#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pcg n SER 305 N 0.00 0.00 0.24 0.53 2.88 -1.26 -4.85 113.62 111.15 1pcg n SER 305 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 1pcg n SER 305 Cb 0.00 0.00 0.42 0.00 -0.75 0.00 0.00 64.21 63.88 1pcg n SER 305 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1pcg h LEU 306 N 0.00 0.00 -1.78 2.46 6.46 -2.00 -2.87 115.31 117.58 1pcg h LEU 306 Ca 0.00 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 1pcg h LEU 306 Cb 0.00 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 39.93 1pcg h LEU 306 CO 0.00 0.09 -0.15 0.00 -0.62 0.00 0.00 178.44 177.76 1pcg h ALA 307 N 1.91 1.55 0.00 1.25 0.00 -1.93 -2.05 119.26 119.99 1pcg h ALA 307 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pcg h ALA 307 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1pcg h ALA 307 CO 0.01 0.19 0.00 1.28 0.00 0.00 0.00 179.25 180.73 1pcg n LEU 308 N -4.07 0.00 -0.20 0.00 4.77 -1.08 -3.22 117.00 113.20 1pcg n LEU 308 Ca -0.02 0.07 0.09 0.00 -0.03 0.00 0.00 56.01 56.12 1pcg n LEU 308 Cb 0.23 -0.07 0.16 0.00 -2.33 0.00 0.00 43.42 41.41 1pcg n LEU 308 CO 0.34 -0.01 0.57 -1.54 -1.33 0.00 0.00 177.39 175.42 1pcg n SER 309 N -1.07 2.48 -4.89 -1.43 3.41 -0.77 -5.02 113.62 106.33 1pcg n SER 309 Ca 0.19 -3.13 -0.30 0.00 -0.26 0.00 0.00 58.87 55.37 1pcg n SER 309 Cb 0.13 -0.45 -0.04 0.00 -0.26 0.00 0.00 64.21 63.59 1pcg n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pcg s LEU 310 N -2.90 4.03 0.26 1.04 1.43 -1.20 -5.08 118.68 116.26 1pcg s LEU 310 Ca 0.34 0.89 -0.06 0.00 -1.03 0.00 0.00 54.13 54.27 1pcg s LEU 310 Cb 0.29 -3.70 -0.06 0.00 0.03 0.00 0.00 46.19 42.75 1pcg s LEU 310 CO 0.03 -0.21 0.53 0.42 0.23 0.00 0.00 176.35 177.34 1pcg s THR 311 N -2.08 5.03 0.35 5.49 -4.23 -1.26 -4.84 115.64 114.10 1pcg s THR 311 Ca 0.47 0.12 0.15 0.00 -1.18 0.00 0.00 61.69 61.25 1pcg s THR 311 Cb -0.11 -3.70 0.35 0.00 1.34 0.00 0.00 72.50 70.39 1pcg s THR 311 CO 0.27 -0.23 1.60 0.00 -0.54 0.00 0.00 174.62 175.73 1pcg h ALA 312 N 1.99 1.89 -0.25 3.99 0.00 -1.95 0.62 119.26 125.55 1pcg h ALA 312 Ca -0.47 0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1pcg h ALA 312 Cb 1.18 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1pcg h ALA 312 CO 0.68 -0.77 -0.44 -0.44 0.00 0.00 0.00 179.25 178.27 1pcg h ASP 313 N 0.09 0.67 -0.25 0.00 3.32 -1.96 -1.18 116.42 117.11 1pcg h ASP 313 Ca 0.76 -0.31 -0.05 0.00 0.02 0.00 0.00 57.03 57.44 1pcg h ASP 313 Cb 1.86 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 41.22 1pcg h ASP 313 CO -0.75 1.02 -0.05 1.56 -1.72 0.00 0.00 179.24 179.29 1pcg h GLN 314 N 0.50 0.47 -0.07 3.56 4.20 -0.28 -1.20 115.11 122.30 1pcg h GLN 314 Ca 0.03 -0.18 0.04 0.00 0.06 0.00 0.00 58.65 58.60 1pcg h