0.00 0.48 0.00 0.00 55.95 57.01 2qab s SER 329 Cb -0.10 -1.05 -0.20 0.00 0.10 0.00 0.00 66.02 64.77 2qab s SER 329 CO 0.32 -1.02 1.20 1.05 0.98 0.00 0.00 173.24 175.76 2qab h GLU 330 N 0.16 0.00 0.00 4.02 9.09 -1.97 -3.48 114.58 122.40 2qab h GLU 330 Ca -0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.98 2qab h GLU 330 Cb 1.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.38 2qab h GLU 330 CO 0.54 0.89 0.00 0.98 0.05 0.00 0.00 179.01 181.47 2qab n TYR 331 N -3.30 0.00 -2.94 2.06 9.36 -1.26 -4.87 117.16 116.22 2qab n TYR 331 Ca -0.02 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.77 2qab n TYR 331 Cb 0.94 0.00 -0.05 0.00 -0.63 0.00 0.00 39.34 39.60 2qab n TYR 331 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2qab s ASP 332 N 0.00 6.32 0.00 2.98 3.68 -1.26 -4.93 116.67 123.46 2qab s ASP 332 Ca 0.00 -0.46 0.00 0.00 2.13 0.00 0.00 52.55 54.22 2qab s ASP 332 Cb 0.00 -2.39 0.00 0.00 -1.45 0.00 0.00 42.92 39.08 2qab s ASP 332 CO 0.00 -1.10 0.71 -0.81 0.13 0.00 0.00 175.17 174.10 2qab n PRO 333 N 7.03 0.87 0.03 4.34 -0.04 -1.26 -2.63 135.00 143.33 2qab n PRO 333 Ca -0.00 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.57 2qab n PRO 333 Cb 0.47 -1.16 0.14 0.00 -0.04 0.00 0.00 33.50 32.91 2qab n PRO 333 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2qab n THR 334 N -0.29 0.18 -5.08 0.52 -2.24 -1.26 -4.88 114.28 101.23 2qab n THR 334 Ca 0.00 -0.18 -0.29 0.00 -2.27 0.00 0.00 64.05 61.31 2qab n THR 334 Cb 0.08 0.12 -0.15 0.00 -2.10 0.00 0.00 70.33 68.27 2qab n THR 334 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qab s ARG 335 N -3.12 1.85 0.97 -0.78 0.52 -1.08 -5.15 118.95 112.16 2qab s ARG 335 Ca 0.07 -0.89 -0.13 0.00 -0.52 0.00 0.00 55.73 54.26 2qab s ARG 335 Cb 0.15 -1.84 0.17 0.00 0.52 0.00 0.00 34.95 33.96 2qab s ARG 335 CO 0.74 0.50 1.11 -1.25 0.02 0.00 0.00 175.30 176.43 2qab s PRO 336 N -0.72 0.63 0.38 3.54 0.04 -1.26 -4.92 135.00 132.68 2qab s PRO 336 Ca 0.09 0.37 -0.13 0.00 0.04 0.00 0.00 61.00 61.38 2qab s PRO 336 Cb -0.09 -1.77 -0.08 0.00 0.04 0.00 0.00 34.50 32.60 2qab s PRO 336 CO -0.00 -2.56 0.77 -0.06 0.04 0.00 0.00 177.00 175.19 2qab s PHE 337 N -3.11 3.42 0.46 0.56 0.08 -1.26 -5.07 117.98 113.07 2qab s PHE 337 Ca 0.65 1.15 0.04 0.00 0.12 0.00 0.00 56.93 58.89 2qab s PHE 337 Cb -0.17 -2.51 -0.04 0.00 -0.57 0.00 0.00 43.02 39.73 2qab s PHE 337 CO 0.56 -0.04 0.03 -1.54 -0.10 0.00 0.00 175.22 174.13 2qab s SER 338 N -2.76 4.07 0.20 1.36 1.04 -1.26 -5.01 113.70 111.34 2qab s SER 338 Ca 0.53 -1.48 -0.09 0.00 0.48 0.00 0.00 55.95 55.39 2qab s SER 338 Cb -0.10 0.08 0.14 0.00 0.10 0.00 0.00 66.02 66.23 2qab s SER 338 CO 0.25 -0.68 1.78 -0.08 0.98 0.00 0.00 173.24 175.49 2qab h GLU 339 N 1.50 1.08 -0.50 4.02 4.81 -1.98 -2.38 114.58 121.13 2qab h GLU 339 Ca -0.44 -0.17 -0.11 0.00 -0.13 0.00 0.00 59.36 58.51 2qab h GLU 339 Cb 1.28 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 2qab h GLU 339 CO 0.76 0.86 -0.12 0.00 -0.73 0.00 0.00 179.01 179.78 2qab h ALA 340 N 1.17 0.68 -0.20 2.92 0.00 -1.89 -2.92 119.26 119.02 2qab h ALA 340 Ca 0.25 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 2qab h ALA 340 Cb 0.15 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qab h ALA 340 CO -0.03 0.60 -0.38 0.66 0.00 0.00 0.00 179.25 180.10 2qab h SER 341 N 0.82 0.68 -0.13 0.00 4.64 -1.88 -1.43 113.55 116.26 2qab h SER 341 Ca 0.13 -0.54 0.01 0.00 -0.47 0.00 0.00 61.79 60.92 2qab h SER 341 Cb 0.68 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2qab h SER 341 CO 0.05 1.10 0.03 -0.03 -0.87 0.00 0.00 176.83 177.11 2qab h MET 342 N 0.29 0.09 -0.40 4.77 -1.53 -1.48 0.64 114.93 117.32 2qab h MET 342 Ca 0.01 -0.01 -0.09 0.00 -3.44 0.00 0.00 59.70 56.17 2qab h MET 342 Cb 0.98 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.99 2qab h MET 342 CO 0.09 0.06 -0.13 1.98 0.14 0.00 0.00 176.91 179.05 2qab h MET 343 N 0.09 0.71 -0.65 0.39 -1.53 -1.55 -0.32 114.93 112.07 2qab h MET 343 Ca 0.06 -0.24 -0.00 0.00 -3.44 0.00 0.00 59.70 56.08 2qab h MET 343 Cb 0.04 -0.06 -0.03 0.00 -0.55 0.00 0.00 31.60 31.00 2qab h MET 343 CO -0.07 0.81 0.40 0.78 0.14 0.00 0.00 176.91 178.97 2qab h GLY 344 N 0.97 0.94 0.99 1.39 0.00 -1.00 -1.35 103.07 105.01 2qab h GLY 344 Ca 0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 2qab h GLY 344 CO 0.04 0.37 0.33 1.41 0.00 0.00 0.00 176.54 178.69 2qab h LEU 345 N 0.88 0.76 -0.47 3.11 4.07 -0.14 -0.43 115.31 123.10 2qab h LEU 345 Ca 0.23 -0.09 -0.09 0.00 0.08 0.00 0.00 57.88 58.01 2qab h LEU 345 Cb -0.04 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.49 2qab h LEU 345 CO -0.05 0.64 -0.08 -0.07 -1.08 0.00 0.00 178.44 177.81 2qab h LEU 346 N 0.83 0.88 0.12 1.67 4.07 -0.89 -2.08 115.31 119.90 2qab h LEU 346 Ca 0.21 -0.34 -0.30 0.00 0.08 0.00 0.00 57.88 57.53 2qab h LEU 346 Cb 0.05 -0.24 0.03 0.00 1.08 0.00 0.00 40.66 41.57 2qab h LEU 346 CO -0.03 1.02 -1.26 0.71 -1.08 0.00 0.00 178.44 177.79 2qab h THR 347 N 0.72 1.32 -0.72 0.22 1.35 -1.16 -1.34 112.91 113.31 2qab h THR 347 Ca 0.12 -2.58 0.06 0.00 -0.55 0.00 0.00 66.41 63.46 2qab h THR 347 Cb 0.61 2.76 -0.06 0.00 -1.73 0.00 0.00 68.15 69.74 2qab h THR 347 CO 0.04 0.78 0.41 -1.13 -0.25 0.00 0.00 175.52 175.37 2qab h ASN 348 N 0.22 0.61 0.22 5.36 -0.73 -1.13 -0.27 115.58 119.87 2qab h ASN 348 Ca -0.18 0.03 -0.01 0.00 1.87 0.00 0.00 56.30 58.01 2qab h ASN 348 Cb 1.94 -0.09 0.00 0.00 0.27 0.00 0.00 38.32 40.44 2qab h ASN 348 CO 0.23 0.39 -0.10 0.25 -0.37 0.00 0.00 177.43 177.83 2qab h LEU 349 N 0.75 -0.25 -0.95 0.34 5.85 -1.32 -2.62 115.31 117.12 2qab h LEU 349 Ca 0.33 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.98 2qab h LEU 349 Cb 0.21 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.24 2qab h LEU 349 CO -0.19 -0.01 0.61 0.00 -0.34 0.00 0.00 178.44 178.50 2qab h ALA 350 N 0.25 1.31 -0.79 1.25 0.00 -1.07 -0.41 119.26 119.80 2qab h ALA 350 Ca -0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2qab h ALA 350 Cb 0.36 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2qab h ALA 350 CO 0.05 0.39 0.40 0.22 0.00 0.00 0.00 179.25 180.31 2qab h ASP 351 N 1.11 1.01 0.00 0.00 1.82 -0.99 0.85 116.42 120.22 2qab h ASP 351 Ca 0.41 -0.12 -0.15 0.00 -0.39 0.00 0.00 57.03 56.77 2qab h ASP 351 Cb 0.15 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.90 2qab h ASP 351 CO -0.17 0.85 -0.51 0.03 -1.61 0.00 0.00 179.24 177.82 2qab h ARG 352 N 1.11 0.56 -0.21 0.28 3.08 -0.97 -3.14 114.38 115.10 2qab h ARG 352 Ca 0.27 -0.34 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 2qab h ARG 352 Cb 0.08 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2qab h ARG 352 CO -0.04 0.94 -0.31 0.93 -1.07 0.00 0.00 179.97 180.43 2qab h GLU 353 N 0.44 0.41 -0.85 0.04 5.08 -0.72 -2.88 114.58 116.10 2qab h GLU 353 Ca 0.02 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2qab h GLU 353 Cb 1.05 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.24 2qab h GLU 353 CO 0.10 0.68 0.53 -0.07 -1.00 0.00 0.00 179.01 179.25 2qab h LEU 354 N 0.36 1.00 -0.53 1.33 3.38 -0.79 0.72 115.31 120.78 2qab h LEU 354 Ca 0.05 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2qab h LEU 354 Cb 0.72 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2qab h LEU 354 CO 0.06 0.75 0.29 0.58 0.09 0.00 0.00 178.44 180.21 2qab h VAL 355 N 1.17 1.18 -0.37 1.22 2.07 -1.52 -2.17 116.25 117.83 2qab h VAL 355 Ca 0.31 -0.46 -0.10 0.00 0.82 0.00 0.00 66.70 67.27 2qab h VAL 355 Cb -0.08 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 2qab h VAL 355 CO -0.06 0.19 -0.17 0.45 0.02 0.00 0.00 177.57 178.01 2qab h HIS 356 N 0.72 0.76 -0.68 1.57 3.86 -1.41 -3.07 115.15 116.89 2qab h HIS 356 Ca 0.19 -0.15 0.02 0.00 -1.16 0.00 0.00 60.37 59.27 2qab h HIS 356 Cb 0.05 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 28.29 2qab h HIS 356 CO -0.01 0.81 0.43 1.98 0.86 0.00 0.00 177.93 182.00 2qab h MET 357 N 0.62 0.83 -0.66 2.45 -1.53 -0.54 0.46 114.93 116.56 2qab h MET 357 Ca 0.10 -0.05 0.01 0.00 -3.44 0.00 0.00 59.70 56.32 2qab h MET 357 Cb 0.63 -0.19 -0.03 0.00 -0.55 0.00 0.00 31.60 31.46 2qab h MET 357 CO 0.04 0.55 0.44 0.82 0.14 0.00 0.00 176.91 178.90 2qab h ILE 358 N 0.86 1.16 -0.36 1.77 2.04 -1.31 0.19 117.51 121.86 2qab h ILE 358 Ca 0.27 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.84 2qab h ILE 358 Cb -0.02 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.23 2qab h ILE 358 CO -0.09 0.16 0.20 0.78 0.00 0.00 0.00 178.15 179.20 2qab h ASN 359 N 0.89 0.31 -0.22 1.72 4.21 -1.35 -2.61 115.58 118.52 2qab h ASN 359 Ca 0.24 0.01 0.03 0.00 1.21 0.00 0.00 56.30 57.79 2qab h ASN 359 Cb -0.09 -0.05 -0.03 0.00 -1.12 0.00 0.00 38.32 37.03 2qab h ASN 359 CO -0.06 0.22 0.05 -0.25 -1.29 0.00 0.00 177.43 176.10 2qab h TRP 360 N 0.40 0.08 -0.58 1.19 7.01 -0.30 -3.01 115.95 120.74 2qab h TRP 360 Ca 0.15 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.21 2qab h TRP 360 Cb 0.03 -0.00 -0.05 0.00 -2.10 0.00 0.00 29.16 27.04 2qab h TRP 360 CO -0.08 0.03 0.31 0.00 -2.79 0.00 0.00 178.44 175.90 2qab h ALA 361 N 1.16 0.75 0.00 2.65 0.00 -0.53 0.15 119.26 123.44 2qab h ALA 361 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qab h ALA 361 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qab h ALA 361 CO -0.13 -0.03 0.00 0.87 0.00 0.00 0.00 179.25 179.97 2qab h LYS 362 N 0.58 0.00 -0.20 0.00 1.57 -1.35 -0.09 116.57 117.09 2qab h LYS 362 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2qab h LYS 362 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2qab h LYS 362 CO -0.17 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.25 2qab n ARG 363 N -2.87 2.31 -2.76 3.15 1.74 0.49 -4.58 116.66 114.14 2qab n ARG 363 Ca -0.02 -1.94 -0.42 0.00 -0.77 0.00 0.00 57.85 54.69 2qab n ARG 363 Cb 0.08 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 2qab n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2qab s VAL 364 N -1.76 4.70 -0.02 1.55 1.01 -0.05 -4.82 120.40 121.02 2qab s VAL 364 Ca 0.34 1.70 -0.37 0.00 0.00 0.00 0.00 61.98 63.65 2qab s VAL 364 Cb 0.21 -4.26 -0.16 0.00 0.00 0.00 0.00 36.38 32.18 2qab s VAL 364 CO 0.31 -0.23 1.54 -2.65 0.00 0.00 0.00 175.10 174.06 2qab n PRO 365 N 6.34 1.40 0.00 2.72 -0.02 -1.26 -0.89 135.00 143.29 2qab n PRO 365 Ca 0.09 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2qab n PRO 365 Cb 0.47 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2qab n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qab n GLY 366 N 3.28 3.20 0.33 -1.23 0.00 -1.26 -4.90 105.19 104.61 2qab n GLY 366 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.22 2qab n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2qab h PHE 367 N 0.00 0.90 0.00 1.61 3.57 -1.29 -1.91 116.94 119.82 2qab h PHE 367 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2qab h PHE 367 Cb 0.00 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.45 2qab h PHE 367 CO 0.00 0.63 0.00 1.55 -2.23 0.00 0.00 178.31 178.26 2qab n VAL 368 N -4.37 0.08 0.19 1.41 3.14 -1.26 -2.62 118.33 114.90 2qab n VAL 368 Ca 0.06 0.02 0.09 0.00 -2.96 0.00 0.00 64.34 61.55 2qab n VAL 368 Cb 0.10 -0.54 0.14 0.00 -1.06 0.00 0.00 33.84 32.48 2qab n VAL 368 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 2qab h ASP 369 N 0.00 0.00 -4.16 6.55 3.32 -1.72 -3.46 116.42 116.95 2qab h ASP 369 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 2qab h ASP 369 Cb 0.42 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.03 2qab h ASP 369 CO 0.00 0.19 0.38 -0.76 -1.72 0.00 0.00 179.24 177.33 2qab s LEU 370 N -6.31 3.59 0.58 1.55 1.43 -1.08 -5.01 118.68 113.43 2qab s LEU 370 Ca 0.06 1.89 -0.20 0.00 -1.03 0.00 0.00 54.13 54.84 2qab s LEU 370 Cb 0.06 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.70 2qab s LEU 370 CO 0.69 -1.12 1.26 0.42 0.23 0.00 0.00 176.35 177.83 2qab s THR 371 N -2.28 2.44 0.30 5.49 -4.23 -1.26 -4.78 115.64 111.31 2qab s THR 371 Ca 0.65 0.29 0.05 0.00 -1.18 0.00 0.00 61.69 61.51 2qab s THR 371 Cb -0.17 -3.13 0.30 0.00 1.34 0.00 0.00 72.50 70.84 2qab s THR 371 CO 0.32 -0.04 1.69 0.25 -0.54 0.00 0.00 174.62 176.30 2qab h LEU 372 N 1.09 0.32 -0.44 4.79 5.85 -1.95 -0.10 115.31 124.87 2qab h LEU 372 Ca -0.51 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 2qab h LEU 372 Cb 1.30 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.46 2qab h LEU 372 CO 0.56 -0.04 0.20 -0.74 -0.34 0.00 0.00 178.44 178.08 2qab h HIS 373 N 0.37 0.64 -0.69 1.25 2.76 -1.99 -0.98 115.15 116.50 2qab h HIS 373 Ca 0.59 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.67 2qab h HIS 373 Cb 1.16 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 29.89 2qab h HIS 373 CO -0.13 0.53 0.25 -0.44 -1.30 0.00 0.00 177.93 176.84 2qab h ASP 374 N 0.56 0.97 -0.34 3.26 3.32 -1.56 -0.83 116.42 121.80 2qab h ASP 374 Ca 0.15 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2qab h ASP 374 Cb 0.14 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 2qab h ASP 374 CO -0.02 0.88 0.16 1.56 -1.72 0.00 0.00 179.24 180.11 2qab h GLN 375 N 1.02 0.49 0.02 3.56 4.20 -0.66 -1.52 115.11 122.20 2qab h GLN 375 Ca 0.23 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.88 2qab h GLN 375 Cb 0.24 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 2qab h GLN 375 CO -0.01 0.44 -0.07 0.28 -0.67 0.00 0.00 178.83 178.80 2qab h VAL 376 N 0.41 0.82 -0.65 -0.54 2.07 -0.99 -2.27 116.25 115.10 2qab h VAL 376 Ca 0.12 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.73 2qab h VAL 376 Cb 0.12 0.82 -0.07 0.00 -1.52 0.00 0.00 31.29 30.64 2qab h VAL 376 CO -0.01 0.00 0.27 -0.74 0.02 0.00 0.00 177.57 177.11 2qab h HIS 377 N -0.13 0.48 -0.36 1.57 -0.00 -0.92 0.06 115.15 115.85 2qab h HIS 377 Ca 0.02 0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 2qab h HIS 377 Cb 0.16 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.44 2qab h HIS 377 CO -0.13 0.14 0.08 -0.07 -0.00 0.00 0.00 177.93 177.95 2qab h LEU 378 N 0.47 0.55 -0.42 0.26 3.38 -1.09 -1.47 115.31 116.99 2qab h LEU 378 Ca 0.33 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2qab h LEU 378 Cb 0.40 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2qab h LEU 378 CO -0.30 0.65 0.01 -0.07 0.09 0.00 0.00 178.44 178.81 2qab h LEU 379 N 0.43 0.73 -1.11 1.67 3.38 -1.10 -0.69 115.31 118.62 2qab h LEU 379 Ca 0.11 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.82 2qab h LEU 379 Cb 0.32 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 2qab h LEU 379 CO 0.00 0.85 0.60 -0.33 0.09 0.00 0.00 178.44 179.66 2qab h GLU 380 N 0.58 1.10 -0.12 1.13 5.08 -0.92 0.74 114.58 122.17 2qab h GLU 380 Ca 0.12 -0.07 -0.23 0.00 -1.00 0.00 0.00 59.36 58.19 2qab h GLU 380 Cb 0.47 -0.25 0.01 0.00 0.50 0.00 0.00 28.75 29.49 2qab h GLU 380 CO 0.02 0.73 -0.82 0.00 -1.00 0.00 0.00 179.01 177.93 2qab n ALA 382 N -2.60 3.92 -0.29 0.00 0.00 -0.29 -4.69 120.51 116.55 2qab n ALA 382 Ca -0.08 -0.60 0.03 0.00 0.00 0.00 0.00 53.44 52.79 2qab n ALA 382 Cb 0.77 -0.74 0.17 0.00 0.00 0.00 0.00 19.45 19.65 2qab n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2qab h TRP 383 N 1.43 0.86 -0.02 0.00 5.08 -1.02 -0.88 115.95 121.40 2qab h TRP 383 Ca 0.00 0.03 -0.19 0.00 1.08 0.00 0.00 58.89 59.81 2qab h TRP 383 Cb 0.62 -0.26 -0.01 0.00 -3.00 0.00 0.00 29.16 26.51 2qab h TRP 383 CO 0.00 0.34 -0.83 1.25 -1.28 0.00 0.00 178.44 177.92 2qab h LEU 384 N 0.79 0.33 -0.60 0.11 5.85 -1.86 -1.40 115.31 118.53 2qab h LEU 384 Ca 0.40 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.90 2qab h LEU 384 Cb 0.38 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 2qab h LEU 384 CO -0.25 1.02 0.37 -0.33 -0.34 0.00 0.00 178.44 178.91 2qab h GLU 385 N 0.16 0.72 -0.35 1.25 5.08 -1.69 -0.35 114.58 119.39 2qab h GLU 385 Ca -0.04 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 2qab h GLU 385 Cb 1.43 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 2qab h GLU 385 CO 0.13 0.48 -0.02 0.82 -1.00 0.00 0.00 179.01 179.42 2qab h ILE 386 N 0.74 1.26 -0.82 3.13 2.04 -0.94 0.09 117.51 123.01 2qab h ILE 386 Ca 0.24 -1.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.06 2qab h ILE 386 Cb -0.00 1.22 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 2qab h ILE 386 CO -0.09 0.34 0.44 -0.07 0.00 0.00 0.00 178.15 178.77 2qab h LEU 387 N 0.45 1.03 -0.27 1.44 3.38 -1.13 -2.33 115.31 117.87 2qab h LEU 387 Ca 0.10 -0.10 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 2qab h LEU 387 Cb 0.49 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qab h LEU 387 CO 0.02 0.84 -0.63 0.24 0.09 0.00 0.00 178.44 179.00 2qab h MET 388 N 1.14 0.82 -0.31 1.13 2.86 -0.76 -1.11 114.93 118.69 2qab h MET 388 Ca 0.29 -0.57 -0.08 0.00 -2.06 0.00 0.00 59.70 57.28 2qab h MET 388 Cb 0.04 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 2qab h MET 388 CO -0.04 1.19 -0.15 0.97 1.06 0.00 0.00 176.91 179.94 2qab h ILE 389 N 0.60 1.24 0.10 -1.22 2.10 -0.95 0.13 117.51 119.52 2qab h ILE 389 Ca -0.01 -1.10 0.01 0.00 1.08 0.00 0.00 64.86 64.84 2qab h ILE 389 Cb 1.24 1.17 -0.02 0.00 -1.09 0.00 0.00 36.82 38.12 2qab h ILE 389 CO 0.13 0.36 -0.14 1.23 -1.08 0.00 0.00 178.15 178.65 2qab h GLY 390 N 0.96 -0.26 0.85 8.18 0.00 -1.23 -0.31 103.07 111.25 2qab h GLY 390 Ca 0.09 0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.61 2qab h GLY 390 CO 0.03 -0.14 0.25 -2.00 0.00 0.00 0.00 176.54 174.69 2qab h LEU 391 N -0.29 0.40 -0.67 3.11 5.85 -0.77 -1.40 115.31 121.54 2qab h LEU 391 Ca 0.02 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.79 2qab h LEU 391 Cb 0.30 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 2qab h LEU 391 CO -0.07 0.28 0.40 0.58 -0.34 0.00 0.00 178.44 179.29 2qab h VAL 392 N 0.51 1.05 -0.27 1.05 2.07 -0.52 -1.75 116.25 118.38 2qab h VAL 392 Ca 0.19 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 2qab h VAL 392 Cb 0.04 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 2qab h VAL 392 CO -0.10 0.14 0.06 -0.25 0.02 0.00 0.00 177.57 177.44 2qab h TRP 393 N 0.77 0.45 0.00 1.57 2.91 -0.65 -2.56 115.95 118.45 2qab h TRP 393 Ca 0.28 -0.06 0.00 0.00 1.13 0.00 0.00 58.89 60.24 2qab h TRP 393 Cb 0.08 -0.13 0.00 0.00 -0.51 0.00 0.00 29.16 28.60 2qab h TRP 393 CO -0.06 0.51 0.00 0.07 -1.03 0.00 0.00 178.44 177.94 2qab h ARG 394 N 0.26 0.00 -0.00 2.65 0.11 -1.15 -2.71 114.38 113.53 2qab h ARG 394 Ca 0.08 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.16 2qab h ARG 394 Cb 0.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.37 2qab h ARG 394 CO 0.00 0.00 -0.03 0.43 0.10 0.00 0.00 179.97 180.47 2qab n SER 395 N -2.90 0.53 -0.27 0.08 7.64 -0.67 -4.35 113.62 113.68 2qab n SER 395 Ca 0.03 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 58.94 2qab n SER 395 Cb 0.41 -0.03 0.13 0.00 -1.01 0.00 0.00 64.21 63.71 2qab n SER 395 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 2qab h MET 396 N 0.78 0.74 -0.80 1.43 -1.53 -1.12 -0.41 114.93 114.02 2qab h MET 396 Ca 0.00 -0.04 -0.13 0.00 -3.44 0.00 0.00 59.70 56.08 2qab h MET 396 Cb 0.25 -0.17 -0.08 0.00 -0.55 0.00 0.00 31.60 31.05 2qab h MET 396 CO 0.00 0.49 0.17 -0.85 0.14 0.00 0.00 176.91 176.86 2qab n GLU 397 N -4.75 3.17 -3.36 0.39 0.28 -1.26 -4.43 120.64 110.68 2qab n GLU 397 Ca 0.11 -2.26 -0.26 0.00 -0.16 0.00 0.00 57.16 54.59 2qab n GLU 397 Cb 0.21 -1.99 -0.08 0.00 1.43 0.00 0.00 31.44 31.01 2qab n GLU 397 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2qab n HIS 398 N 0.05 1.58 -1.64 -1.84 8.25 -0.16 -5.10 115.22 116.35 2qab n HIS 398 Ca 0.29 -3.85 -0.58 0.00 -0.26 0.00 0.00 57.72 53.32 2qab n HIS 398 Cb 1.09 -0.41 -0.07 0.00 1.12 0.00 0.00 29.99 31.72 2qab n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2qab n PRO 399 N 1.34 0.78 -0.49 -0.41 -0.02 -1.26 -1.12 135.00 133.82 2qab n PRO 399 Ca 0.25 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2qab n PRO 399 Cb 0.46 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 2qab n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qab n GLY 400 N 3.17 1.05 3.25 -1.23 0.00 -1.26 -5.03 105.19 105.14 2qab n GLY 400 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 2qab n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qab s LYS 401 N -0.37 1.03 -0.30 1.61 1.02 -0.27 -1.62 119.74 120.84 2qab s LYS 401 Ca 0.00 -1.14 -0.05 0.00 0.02 0.00 0.00 55.97 54.80 2qab s LYS 401 Cb 0.00 -1.15 0.03 0.00 -0.52 0.00 0.00 37.83 36.19 2qab s LYS 401 CO 0.00 0.26 0.05 -0.51 -0.92 0.00 0.00 175.35 174.23 2qab s LEU 402 N -2.01 3.88 -1.15 3.17 1.43 0.15 -4.80 118.68 119.36 2qab s LEU 402 Ca 0.05 -0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 52.03 2qab s LEU 402 Cb -0.09 -1.82 0.11 0.00 0.03 0.00 0.00 46.19 44.42 2qab s LEU 402 CO 0.04 -0.23 1.47 -0.22 0.23 0.00 0.00 176.35 177.64 2qab s LEU 403 N 1.41 4.41 0.27 1.79 0.20 -1.26 -1.52 118.68 123.97 2qab s LEU 403 Ca -0.00 -2.38 -0.03 0.00 0.69 0.00 0.00 54.13 52.41 2qab s LEU 403 Cb -0.18 -2.49 0.35 0.00 -0.43 0.00 0.00 46.19 43.44 2qab s LEU 403 CO 0.01 -1.07 1.82 -0.26 -0.29 0.00 0.00 176.35 176.56 2qab h PHE 404 N 8.06 0.93 -3.24 5.38 0.04 -1.66 -3.42 116.94 123.03 2qab h PHE 404 Ca 0.31 -0.08 -0.03 0.00 2.80 0.00 0.00 57.97 60.97 2qab h PHE 404 Cb 0.92 -0.27 -0.11 0.00 2.20 0.00 0.00 35.95 38.69 2qab h PHE 404 CO 1.25 0.76 0.05 0.00 -0.60 0.00 0.00 178.31 179.77 2qab s ALA 405 N -5.29 -1.11 0.44 2.45 0.00 -1.00 -4.93 121.76 112.31 2qab s ALA 405 Ca -0.10 0.01 0.20 0.00 0.00 0.00 0.00 51.96 52.06 2qab s ALA 405 Cb 0.16 0.81 1.15 0.00 0.00 0.00 0.00 23.12 25.24 2qab s ALA 405 CO 0.81 -0.75 1.88 -1.35 0.00 0.00 0.00 175.76 176.35 2qab h PRO 406 N 2.19 0.32 -0.53 0.00 0.11 -1.88 -0.18 132.00 132.03 2qab h PRO 406 Ca -0.31 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2qab h PRO 406 Cb 1.27 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2qab h PRO 406 CO 0.40 0.21 0.00 0.27 -0.21 0.00 0.00 178.00 178.67 2qab n ASN 407 N -4.46 4.27 -3.42 -2.05 6.94 -1.26 -4.62 115.26 110.65 2qab n ASN 407 Ca 0.18 -2.45 -0.28 0.00 -0.02 0.00 0.00 54.58 52.01 2qab n ASN 407 Cb 0.70 -0.51 -0.11 0.00 -2.36 0.00 0.00 39.78 37.51 2qab n ASN 407 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2qab s LEU 408 N -1.83 1.36 -0.31 -4.53 2.96 -0.08 -4.89 118.68 111.37 2qab s LEU 408 Ca 0.44 -2.86 -0.03 0.00 -0.22 0.00 0.00 54.13 51.47 2qab s LEU 408 Cb 0.29 -0.45 0.04 0.00 0.50 0.00 0.00 46.19 46.57 2qab s LEU 408 CO 0.21 -0.20 0.03 -0.22 -1.32 0.00 0.00 176.35 174.84 2qab s LEU 409 N 0.29 3.96 -0.25 -0.68 2.96 -1.25 -1.67 118.68 122.04 2qab s LEU 409 Ca 0.29 -1.19 -0.05 0.00 -0.22 0.00 0.00 54.13 52.97 2qab s LEU 409 Cb -0.03 -1.76 0.00 0.00 0.50 0.00 0.00 46.19 44.90 2qab s LEU 409 CO -0.14 -0.27 0.00 -0.76 -1.32 0.00 0.00 176.35 173.86 2qab s LEU 410 N 1.31 3.28 0.82 -0.68 1.43 -0.57 -4.88 118.68 119.37 2qab s LEU 410 Ca -0.04 -0.55 -0.11 0.00 -1.03 0.00 0.00 54.13 52.40 2qab s LEU 410 Cb -0.19 -1.79 0.08 0.00 0.03 0.00 0.00 46.19 44.32 2qab s LEU 410 CO -0.00 -0.09 1.09 1.51 0.23 0.00 0.00 176.35 179.09 2qab s ASP 411 N 1.47 4.13 0.28 2.29 1.47 -1.26 -0.67 116.67 124.37 2qab s ASP 411 Ca 0.04 1.75 -0.04 0.00 1.18 0.00 0.00 52.55 55.47 2qab s ASP 411 Cb -0.16 -2.43 0.55 0.00 -0.34 0.00 0.00 42.92 40.55 2qab s ASP 411 CO -0.01 -2.26 1.58 -0.09 0.68 0.00 0.00 175.17 175.07 2qab h ARG 412 N -1.29 0.02 0.00 2.11 1.12 -1.69 -1.82 114.38 112.84 2qab h ARG 412 Ca -0.45 -0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.41 2qab h ARG 412 Cb 1.25 -0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 31.20 2qab h ARG 412 CO 0.52 0.01 -0.02 -0.91 -3.11 0.00 0.00 179.97 176.46 2qab h ASN 413 N 0.02 0.00 0.71 -3.80 -0.26 -1.91 -2.53 115.58 107.82 2qab h ASN 413 Ca 0.50 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.24 2qab h ASN 413 Cb 0.90 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.16 2qab h ASN 413 CO -0.90 0.02 0.00 0.00 -1.06 0.00 0.00 177.43 175.49 2qab n GLN 414 N -3.15 0.16 0.27 0.81 6.02 -0.68 -2.05 117.38 118.76 2qab n GLN 414 Ca -0.01 0.05 0.18 0.00 -0.01 0.00 0.00 57.00 57.21 2qab n GLN 414 Cb 0.22 -1.50 0.77 0.00 1.02 0.00 0.00 30.24 30.74 2qab n GLN 414 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2qab h GLY 415 N 4.38 0.00 2.00 1.08 0.00 -1.59 -2.51 103.07 106.43 2qab h GLY 415 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qab h GLY 415 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 2qab n LYS 416 N -2.98 0.07 0.30 4.80 5.02 -0.87 -2.70 118.16 121.80 2qab n LYS 416 Ca 0.00 0.16 0.19 0.00 -2.02 0.00 0.00 58.31 56.64 2qab n LYS 416 Cb 0.25 -1.60 0.95 0.00 -0.02 0.00 0.00 35.03 34.61 2qab n LYS 416 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qab s VAL 418 N -4.01 1.70 0.23 0.00 1.01 -1.10 -3.75 120.40 114.47 2qab s VAL 418 Ca -0.03 -0.76 -0.32 0.00 0.00 0.00 0.00 61.98 60.88 2qab s VAL 418 Cb 0.12 -1.53 -0.13 0.00 0.00 0.00 0.00 36.38 34.84 2qab s VAL 418 CO 0.49 0.48 1.51 -1.84 0.00 0.00 0.00 175.10 175.74 2qab n GLU 419 N 4.14 2.24 -0.10 2.72 0.28 -1.26 -2.04 120.64 126.61 2qab n GLU 419 Ca -0.19 0.80 0.00 0.00 -0.16 0.00 0.00 57.16 57.61 2qab n GLU 419 Cb 0.51 -2.52 0.00 0.00 1.43 0.00 0.00 31.44 30.86 2qab n GLU 419 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2qab n GLY 420 N 2.60 2.68 0.17 -1.84 0.00 -1.26 -4.88 105.19 102.68 2qab n GLY 420 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 2qab n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2qab h MET 421 N 2.18 0.54 -0.27 1.61 -1.53 -1.58 -3.34 114.93 112.54 2qab h MET 421 Ca 0.00 -0.57 -0.00 0.00 -3.44 0.00 0.00 59.70 55.69 2qab h MET 421 Cb 0.00 0.16 -0.01 0.00 -0.55 0.00 0.00 31.60 31.19 2qab h MET 421 CO 0.00 1.19 0.15 -0.24 0.14 0.00 0.00 176.91 178.15 2qab h VAL 422 N 0.31 1.09 -0.82 -5.77 3.04 -1.74 -0.75 116.25 111.60 2qab h VAL 422 Ca -0.10 -0.22 -0.01 0.00 -1.01 0.00 0.00 66.70 65.36 2qab h VAL 422 Cb 1.61 0.72 -0.04 0.00 -2.01 0.00 0.00 31.29 31.57 2qab h VAL 422 CO 0.18 0.09 0.46 -0.33 -1.01 0.00 0.00 177.57 176.96 2qab h GLU 423 N 0.37 1.13 -0.15 4.17 3.07 -1.93 0.28 114.58 121.52 2qab h GLU 423 Ca 0.10 -0.13 -0.11 0.00 -0.50 0.00 0.00 59.36 58.72 2qab h GLU 423 Cb 0.01 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 27.70 2qab h GLU 423 CO -0.02 0.83 -0.34 0.82 -1.40 0.00 0.00 179.01 178.90 2qab h ILE 424 N 1.13 1.35 -0.36 3.13 2.04 -1.38 -2.62 117.51 120.80 2qab h ILE 424 Ca 0.29 -1.60 0.08 0.00 1.00 0.00 0.00 64.86 64.63 2qab h ILE 424 Cb 0.01 1.99 -0.08 0.00 -0.74 0.00 0.00 36.82 38.00 2qab h ILE 424 CO -0.05 0.48 -0.19 -0.26 0.00 0.00 0.00 178.15 178.13 2qab h PHE 425 N 0.13 -0.48 -0.98 1.37 -1.00 -0.97 -0.32 116.94 114.68 2qab h PHE 425 Ca 0.00 0.04 0.13 0.00 2.81 0.00 0.00 57.97 60.95 2qab h PHE 425 Cb 0.94 0.27 -0.09 0.00 3.61 0.00 0.00 35.95 40.68 2qab h PHE 425 CO 0.10 -0.27 0.61 -0.44 -1.61 0.00 0.00 178.31 176.70 2qab h ASP 426 N -0.13 0.88 -0.25 2.17 3.32 -0.39 0.73 116.42 122.75 2qab h ASP 426 Ca 0.18 0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.24 2qab h ASP 426 Cb 0.41 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2qab h ASP 426 CO -0.45 0.45 -0.05 0.24 -1.72 0.00 0.00 179.24 177.71 2qab h MET 427 N 0.94 0.47 -0.39 3.56 2.86 -1.01 -1.61 114.93 119.74 2qab h MET 427 Ca 0.50 -0.18 0.04 0.00 -2.06 0.00 0.00 59.70 58.01 2qab h MET 427 Cb 0.54 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.13 2qab h MET 427 CO -0.28 0.69 0.15 -0.07 1.06 0.00 0.00 176.91 178.46 2qab h LEU 428 N 0.22 0.19 -0.49 1.22 3.38 -0.21 -2.02 115.31 117.59 2qab h LEU 428 Ca 0.06 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2qab h LEU 428 Cb 0.51 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2qab h LEU 428 CO 0.02 0.14 0.17 -0.07 0.09 0.00 0.00 178.44 178.80 2qab h LEU 429 N 0.32 0.70 -1.45 1.67 3.38 -0.87 -1.44 115.31 117.62 2qab h LEU 429 Ca 0.18 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.02 2qab h LEU 429 Cb 0.14 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 2qab h LEU 429 CO -0.17 0.70 0.43 0.00 0.09 0.00 0.00 178.44 179.50 2qab h ALA 430 N 1.02 1.75 -0.19 1.53 0.00 -1.04 0.98 119.26 123.31 2qab h ALA 430 Ca 0.16 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 2qab h ALA 430 Cb 0.24 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.86 2qab h ALA 430 CO -0.01 0.15 -0.59 1.15 0.00 0.00 0.00 179.25 179.95 2qab h THR 431 N 0.68 1.30 -0.47 0.00 2.02 -0.99 -1.93 112.91 113.52 2qab h THR 431 Ca 0.28 -1.81 0.02 0.00 0.77 0.00 0.00 66.41 65.67 2qab h THR 431 Cb 0.25 1.90 -0.03 0.00 -1.74 0.00 0.00 68.15 68.52 2qab h THR 431 CO -0.09 0.57 0.27 -1.28 0.37 0.00 0.00 175.52 175.37 2qab h SER 432 N 0.46 0.44 -1.01 4.18 0.87 -0.55 -1.03 113.55 116.91 2qab h SER 432 Ca -0.02 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2qab h SER 432 Cb 1.21 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 63.03 2qab h SER 432 CO 0.13 0.32 0.67 0.28 -0.53 0.00 0.00 176.83 177.69 2qab h SER 433 N 0.55 1.15 0.43 6.23 0.02 -0.78 -0.88 113.55 120.27 2qab h SER 433 Ca 0.19 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2qab h SER 433 Cb 0.02 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 62.28 2qab h SER 433 CO -0.09 0.83 -0.21 -0.09 -1.14 0.00 0.00 176.83 176.13 2qab h ARG 434 N 1.36 -0.56 -0.80 3.45 9.65 -0.79 0.01 114.38 126.71 2qab h ARG 434 Ca 0.37 0.04 0.15 0.00 -1.10 0.00 0.00 59.98 59.44 2qab h ARG 434 Cb -0.14 0.13 -0.15 0.00 -1.39 0.00 0.00 29.97 28.41 2qab h ARG 434 CO -0.08 -0.34 -0.23 0.74 2.80 0.00 0.00 179.97 182.86 2qab h PHE 435 N -0.63 -0.52 0.05 2.20 -1.00 -1.01 -0.07 116.94 115.96 2qab h PHE 435 Ca -0.06 0.07 0.01 0.00 2.81 0.00 0.00 57.97 60.80 2qab h PHE 435 Cb 0.47 0.35 -0.01 0.00 3.61 0.00 0.00 35.95 40.38 2qab h PHE 435 CO -0.03 -0.36 -0.08 -0.09 -1.61 0.00 0.00 178.31 176.14 2qab h ARG 436 N -0.02 -0.16 0.00 1.51 2.43 -0.87 0.52 114.38 117.78 2qab h ARG 436 Ca 0.37 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.50 2qab h ARG 436 Cb 0.59 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 2qab h ARG 436 CO -0.82 -0.11 -0.24 0.00 -1.51 0.00 0.00 179.97 177.28 2qab h MET 437 N -0.17 0.00 0.00 0.20 -0.00 0.06 -0.15 114.93 114.87 2qab h MET 437 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.72 2qab h MET 437 Cb 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.78 2qab h MET 437 CO -0.05 0.24 0.00 0.52 -0.00 0.00 0.00 176.91 177.62 2qab h MET 438 N 0.00 0.00 -5.57 -0.10 2.86 -0.78 -3.48 114.93 107.86 2qab h MET 438 Ca -0.00 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.33 2qab h MET 438 Cb 0.43 0.00 0.17 0.00 0.06 0.00 0.00 31.60 32.26 2qab h MET 438 CO 0.03 0.00 -0.77 -1.71 1.06 0.00 0.00 176.91 175.52 2qab n ASN 439 N -2.49 -2.80 -4.68 1.22 5.15 0.09 -4.90 115.26 106.85 2qab n ASN 439 Ca 0.05 -0.63 -0.45 0.00 -0.60 0.00 0.00 54.58 52.95 2qab n ASN 439 Cb 0.45 -5.08 -0.03 0.00 -0.53 0.00 0.00 39.78 34.59 2qab n ASN 439 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2qab n LEU 440 N -3.94 3.20 -4.93 1.20 7.94 -0.70 -4.98 117.00 114.79 2qab n LEU 440 Ca -0.25 1.12 -0.26 0.00 -1.11 0.00 0.00 56.01 55.50 2qab n LEU 440 Cb 0.66 -1.44 -0.03 0.00 0.53 0.00 0.00 43.42 43.14 2qab n LEU 440 CO 0.60 -0.35 0.09 -1.10 -1.11 0.00 0.00 177.39 175.51 2qab s GLN 441 N 0.16 3.53 0.35 1.96 -1.52 -1.26 -4.96 119.66 117.91 2qab s GLN 441 Ca 0.72 -0.30 0.02 0.00 -1.95 0.00 0.00 55.36 53.85 2qab s GLN 441 Cb -0.65 -2.77 0.63 0.00 -0.22 0.00 0.00 33.01 30.01 2qab s GLN 441 CO 0.44 0.31 2.01 0.78 -0.25 0.00 0.00 175.29 178.58 2qab h GLY 442 N 1.60 0.90 1.33 3.09 0.00 -1.99 -0.60 103.07 107.40 2qab h GLY 442 Ca -0.49 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 46.40 2qab h GLY 442 CO 0.66 0.33 -0.19 0.83 0.00 0.00 0.00 176.54 178.17 2qab h GLU 443 N 0.86 0.78 -0.27 4.80 3.07 -1.99 -1.98 114.58 119.86 2qab h GLU 443 Ca 0.23 -0.30 -0.04 0.00 -0.50 0.00 0.00 59.36 58.76 2qab h GLU 443 Cb -0.10 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.76 2qab h GLU 443 CO -0.05 0.91 0.02 0.93 -1.40 0.00 0.00 179.01 179.42 2qab h GLU 444 N 0.69 0.46 -0.56 2.33 5.08 -1.84 -2.89 114.58 117.85 2qab h GLU 444 Ca 0.10 -0.13 0.09 0.00 -1.00 0.00 0.00 59.36 58.42 2qab h GLU 444 Cb 0.69 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 2qab h GLU 444 CO 0.05 0.59 0.17 0.35 -1.00 0.00 0.00 179.01 179.18 2qab h PHE 445 N 0.25 0.30 -0.02 4.33 3.57 -0.84 -0.37 116.94 124.16 2qab h PHE 445 Ca 0.08 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.50 2qab h PHE 445 Cb 0.37 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2qab h PHE 445 CO 0.03 0.06 -0.49 -0.39 -2.23 0.00 0.00 178.31 175.29 2qab h VAL 446 N 0.34 1.35 -0.11 1.41 -1.51 -1.36 0.36 116.25 116.73 2qab h VAL 446 Ca 0.28 -1.68 -0.01 0.00 -1.23 0.00 0.00 66.70 64.06 2qab h VAL 446 Cb 0.35 1.89 -0.00 0.00 -2.13 0.00 0.00 31.29 31.39 2qab h VAL 446 CO -0.31 0.48 0.04 0.00 -1.23 0.00 0.00 177.57 176.56 2qab h LEU 448 N 0.01 0.81 -0.76 0.00 3.38 -0.25 -1.72 115.31 116.78 2qab h LEU 448 Ca 0.04 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2qab h LEU 448 Cb 0.19 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2qab h LEU 448 CO -0.00 0.58 0.37 0.50 0.09 0.00 0.00 178.44 179.98 2qab h LYS 449 N 0.96 1.08 -0.17 1.13 3.64 -0.91 -1.98 116.57 120.32 2qab h LYS 449 Ca 0.26 -0.15 -0.11 0.00 -1.27 0.00 0.00 60.65 59.38 2qab h LYS 449 Cb -0.10 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.51 2qab h LYS 449 CO -0.06 0.84 -0.36 0.77 -2.27 0.00 0.00 179.45 178.37 2qab h SER 450 N 1.06 0.38 -0.27 4.20 0.02 -1.09 -2.36 113.55 115.49 2qab h SER 450 Ca 0.26 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2qab h SER 450 Cb 0.10 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2qab h SER 450 CO -0.03 0.71 0.15 0.40 -1.14 0.00 0.00 176.83 176.92 2qab h ILE 451 N 0.31 1.12 -0.22 3.27 2.04 -0.95 -1.80 117.51 121.29 2qab h ILE 451 Ca 0.04 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.63 2qab h ILE 451 Cb 0.78 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.64 2qab h ILE 451 CO 0.06 0.12 -0.18 0.40 0.00 0.00 0.00 178.15 178.56 2qab h ILE 452 N 0.33 0.51 -0.67 -0.67 2.04 -1.15 0.67 117.51 118.57 2qab h ILE 452 Ca 0.10 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.08 2qab h ILE 452 Cb 0.06 0.51 -0.09 0.00 -0.74 0.00 0.00 36.82 36.56 2qab h ILE 452 CO -0.02 0.00 0.20 0.25 0.00 0.00 0.00 178.15 178.58 2qab h LEU 453 N -0.18 0.11 0.09 1.44 5.85 -1.17 -1.31 115.31 120.14 2qab h LEU 453 Ca 0.13 0.11 -0.29 0.00 0.84 0.00 0.00 57.88 58.67 2qab h LEU 453 Cb 0.38 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2qab h LEU 453 CO -0.33 0.04 -1.47 -0.07 -0.34 0.00 0.00 178.44 176.27 2qab h LEU 454 N 0.33 0.30 0.15 2.25 3.38 -0.75 -3.40 115.31 117.58 2qab h LEU 454 Ca 0.36 -0.41 -0.28 0.00 0.09 0.00 0.00 57.88 57.64 2qab h LEU 454 Cb 0.55 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.21 2qab h LEU 454 CO -0.41 1.34 -1.37 -1.13 0.09 0.00 0.00 178.44 176.96 2qab h ASN 455 N 0.05 0.51 -0.77 -0.43 -1.24 0.50 -3.36 115.58 110.84 2qab h ASN 455 Ca -0.21 -0.90 0.05 0.00 0.71 0.00 0.00 56.30 55.95 2qab h ASN 455 Cb 1.98 -0.17 -0.06 0.00 0.73 0.00 0.00 38.32 40.81 2qab h ASN 455 CO 0.15 1.62 0.47 0.28 -1.29 0.00 0.00 177.43 178.66 2qab h SER 456 N -0.18 0.73 -0.34 1.15 0.02 -1.41 -2.55 113.55 110.98 2qab h SER 456 Ca -0.27 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 2qab h SER 456 Cb 1.86 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 64.26 2qab h SER 456 CO 0.13 0.48 0.00 0.61 -1.14 0.00 0.00 176.83 176.91 2qab n GLY 457 N -1.31 1.62 0.33 -3.77 0.00 -1.26 -4.62 105.19 96.18 2qab n GLY 457 Ca 0.10 -0.62 -0.04 0.00 0.00 0.00 0.00 46.02 45.45 2qab n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2qab h VAL 458 N 3.75 1.25 -0.00 1.61 3.04 -1.60 -2.70 116.25 121.60 2qab h VAL 458 Ca 0.00 -0.78 0.00 0.00 -1.01 0.00 0.00 66.70 64.91 2qab h VAL 458 Cb 0.87 0.36 0.00 0.00 -2.01 0.00 0.00 31.29 30.51 2qab h VAL 458 CO 0.00 0.32 -0.09 -1.22 -1.01 0.00 0.00 177.57 175.56 2qab n TYR 459 N -4.29 0.00 0.70 3.17 4.01 -1.26 -2.77 117.16 116.72 2qab n TYR 459 Ca 0.07 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.91 2qab n TYR 459 Cb 0.18 -0.33 0.27 0.00 -0.31 0.00 0.00 39.34 39.15 2qab n TYR 459 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2qab n THR 460 N -1.31 0.45 0.00 -0.72 -2.24 -1.02 -5.25 114.28 104.19 2qab n THR 460 Ca 0.11 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2qab n THR 460 Cb 0.30 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 2qab n THR 460 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2qab n PHE 461 N 0.86 0.00 0.00 4.78 3.72 -1.11 -5.14 117.46 120.56 2qab n PHE 461 Ca 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.57 2qab n PHE 461 Cb 0.43 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.97 2qab n PHE 461 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 2qab n GLU 470 N 0.00 0.00 -0.18 -1.08 0.00 -1.26 -5.17 120.64 112.95 2qab n GLU 470 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 57.16 57.07 2qab