GLN 314 Cb 0.97 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.67 1pcg h GLN 314 CO 0.09 0.69 -0.23 1.98 -0.67 0.00 0.00 178.83 180.69 1pcg h MET 315 N 0.22 -0.31 -0.50 1.46 4.05 -0.57 0.27 114.93 119.55 1pcg h MET 315 Ca 0.06 0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.55 1pcg h MET 315 Cb 0.51 0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 31.34 1pcg h MET 315 CO 0.02 -0.21 0.24 0.28 0.23 0.00 0.00 176.91 177.48 1pcg h VAL 316 N -0.32 0.94 -0.31 -5.77 2.07 -1.17 -1.60 116.25 110.09 1pcg h VAL 316 Ca 0.08 -0.16 0.05 0.00 0.82 0.00 0.00 66.70 67.48 1pcg h VAL 316 Cb 0.44 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 1pcg h VAL 316 CO -0.25 0.09 0.05 0.28 0.02 0.00 0.00 177.57 177.76 1pcg h SER 317 N 0.47 -0.01 -0.10 0.57 0.02 -0.29 0.10 113.55 114.32 1pcg h SER 317 Ca 0.23 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.27 1pcg h SER 317 Cb 0.15 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.73 1pcg h SER 317 CO -0.17 0.03 -0.15 0.00 -1.14 0.00 0.00 176.83 175.40 1pcg h ALA 318 N 1.24 -0.09 -0.67 3.77 0.00 0.01 -1.36 119.26 122.16 1pcg h ALA 318 Ca 0.15 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1pcg h ALA 318 Cb 0.17 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1pcg h ALA 318 CO -0.20 -0.61 0.44 -0.07 0.00 0.00 0.00 179.25 178.81 1pcg h LEU 319 N -0.19 0.76 -1.39 0.00 3.38 -0.77 -1.60 115.31 115.50 1pcg h LEU 319 Ca 0.08 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1pcg h LEU 319 Cb 0.31 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1pcg h LEU 319 CO -0.22 0.55 -0.17 -0.07 0.09 0.00 0.00 178.44 178.62 1pcg h LEU 320 N 0.90 0.18 -0.35 1.67 3.38 -0.60 -2.93 115.31 117.57 1pcg h LEU 320 Ca 0.25 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 1pcg h LEU 320 Cb -0.09 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1pcg h LEU 320 CO -0.06 0.37 0.01 -0.78 0.09 0.00 0.00 178.44 178.08 1pcg h ASP 321 N 0.18 0.60 0.48 -0.43 -0.00 -0.40 -3.13 116.42 113.72 1pcg h ASP 321 Ca 0.03 -0.30 0.00 0.00 -0.00 0.00 0.00 57.03 56.77 1pcg h ASP 321 Cb 0.41 -0.16 0.00 0.00 -0.00 0.00 0.00 39.33 39.58 1pcg h ASP 321 CO 0.03 0.75 0.00 0.00 -0.00 0.00 0.00 179.24 180.01 1pcg n ALA 322 N -2.38 1.85 -1.62 -0.78 0.00 -0.68 -4.88 120.51 112.01 1pcg n ALA 322 Ca -0.02 -0.07 -0.49 0.00 0.00 0.00 0.00 53.44 52.87 1pcg n ALA 322 Cb 0.26 -1.28 -0.05 0.00 0.00 0.00 0.00 19.45 18.39 1pcg n ALA 322 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1pcg n GLU 323 N -1.41 1.57 -1.83 0.00 -0.58 -1.18 -4.59 120.64 112.60 1pcg n GLU 323 Ca 0.06 0.56 -0.30 0.00 -0.42 0.00 0.00 57.16 57.06 1pcg n GLU 323 Cb 0.18 -2.22 0.05 0.00 -0.57 0.00 0.00 31.44 28.88 1pcg n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1pcg