n GLU 470 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 31.44 31.45 2qab n GLU 470 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 2qab h GLU 471 N 0.00 0.87 -0.55 3.44 9.09 -2.00 -2.58 114.58 122.85 2qab h GLU 471 Ca 0.00 -0.24 -0.10 0.00 0.05 0.00 0.00 59.36 59.07 2qab h GLU 471 Cb 0.00 -0.10 -0.02 0.00 -1.65 0.00 0.00 28.75 26.98 2qab h GLU 471 CO 0.00 0.86 -0.06 0.87 0.05 0.00 0.00 179.01 180.73 2qab h LYS 472 N 0.75 1.00 -0.65 1.06 1.57 -2.00 -2.90 116.57 115.39 2qab h LYS 472 Ca 0.16 -0.34 -0.04 0.00 -1.87 0.00 0.00 60.65 58.56 2qab h LYS 472 Cb 0.42 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 2qab h LYS 472 CO 0.01 1.01 0.26 0.22 -0.57 0.00 0.00 179.45 180.38 2qab h ASP 473 N 0.90 0.88 -0.29 0.86 3.58 -1.98 -2.10 116.42 118.27 2qab h ASP 473 Ca 0.15 -0.12 -0.15 0.00 0.42 0.00 0.00 57.03 57.33 2qab h ASP 473 Cb 0.61 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.43 2qab h ASP 473 CO 0.04 0.79 -0.42 -0.74 -2.88 0.00 0.00 179.24 176.02 2qab h HIS 474 N 0.94 0.98 -0.75 0.28 2.76 -1.36 -0.95 115.15 117.05 2qab h HIS 474 Ca 0.22 -0.33 -0.02 0.00 -2.20 0.00 0.00 60.37 58.04 2qab h HIS 474 Cb 0.19 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 28.92 2qab h HIS 474 CO 0.01 1.12 0.39 0.82 -1.30 0.00 0.00 177.93 178.98 2qab h ILE 475 N 0.55 1.23 0.00 6.26 2.04 -1.33 0.42 117.51 126.68 2qab h ILE 475 Ca 0.03 -0.61 -0.09 0.00 1.00 0.00 0.00 64.86 65.19 2qab h ILE 475 Cb 1.02 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 2qab h ILE 475 CO 0.10 0.26 -0.42 0.45 0.00 0.00 0.00 178.15 178.54 2qab h HIS 476 N 1.04 0.00 -0.19 1.37 3.86 -1.23 0.15 115.15 120.15 2qab h HIS 476 Ca 0.26 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.37 2qab h HIS 476 Cb 0.07 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.54 2qab h HIS 476 CO 0.00 0.42 -0.29 0.00 0.86 0.00 0.00 177.93 178.93 2qab h ARG 477 N 0.00 0.53 -0.47 2.45 3.08 -0.57 -1.71 114.38 117.69 2qab h ARG 477 Ca -0.00 -0.32 -0.09 0.00 0.07 0.00 0.00 59.98 59.64 2qab h ARG 477 Cb 0.78 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 2qab h ARG 477 CO 0.05 0.92 -0.07 0.28 -1.07 0.00 0.00 179.97 180.09 2qab h VAL 478 N 0.19 1.25 -0.73 2.04 2.07 -0.69 -2.36 116.25 118.03 2qab h VAL 478 Ca 0.02 -1.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 2qab h VAL 478 Cb 0.86 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 2qab h VAL 478 CO 0.07 0.39 0.43 -0.07 0.02 0.00 0.00 177.57 178.41 2qab h LEU 479 N 0.75 0.88 -0.55 2.57 3.38 -0.64 -1.98 115.31 119.72 2qab h LEU 479 Ca 0.13 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.08 2qab h LEU 479 Cb 0.55 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 2qab h LEU 479 CO 0.03 0.69 0.28 0.44 0.09 0.00 0.00 178.44 179.98 2qab h ASP 480 N 1.00 0.41 -0.58 -0.43 3.32 -1.01 -0.42 116.42 118.70 2qab h ASP 480 Ca 0.26 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 2qab h ASP 480 Cb -0.02 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 2qab h ASP 480 CO -0.05 0.28 0.36 0.11 -1.72 0.00 0.00 179.24 178.21 2qab h LYS 481 N 0.54 0.79 -0.01 3.56 1.79 -0.90 0.57 116.57 122.91 2qab h LYS 481 Ca 0.25 -0.06 -0.22 0.00 -2.18 0.00 0.00 60.65 58.43 2qab h LYS 481 Cb 0.16 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.64 2qab h LYS 481 CO -0.17 0.56 -0.91 0.82 -1.08 0.00 0.00 179.45 178.67 2qab h ILE 482 N 0.81 1.41 -0.40 1.86 2.04 -0.68 -0.24 117.51 122.31 2qab h ILE 482 Ca 0.21 -2.43 0.03 0.00 1.00 0.00 0.00 64.86 63.67 2qab h ILE 482 Cb -0.03 2.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 2qab h ILE 482 CO -0.04 0.72 0.20 0.74 0.00 0.00 0.00 178.15 179.77 2qab h THR 483 N 0.22 0.97 -0.93 -0.27 2.02 -0.53 -0.63 112.91 113.76 2qab h THR 483 Ca -0.07 -0.14 0.10 0.00 0.77 0.00 0.00 66.41 67.08 2qab h THR 483 Cb 1.54 0.54 -0.07 0.00 -1.74 0.00 0.00 68.15 68.41 2qab h THR 483 CO 0.16 0.07 0.60 0.44 0.37 0.00 0.00 175.52 177.16 2qab h ASP 484 N 0.40 0.85 -0.32 4.18 3.32 -0.62 -2.06 116.42 122.17 2qab h ASP 484 Ca 0.17 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 2qab h ASP 484 Cb 0.08 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 2qab h ASP 484 CO -0.12 0.49 -0.09 0.74 -1.72 0.00 0.00 179.24 178.53 2qab h THR 485 N 0.93 1.28 -0.61 0.35 2.02 -0.21 -1.38 112.91 115.29 2qab h THR 485 Ca 0.44 -1.15 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 2qab h THR 485 Cb 0.43 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 2qab h THR 485 CO -0.20 0.37 0.26 -0.07 0.37 0.00 0.00 175.52 176.25 2qab h LEU 486 N 0.40 0.82 -0.64 2.58 3.38 -0.60 -1.50 115.31 119.75 2qab h LEU 486 Ca 0.08 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 2qab h LEU 486 Cb 0.59 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2qab h LEU 486 CO 0.03 0.75 -0.04 0.40 0.09 0.00 0.00 178.44 179.68 2qab h ILE 487 N 0.84 1.26 -0.49 1.22 1.08 -1.40 -2.20 117.51 117.82 2qab h ILE 487 Ca 0.20 -1.18 0.06 0.00 -0.39 0.00 0.00 64.86 63.55 2qab h ILE 487 Cb 0.18 0.86 -0.05 0.00 -3.07 0.00 0.00 36.82 34.74 2qab h ILE 487 CO -0.02 0.42 0.19 -0.74 -0.69 0.00 0.00 178.15 177.32 2qab h HIS 488 N 0.93 0.34 -0.41 1.37 -0.00 -0.90 0.20 115.15 116.68 2qab h HIS 488 Ca 0.16 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.53 2qab h HIS 488 Cb 0.59 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.90 2qab h HIS 488 CO 0.04 0.13 0.15 -0.07 -0.00 0.00 0.00 177.93 178.18 2qab h LEU 489 N 0.38 0.52 0.21 0.26 3.38 -1.02 0.20 115.31 119.24 2qab h LEU 489 Ca 0.23 -0.06 -0.32 0.00 0.09 0.00 0.00 57.88 57.83 2qab h LEU 489 Cb 0.23 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 40.87 2qab h LEU 489 CO -0.22 0.49 -1.43 0.24 0.09 0.00 0.00 178.44 177.61 2qab h MET 490 N 0.58 0.44 0.05 1.13 2.86 -0.93 -1.97 114.93 117.08 2qab h MET 490 Ca 0.14 -0.75 -0.00 0.00 -2.06 0.00 0.00 59.70 57.03 2qab h MET 490 Cb 0.14 0.28 0.00 0.00 0.06 0.00 0.00 31.60 32.08 2qab h MET 490 CO -0.01 1.35 -0.02 0.00 1.06 0.00 0.00 176.91 179.29 2qab h ALA 491 N 0.31 -0.06 -0.83 6.32 0.00 -0.39 -2.16 119.26 122.45 2qab h ALA 491 Ca -0.22 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 54.85 2qab h ALA 491 Cb 2.10 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.86 2qab h ALA 491 CO 0.24 -0.53 0.55 -0.22 0.00 0.00 0.00 179.25 179.29 2qab h LYS 492 N -0.07 0.38 -0.02 0.00 3.64 -0.64 -0.17 116.57 119.68 2qab h LYS 492 Ca -0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2qab h LYS 492 Cb 0.06 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2qab h LYS 492 CO 0.01 0.25 0.00 0.00 -2.27 0.00 0.00 179.45 177.44 2qab n ALA 493 N -2.53 2.62 -0.40 5.00 0.00 -0.74 -4.89 120.51 119.56 2qab n ALA 493 Ca 0.17 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2qab n ALA 493 Cb 0.63 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2qab n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qab n GLY 494 N 0.94 0.75 3.77 0.00 0.00 -0.07 -5.05 105.19 105.52 2qab n GLY 494 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2qab n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qab s LEU 495 N 0.00 4.30 0.90 0.99 1.02 -0.86 -5.02 118.68 120.00 2qab s LEU 495 Ca 0.00 2.37 -0.11 0.00 0.02 0.00 0.00 54.13 56.41 2qab s LEU 495 Cb 0.00 -3.89 0.13 0.00 0.02 0.00 0.00 46.19 42.45 2qab s LEU 495 CO 0.00 -0.54 1.10 0.42 0.02 0.00 0.00 176.35 177.35 2qab s THR 496 N -1.33 2.64 0.18 5.49 -4.23 -1.26 -4.63 115.64 112.50 2qab s THR 496 Ca 0.53 0.21 -0.14 0.00 -1.18 0.00 0.00 61.69 61.11 2qab s THR 496 Cb -0.32 -2.55 0.10 0.00 1.34 0.00 0.00 72.50 71.07 2qab s THR 496 CO 0.41 -0.27 1.70 -0.07 -0.54 0.00 0.00 174.62 175.85 2qab h LEU 497 N -1.62 -0.11 -0.93 4.79 4.07 -1.98 0.30 115.31 119.82 2qab h LEU 497 Ca -0.48 0.10 0.04 0.00 0.08 0.00 0.00 57.88 57.61 2qab h LEU 497 Cb 1.27 0.16 -0.06 0.00 1.08 0.00 0.00 40.66 43.11 2qab h LEU 497 CO 0.50 -0.02 0.60 -0.61 -1.08 0.00 0.00 178.44 177.83 2qab h GLN 498 N 0.15 1.13 -0.10 1.13 4.15 -2.00 -1.18 115.11 118.39 2qab h GLN 498 Ca 0.23 -0.07 -0.15 0.00 0.77 0.00 0.00 58.65 59.43 2qab h GLN 498 Cb 0.32 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 2qab h GLN 498 CO -0.34 0.75 -0.58 1.96 -1.93 0.00 0.00 178.83 178.68 2qab h GLN 499 N 1.16 0.31 -0.19 1.69 4.20 -1.68 -2.02 115.11 118.57 2qab h GLN 499 Ca 0.37 -0.21 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 2qab h GLN 499 Cb 0.02 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 2qab h GLN 499 CO -0.12 0.80 0.08 1.96 -0.67 0.00 0.00 178.83 180.87 2qab h GLN 500 N 0.24 0.29 -0.41 1.46 4.20 0.20 -0.25 115.11 120.83 2qab h GLN 500 Ca -0.00 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.53 2qab h GLN 500 Cb 1.09 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 2qab h GLN 500 CO 0.09 0.36 -0.24 0.45 -0.67 0.00 0.00 178.83 178.83 2qab h HIS 501 N 0.16 0.98 -0.64 2.96 3.86 -1.19 -0.49 115.15 120.79 2qab h HIS 501 Ca 0.06 -0.24 -0.01 0.00 -1.16 0.00 0.00 60.37 59.03 2qab h HIS 501 Cb 0.18 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.39 2qab h HIS 501 CO -0.01 1.00 0.35 1.96 0.86 0.00 0.00 177.93 182.09 2qab h GLN 502 N 0.73 0.89 -0.29 2.45 4.20 -1.26 -2.04 115.11 119.80 2qab h GLN 502 Ca 0.09 -0.11 -0.15 0.00 0.06 0.00 0.00 58.65 58.55 2qab h GLN 502 Cb 0.78 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 2qab h GLN 502 CO 0.06 0.68 -0.44 -0.09 -0.67 0.00 0.00 178.83 178.37 2qab h ARG 503 N 0.87 0.72 -0.13 1.46 2.43 -0.93 -1.69 114.38 117.11 2qab h ARG 503 Ca 0.22 -0.39 0.02 0.00 -0.81 0.00 0.00 59.98 59.02 2qab h ARG 503 Cb 0.05 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 2qab h ARG 503 CO -0.04 1.01 0.01 1.25 -1.51 0.00 0.00 179.97 180.69 2qab h LEU 504 N 0.58 -0.03 -0.56 3.80 5.85 -0.90 -1.38 115.31 122.68 2qab h LEU 504 Ca 0.04 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2qab h LEU 504 Cb 0.99 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 2qab h LEU 504 CO 0.09 0.01 0.31 0.00 -0.34 0.00 0.00 178.44 178.51 2qab h ALA 505 N 1.10 0.72 -0.45 1.25 0.00 -1.31 -1.46 119.26 119.12 2qab h ALA 505 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.00 2qab h ALA 505 Cb 0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2qab h ALA 505 CO -0.09 0.00 0.24 1.96 0.00 0.00 0.00 179.25 181.36 2qab h GLN 506 N 0.61 0.46 -0.35 0.00 4.20 -0.99 -0.68 115.11 118.36 2qab h GLN 506 Ca 0.24 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.87 2qab h GLN 506 Cb 0.09 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2qab h GLN 506 CO -0.13 0.31 0.03 -0.07 -0.67 0.00 0.00 178.83 178.29 2qab h LEU 507 N 0.48 0.59 -1.26 1.46 3.38 -0.95 -2.99 115.31 116.02 2qab h LEU 507 Ca 0.19 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2qab h LEU 507 Cb 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2qab h LEU 507 CO -0.12 0.73 -0.32 -0.07 0.09 0.00 0.00 178.44 178.75 2qab h LEU 508 N 0.43 0.09 -1.22 1.67 3.38 -1.03 -2.64 115.31 115.98 2qab h LEU 508 Ca 0.10 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 2qab h LEU 508 Cb 0.41 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2qab h LEU 508 CO 0.01 0.41 -0.28 -0.07 0.09 0.00 0.00 178.44 178.60 2qab h LEU 509 N 0.08 0.00 -1.36 1.67 3.38 -0.99 -2.04 115.31 116.05 2qab h LEU 509 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2qab h LEU 509 Cb 0.61 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2qab h LEU 509 CO 0.04 0.28 -0.09 0.40 0.09 0.00 0.00 178.44 179.16 2qab h ILE 510 N 0.00 1.18 -0.18 1.22 2.04 -1.33 -2.38 117.51 118.06 2qab h ILE 510 Ca -0.00 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.11 2qab h ILE 510 Cb 0.71 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 2qab h ILE 510 CO 0.04 0.25 0.12 -0.07 0.00 0.00 0.00 178.15 178.48 2qab h LEU 511 N 0.30 0.14 -0.63 1.44 3.38 -1.39 0.24 115.31 118.78 2qab h LEU 511 Ca 0.06 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2qab h LEU 511 Cb 0.36 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2qab h LEU 511 CO 0.02 0.10 0.31 -1.28 0.09 0.00 0.00 178.44 177.67 2qab h SER 512 N 0.16 0.82 0.15 -0.43 0.87 -1.51 -0.89 113.55 112.72 2qab h SER 512 Ca 0.07 -0.13 -0.13 0.00 -1.23 0.00 0.00 61.79 60.38 2qab h SER 512 Cb 0.09 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2qab h SER 512 CO -0.01 0.72 -0.46 -0.74 -0.53 0.00 0.00 176.83 175.81 2qab h HIS 513 N 0.86 0.45 -0.55 2.24 -0.00 -1.05 -2.01 115.15 115.09 2qab h HIS 513 Ca 0.22 -0.14 -0.08 0.00 -0.00 0.00 0.00 60.37 60.37 2qab h HIS 513 Cb 0.11 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 27.41 2qab h HIS 513 CO 0.00 0.77 0.04 0.82 -0.00 0.00 0.00 177.93 179.56 2qab h ILE 514 N 0.30 1.26 -0.34 6.26 2.04 -0.90 -1.17 117.51 124.97 2qab h ILE 514 Ca 0.02 -1.05 0.03 0.00 1.00 0.00 0.00 64.86 64.87 2qab h ILE 514 Cb 0.93 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 2qab h ILE 514 CO 0.08 0.38 0.14 -0.09 0.00 0.00 0.00 178.15 178.66 2qab h ARG 515 N 0.83 0.29 -0.48 2.37 9.65 -1.05 -0.59 114.38 125.41 2qab h ARG 515 Ca 0.16 -0.02 0.09 0.00 -1.10 0.00 0.00 59.98 59.11 2qab h ARG 515 Cb 0.48 -0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 28.92 2qab h ARG 515 CO 0.02 0.19 0.06 1.25 2.80 0.00 0.00 179.97 184.29 2qab h HIS 516 N 0.30 0.08 -0.49 2.20 2.76 -0.99 -0.65 115.15 118.36 2qab h HIS 516 Ca 0.15 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.30 2qab h HIS 516 Cb 0.09 0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.07 2qab h HIS 516 CO -0.12 -0.05 0.11 0.52 -1.30 0.00 0.00 177.93 177.09 2qab h MET 517 N 0.18 0.80 -0.04 5.26 2.86 -0.88 -0.91 114.93 122.19 2qab h MET 517 Ca 0.24 -0.20 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 2qab h MET 517 Cb 0.34 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 2qab h MET 517 CO -0.35 0.78 -0.15 1.03 1.06 0.00 0.00 176.91 179.28 2qab h SER 518 N 0.68 -0.43 -0.52 1.22 0.87 -0.64 0.51 113.55 115.23 2qab h SER 518 Ca 0.15 0.07 0.05 0.00 -1.23 0.00 0.00 61.79 60.84 2qab h SER 518 Cb 0.34 0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 62.45 2qab h SER 518 CO 0.00 -0.20 0.25 0.78 -0.53 0.00 0.00 176.83 177.13 2qab h ASN 519 N -0.22 0.34 -0.46 6.23 2.35 -0.83 0.32 115.58 123.31 2qab h ASN 519 Ca 0.06 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 2qab h ASN 519 Cb 0.31 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 2qab h ASN 519 CO -0.17 0.23 0.23 0.11 -1.65 0.00 0.00 177.43 176.18 2qab h LYS 520 N 0.48 0.65 -0.82 0.81 6.56 -0.92 -2.66 116.57 120.67 2qab h LYS 520 Ca 0.24 -0.09 -0.03 0.00 -1.06 0.00 0.00 60.65 59.71 2qab h LYS 520 Cb 0.17 -0.12 -0.04 0.00 -0.57 0.00 0.00 32.23 31.68 2qab h LYS 520 CO -0.18 0.54 0.39 0.78 -2.06 0.00 0.00 179.45 178.91 2qab h GLY 521 N 0.60 1.27 0.99 3.86 0.00 0.83 -1.72 103.07 108.90 2qab h GLY 521 Ca 0.16 