s PRO 324 N 0.34 2.74 0.60 3.49 0.04 -1.26 -5.05 135.00 135.90 1pcg s PRO 324 Ca 0.79 0.49 -0.15 0.00 0.04 0.00 0.00 61.00 62.16 1pcg s PRO 324 Cb -0.81 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.69 1pcg s PRO 324 CO 0.45 -1.13 1.06 -1.25 0.04 0.00 0.00 177.00 176.18 1pcg s PRO 325 N -5.33 3.26 -0.68 0.56 0.04 -1.26 -4.99 135.00 126.61 1pcg s PRO 325 Ca 0.59 1.20 -0.20 0.00 0.04 0.00 0.00 61.00 62.63 1pcg s PRO 325 Cb -0.12 -2.02 0.10 0.00 0.04 0.00 0.00 34.50 32.50 1pcg s PRO 325 CO 0.52 -0.86 0.88 0.42 0.04 0.00 0.00 177.00 178.01 1pcg s ILE 326 N -2.47 4.61 0.66 0.56 1.01 -1.26 -5.03 121.20 119.27 1pcg s ILE 326 Ca 0.64 -0.84 -0.16 0.00 0.00 0.00 0.00 60.65 60.28 1pcg s ILE 326 Cb -0.16 -4.62 0.00 0.00 0.01 0.00 0.00 42.46 37.69 1pcg s ILE 326 CO 0.38 -1.33 1.18 -0.76 0.00 0.00 0.00 174.94 174.42 1pcg s LEU 327 N 3.23 3.47 0.09 2.97 1.43 -1.26 -4.90 118.68 123.71 1pcg s LEU 327 Ca 0.19 2.28 0.02 0.00 -1.03 0.00 0.00 54.13 55.59 1pcg s LEU 327 Cb -0.18 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.42 1pcg s LEU 327 CO 0.05 -1.85 0.18 -0.31 0.23 0.00 0.00 176.35 174.65 1pcg s TYR 328 N -1.92 3.39 0.30 0.29 1.51 -1.26 -4.32 117.35 115.34 1pcg s TYR 328 Ca 0.74 0.16 -0.29 0.00 -1.01 0.00 0.00 57.07 56.66 1pcg s TYR 328 Cb -0.27 -1.69 -0.10 0.00 -0.11 0.00 0.00 41.96 39.79 1pcg s TYR 328 CO 0.39 0.55 1.18 0.45 -1.11 0.00 0.00 175.55 177.02 1pcg s SER 329 N -2.63 7.07 -0.35 2.29 0.15 -1.26 -4.91 113.70 114.06 1pcg s SER 329 Ca 0.33 2.43 -0.00 0.00 0.70 0.00 0.00 55.95 59.41 1pcg s SER 329 Cb -0.12 -2.64 0.30 0.00 -1.71 0.00 0.00 66.02 61.85 1pcg s SER 329 CO 0.26 -0.30 1.88 -0.62 1.20 0.00 0.00 173.24 175.66 1pcg n GLU 330 N 1.07 1.90 -3.57 5.44 1.02 -1.26 -4.80 120.64 120.44 1pcg n GLU 330 Ca -0.01 -1.85 -0.07 0.00 -0.02 0.00 0.00 57.16 55.21 1pcg n GLU 330 Cb 0.44 -1.73 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 1pcg n GLU 330 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1pcg s TYR 331 N -2.12 -0.25 -0.14 -0.32 4.12 -1.26 -5.15 117.35 112.22 1pcg s TYR 331 Ca 0.36 0.31 0.00 0.00 0.02 0.00 0.00 57.07 57.76 1pcg s TYR 331 Cb 0.29 0.49 0.02 0.00 -1.52 0.00 0.00 41.96 41.24 1pcg s TYR 331 CO 0.01 -0.31 -0.14 0.34 0.02 0.00 0.00 175.55 175.48 1pcg s ASP 332 N -1.70 2.60 0.18 2.29 3.68 -1.26 -5.01 116.67 117.45 1pcg s ASP 332 Ca 0.04 -0.46 -0.15 0.00 2.13 0.00 0.00 52.55 54.12 1pcg s ASP 332 Cb -0.01 -1.13 0.15 0.00 -1.45 0.00 0.00 42.92 40.48 1pcg s ASP 332 CO -0.04 -0.05 1.69 1.55 0.13 0.00 0.00 175.17 178.45 1pcg h PRO 333 N 7.98 0.12 0.00 4.34 0.13 -2.00 -3.53 132.00 139.03 1pcg h PRO 333 Ca -0.36 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1pcg h PRO 333 Cb 1.14 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1pcg