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 2qab h GLY 521 CO -0.02 0.60 0.32 1.98 0.00 0.00 0.00 176.54 179.42 2qab h MET 522 N 1.17 0.80 -0.31 4.80 -1.53 -0.23 0.91 114.93 120.55 2qab h MET 522 Ca 0.28 -0.09 -0.11 0.00 -3.44 0.00 0.00 59.70 56.34 2qab h MET 522 Cb 0.13 -0.16 -0.01 0.00 -0.55 0.00 0.00 31.60 31.00 2qab h MET 522 CO -0.03 0.60 -0.28 1.05 0.14 0.00 0.00 176.91 178.39 2qab h GLU 523 N 0.78 0.63 0.03 0.39 4.11 -1.17 -0.84 114.58 118.50 2qab h GLU 523 Ca 0.20 -0.26 -0.00 0.00 0.07 0.00 0.00 59.36 59.37 2qab h GLU 523 Cb 0.03 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2qab h GLU 523 CO -0.03 0.84 -0.02 1.25 0.07 0.00 0.00 179.01 181.12 2qab h HIS 524 N 0.54 -0.04 -0.98 2.06 2.76 -0.98 -0.06 115.15 118.45 2qab h HIS 524 Ca 0.07 -0.00 0.14 0.00 -2.20 0.00 0.00 60.37 58.38 2qab h HIS 524 Cb 0.75 0.01 -0.09 0.00 1.55 0.00 0.00 27.41 29.64 2qab h HIS 524 CO 0.03 0.18 0.62 1.25 -1.30 0.00 0.00 177.93 178.71 2qab h LEU 525 N -0.26 0.84 -0.45 0.26 5.85 -0.77 0.36 115.31 121.14 2qab h LEU 525 Ca -0.00 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 2qab h LEU 525 Cb 0.24 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2qab h LEU 525 CO 0.01 0.42 -0.08 0.22 -0.34 0.00 0.00 178.44 178.66 2qab h TYR 526 N 0.88 0.95 -0.24 1.25 3.20 -0.67 -2.07 116.97 120.27 2qab h TYR 526 Ca 0.50 -0.19 -0.00 0.00 3.14 0.00 0.00 58.73 62.17 2qab h TYR 526 Cb 0.62 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 2qab h TYR 526 CO -0.00 0.93 0.14 1.03 -1.64 0.00 0.00 178.16 178.62 2qab h SER 527 N 0.68 0.30 0.03 -2.11 0.87 -0.17 -1.00 113.55 112.15 2qab h SER 527 Ca 0.12 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2qab h SER 527 Cb 0.61 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2qab h SER 527 CO 0.04 0.28 -0.02 0.24 -0.53 0.00 0.00 176.83 176.84 2qab h MET 528 N 0.29 0.00 0.06 2.24 2.86 -0.86 0.31 114.93 119.83 2qab h MET 528 Ca 0.09 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.63 2qab h MET 528 Cb 0.04 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.71 2qab h MET 528 CO -0.01 0.02 -0.41 -0.22 1.06 0.00 0.00 176.91 177.34 2qab h LYS 529 N 0.00 0.17 -0.25 1.72 3.64 -0.98 -1.24 116.57 119.64 2qab h LYS 529 Ca -0.00 -0.26 -0.01 0.00 -1.27 0.00 0.00 60.65 59.11 2qab h LYS 529 Cb 0.04 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2qab h LYS 529 CO 0.00 1.10 0.13 0.00 -2.27 0.00 0.00 179.45 178.41 2qab n LYS 531 N -4.84 0.35 -3.69 0.00 5.02 0.08 -4.87 118.16 110.20 2qab n LYS 531 Ca -0.03 0.08 -0.27 0.00 -2.02 0.00 0.00 58.31 56.07 2qab n LYS 531 Cb 0.08 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.63 2qab n LYS 531 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2qab n ASN 532 N -1.17 -5.34 0.00 4.39 4.05 -0.48 -4.86 115.26 111.85 2qab n ASN 532 Ca 0.10 -0.63 0.14 0.00 0.45 0.00 0.00 54.58 54.64 2qab n ASN 532 Cb 0.10 -4.26 0.77 0.00 1.23 0.00 0.00 39.78 37.62 2qab n ASN 532 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 2qab n VAL 533 N -4.71 0.05 -3.64 3.44 0.24 -0.49 -4.82 118.33 108.39 2qab n VAL 533 Ca 0.02 0.01 -0.05 0.00 -2.04 0.00 0.00 64.34 62.28 2qab n VAL 533 Cb 0.55 -0.54 -0.07 0.00 -1.47 0.00 0.00 33.84 32.31 2qab n VAL 533 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2qab s VAL 534 N -2.42 0.00 0.28 3.34 0.11 -1.26 -4.50 120.40 115.96 2qab s VAL 534 Ca 0.32 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.07 2qab s VAL 534 Cb 0.20 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.95 2qab s VAL 534 CO 0.41 0.00 1.14 -2.16 -3.33 0.00 0.00 175.10 171.16 2qab s PRO 535 N 0.13 4.59 0.09 1.54 0.04 -1.26 -4.77 135.00 135.36 2qab s PRO 535 Ca 0.05 1.87 0.06 0.00 0.04 0.00 0.00 61.00 63.03 2qab s PRO 535 Cb -0.05 -3.17 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 2qab s PRO 535 CO -0.12 0.14 -0.08 -0.51 0.04 0.00 0.00 177.00 176.47 2qab s LEU 536 N -1.45 3.14 0.80 -3.56 1.43 -1.26 -4.98 118.68 112.80 2qab s LEU 536 Ca 0.45 -0.32 -0.11 0.00 -1.03 0.00 0.00 54.13 53.13 2qab s LEU 536 Cb -0.33 -1.91 0.08 0.00 0.03 0.00 0.00 46.19 44.05 2qab s LEU 536 CO 0.43 0.19 1.11 -0.94 0.23 0.00 0.00 176.35 177.36 2qab s SER 537 N -2.15 4.13 0.19 2.29 1.04 -1.26 -4.78 113.70 113.16 2qab s SER 537 Ca 0.22 1.93 -0.12 0.00 0.48 0.00 0.00 55.95 58.47 2qab s SER 537 Cb -0.11 -2.54 0.17 0.00 0.10 0.00 0.00 66.02 63.65 2qab s SER 537 CO 0.14 -2.29 1.78 0.44 0.98 0.00 0.00 173.24 174.30 2qab h ASP 538 N -1.24 0.38 -0.72 7.02 3.32 -1.99 -0.05 116.42 123.14 2qab h ASP 538 Ca -0.44 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.63 2qab h ASP 538 Cb 1.24 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.72 2qab h ASP 538 CO 0.49 0.26 0.39 0.25 -1.72 0.00 0.00 179.24 178.91 2qab h LEU 539 N 0.52 0.91 -0.38 1.55 5.85 -1.99 -1.51 115.31 120.26 2qab h LEU 539 Ca 0.25 -0.10 -0.14 0.00 0.84 0.00 0.00 57.88 58.73 2qab h LEU 539 Cb 0.18 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2qab h LEU 539 CO -0.18 0.75 -0.31 0.25 -0.34 0.00 0.00 178.44 178.60 2qab h LEU 540 N 1.00 0.93 -1.10 2.25 5.85 -1.80 -0.87 115.31 121.58 2qab h LEU 540 Ca 0.25 -0.45 0.08 0.00 0.84 0.00 0.00 57.88 58.60 2qab h LEU 540 Cb 0.04 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 40.75 2qab h LEU 540 CO -0.04 1.18 0.61 -0.07 -0.34 0.00 0.00 178.44 179.79 2qab h LEU 541 N 0.69 0.93 -0.44 2.25 3.38 -0.89 0.17 115.31 121.40 2qab h LEU 541 Ca 0.07 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 2qab h LEU 541 Cb 0.90 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2qab h LEU 541 CO 0.08 0.57 -0.30 -0.08 0.09 0.00 0.00 178.44 178.81 2qab h GLU 542 N 1.04 0.98 -0.18 1.13 4.81 -0.80 0.33 114.58 121.90 2qab h GLU 542 Ca 0.42 -0.46 -0.13 0.00 -0.13 0.00 0.00 59.36 59.06 2qab h GLU 542 Cb 0.27 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2qab h GLU 542 CO -0.18 1.13 -0.45 0.52 -0.73 0.00 0.00 179.01 179.30 2qab h MET 543 N 0.82 0.45 0.12 1.92 2.86 -0.69 -2.55 114.93 117.85 2qab h MET 543 Ca 0.09 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 2qab h MET 543 Cb 0.89 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.56 2qab h MET 543 CO 0.08 0.82 -0.06 1.25 1.06 0.00 0.00 176.91 180.06 2qab h LEU 544 N 0.36 -0.14 -1.97 1.22 5.85 -0.78 -3.20 115.31 116.66 2qab h LEU 544 Ca 0.02 -0.23 0.21 0.00 0.84 0.00 0.00 57.88 58.72 2qab h LEU 544 Cb 0.94 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2qab h LEU 544 CO 0.08 0.16 0.52 0.44 -0.34 0.00 0.00 178.44 179.30 2qab h ASP 545 N -0.44 0.03 0.39 1.25 3.45 -0.19 -2.08 116.42 118.83 2qab h ASP 545 Ca -0.02 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.44 2qab h ASP 545 Cb 0.36 -0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.13 2qab h ASP 545 CO 0.03 0.01 -0.03 0.00 -1.57 0.00 0.00 179.24 177.68 2qab h ALA 546 N 1.64 1.10 -0.07 3.45 0.00 -1.45 -2.50 119.26 121.43 2qab h ALA 546 Ca 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2qab h ALA 546 Cb 1.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2qab h ALA 546 CO -0.01 0.04 0.00 0.72 0.00 0.00 0.00 179.25 180.00 2qab n HIS 547 N -3.27 0.07 -1.64 0.00 8.25 -0.78 -5.02 115.22 112.84 2qab n HIS 547 Ca -0.02 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 2qab n HIS 547 Cb 0.18 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.29 2qab n HIS 547 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52