h PRO 333 CO 0.51 0.08 0.00 -2.37 -0.23 0.00 0.00 178.00 175.99 1pcg n THR 334 N -5.20 0.00 -1.37 1.56 5.66 -1.26 -5.07 114.28 108.60 1pcg n THR 334 Ca 0.04 0.00 -0.55 0.00 -3.05 0.00 0.00 64.05 60.50 1pcg n THR 334 Cb 0.24 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.93 1pcg n THR 334 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1pcg n PRO 336 N 0.00 0.64 -1.62 1.09 -0.02 -1.26 -5.14 135.00 128.68 1pcg n PRO 336 Ca 0.00 0.17 -0.29 0.00 -2.02 0.00 0.00 63.50 61.36 1pcg n PRO 336 Cb 0.00 -2.07 0.14 0.00 -0.02 0.00 0.00 33.50 31.55 1pcg n PRO 336 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1pcg s PHE 337 N 6.76 2.35 0.03 6.00 0.08 -1.26 -5.07 117.98 126.86 1pcg s PHE 337 Ca 1.14 0.74 -0.14 0.00 0.12 0.00 0.00 56.93 58.79 1pcg s PHE 337 Cb -1.12 -3.50 0.02 0.00 -0.57 0.00 0.00 43.02 37.85 1pcg s PHE 337 CO 0.56 -2.39 0.31 -1.54 -0.10 0.00 0.00 175.22 172.06 1pcg s SER 338 N -4.23 -0.15 0.30 1.36 1.04 -1.26 -5.00 113.70 105.76 1pcg s SER 338 Ca 0.65 -0.12 0.04 0.00 0.48 0.00 0.00 55.95 57.00 1pcg s SER 338 Cb -0.12 0.36 0.66 0.00 0.10 0.00 0.00 66.02 67.01 1pcg s SER 338 CO 0.53 -0.59 1.83 -0.08 0.98 0.00 0.00 173.24 175.90 1pcg h GLU 339 N 3.32 0.85 0.06 4.02 4.81 -1.96 0.39 114.58 126.07 1pcg h GLU 339 Ca -0.31 -0.05 -0.25 0.00 -0.13 0.00 0.00 59.36 58.61 1pcg h GLU 339 Cb 1.19 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 30.39 1pcg h GLU 339 CO 0.45 0.56 -1.08 0.00 -0.73 0.00 0.00 179.01 178.21 1pcg h ALA 340 N 1.58 0.22 -0.03 2.92 0.00 -1.90 -2.66 119.26 119.38 1pcg h ALA 340 Ca 0.51 -0.77 -0.21 0.00 0.00 0.00 0.00 54.91 54.44 1pcg h ALA 340 Cb 0.65 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1pcg h ALA 340 CO -0.28 0.83 -0.87 0.66 0.00 0.00 0.00 179.25 179.59 1pcg h SER 341 N 0.20 0.55 0.17 0.00 4.64 -1.78 -2.46 113.55 114.86 1pcg h SER 341 Ca -0.12 -0.41 -0.01 0.00 -0.47 0.00 0.00 61.79 60.78 1pcg h SER 341 Cb 1.75 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 1pcg h SER 341 CO 0.19 1.19 -0.08 -0.03 -0.87 0.00 0.00 176.83 177.23 1pcg h MET 342 N 0.27 -0.22 0.00 4.77 -1.53 -1.02 -1.74 114.93 115.47 1pcg h MET 342 Ca -0.06 0.01 -0.01 0.00 -3.44 0.00 0.00 59.70 56.20 1pcg h MET 342 Cb 1.49 0.05 -0.00 0.00 -0.55 0.00 0.00 31.60 32.58 1pcg h MET 342 CO 0.15 0.08 -0.04 0.52 0.14 0.00 0.00 176.91 177.77 1pcg h MET 343 N -0.51 0.00 0.02 0.39 2.07 -1.54 -0.84 114.93 114.52 1pcg h MET 343 Ca -0.02 0.00 -0.22 0.00 -2.07 0.00 0.00 59.70 57.39 1pcg h MET 343 Cb 0.39 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.12 1pcg h MET 343 CO 0.04 0.04 -0.97 0.78 1.07 0.00 0.00 176.91 177.87 1pcg h GLY 344 N 0.14 0.29 0.56 8.32 0.00 -1.26 -2.05 103.07 109.07 1pcg h GLY 344 Ca -0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.76 1pcg h GLY 344 CO 0.00 0.49 -0.15 -2.00 0.00 0.00 0.00 176.54 174.88 1pcg h LEU 345 N 0.13 -0.37 -0.74 3.11 6.46 -0.35 -0.89 115.31 122.66 1pcg h LEU 345 Ca -0.07 -0.18 -0.04 0.00 -0.12 0.00 0.00 57.88 57.47 1pcg h LEU 345 Cb 1.62 0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 41.61 1pcg h LEU 345 CO 0.15 0.06 0.30 -0.07 -0.62 0.00 0.00 178.44 178.26 1pcg h LEU 346 N -0.88 1.02 -0.80 2.25 3.38 -1.32 -2.25 115.31 116.71 1pcg h LEU 346 Ca -0.04 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.63 1pcg h LEU 346 Cb 0.52 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1pcg h LEU 346 CO 0.07 0.91 -0.45 0.00 0.09 0.00 0.00 178.44 179.06 1pcg h THR 347 N 1.06 1.32 -0.22 0.22 1.03 -1.44 -1.57 112.91 113.32 1pcg h THR 347 Ca 0.25 -1.63 -0.03 0.00 -0.01 0.00 0.00 66.41 64.98 1pcg h THR 347 Cb 0.20 1.72 -0.01 0.00 -1.07 0.00 0.00 68.15 68.99 1pcg h THR 347 CO -0.02 0.49 0.01 -1.13 -0.01 0.00 0.00 175.52 174.86 1pcg h ASN 348 N 0.27 0.37 -0.37 0.00 -0.73 -0.89 -1.83 115.58 112.41 1pcg h ASN 348 Ca 0.02 -0.30 -0.00 0.00 1.87 0.00 0.00 56.30 57.89 1pcg h ASN 348 Cb 0.90 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 39.38 1pcg h ASN 348 CO 0.07 0.58 0.23 0.25 -0.37 0.00 0.00 177.43 178.20 1pcg h LEU 349 N 0.15 0.44 -0.34 0.34 5.85 -1.27 -2.85 115.31 117.63 1pcg h LEU 349 Ca 0.06 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1pcg h LEU 349 Cb 0.39 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1pcg h LEU 349 CO 0.01 0.35 0.22 0.00 -0.34 0.00 0.00 178.44 178.68 1pcg h ALA 350 N 1.11 0.43 -0.53 1.25 0.00 -1.20 -1.89 119.26 118.42 1pcg h ALA 350 Ca 0.13 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.09 1pcg h ALA 350 Cb -0.01 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.58 1pcg h ALA 350 CO -0.03 -0.09 0.20 0.22 0.00 0.00 0.00 179.25 179.55 1pcg h ASP 351 N 0.46 0.20 -0.09 0.00 1.82 -1.16 -1.26 116.42 116.39 1pcg h ASP 351 Ca 0.12 0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.83 1pcg h ASP 351 Cb -0.04 0.04 -0.00 0.00 0.68 0.00 0.00 39.33 40.01 1pcg h ASP 351 CO -0.03 0.14 0.04 0.03 -1.61 0.00 0.00 179.24 177.81 1pcg h ARG 352 N 0.38 0.13 -0.52 0.28 3.08 -1.29 -2.65 114.38 113.79 1pcg h ARG 352 Ca 0.26 -0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.44 1pcg h ARG 352 Cb 0.29 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1pcg h ARG 352 CO -0.26 0.22 0.41 0.93 -1.07 0.00 0.00 179.97 180.20 1pcg h GLU 353 N 0.01 0.00 -0.00 0.04 5.08 -0.78 0.34 114.58 119.27 1pcg h GLU 353 Ca 0.03 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 1pcg h GLU 353 Cb 0.14 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1pcg h GLU 353 CO -0.00 0.00 -0.37 -0.07 -1.00 0.00 0.00 179.01 177.57 1pcg h LEU 354 N 0.00 0.00 -0.01 1.33 3.38 -0.87 0.13 115.31 119.28 1pcg h LEU 354 Ca 0.25 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1pcg h LEU 354 Cb 1.06 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 1pcg h LEU 354 CO -0.00 0.37 -0.01 0.58 0.09 0.00 0.00 178.44 179.47 1pcg h VAL 355 N 0.00 1.37 -0.59 1.22 2.07 -0.98 -1.63 116.25 117.71 1pcg h VAL 355 Ca -0.00 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.40 1pcg h VAL 355 Cb 0.65 2.09 -0.03 0.00 -1.52 0.00 0.00 31.29 32.48 1pcg h VAL 355 CO 0.05 0.29 0.26 0.45 0.02 0.00 0.00 177.57 178.63 1pcg h HIS 356 N -0.43 0.83 -0.30 1.57 3.86 -1.47 -2.49 115.15 116.72 1pcg h HIS 356 Ca 0.00 -0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.21 1pcg h HIS 356 Cb 0.47 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.65 1pcg h HIS 356 CO 0.09 0.63 0.09 1.98 0.86 0.00 0.00 177.93 181.57 1pcg h MET 357 N 0.83 0.21 -0.87 2.45 -1.53 -0.53 -0.13 114.93 115.36 1pcg h MET 357 Ca 0.20 -0.01 0.07 0.00 -3.44 0.00 0.00 59.70 56.52 1pcg h MET 357 Cb 0.12 -0.05 -0.06 0.00 -0.55 0.00 0.00 31.60 31.07 1pcg h MET 357 CO -0.02 0.14 0.57 0.82 0.14 0.00 0.00 176.91 178.55 1pcg h ILE 358 N 0.22 1.04 -0.29 1.77 2.04 -0.86 0.54 117.51 121.97 1pcg h ILE 358 Ca 0.13 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1pcg h ILE 358 Cb 0.11 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 1pcg h ILE 358 CO -0.15 0.17 0.05 0.78 0.00 0.00 0.00 178.15 179.00 1pcg h ASN 359 N 0.96 0.46 -0.50 1.72 2.35 -0.96 -2.95 115.58 116.66 1pcg h ASN 359 Ca 0.38 -0.26 0.04 0.00 -0.55 0.00 0.00 56.30 55.91 1pcg h ASN 359 Cb 0.24 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.45 1pcg h ASN 359 CO -0.14 0.61 0.26 -0.25 -1.65 0.00 0.00 177.43 176.25 1pcg h TRP 360 N 0.30 0.48 -0.97 1.19 7.01 0.26 -2.47 115.95 121.75 1pcg h TRP 360 Ca 0.09 0.02 0.09 0.00 2.11 0.00 0.00 58.89 61.20 1pcg h TRP 360 Cb 0.34 -0.14 -0.07 0.00 -2.10 0.00 0.00 29.16 27.19 1pcg h TRP 360 CO 0.02 0.24 0.62 0.00 -2.79 0.00 0.00 178.44 176.54 1pcg h ALA 361 N 1.26 1.50 0.00 2.65 0.00 -0.86 0.53 119.26 124.34 1pcg h ALA 361 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1pcg h ALA 361 Cb 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1pcg h ALA 361 CO -0.14 0.31 0.00 1.63 0.00 0.00 0.00 179.25 181.05 1pcg n LYS 362 N -4.54 0.14 0.00 0.00 5.02 -0.93 -2.03 118.16 115.82 1pcg n LYS 362 Ca 0.16 0.54 0.08 0.00 -2.02 0.00 0.00 58.31 57.07 1pcg n LYS 362 Cb 0.27 -1.88 -0.05 0.00 -0.02 0.00 0.00 35.03 33.35 1pcg n LYS 362 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1pcg n ARG 363 N -2.17 1.49 -2.48 1.97 1.74 0.16 -4.63 116.66 112.73 1pcg n ARG 363 Ca 0.00 -0.44 -0.43 0.00 -0.77 0.00 0.00 57.85 56.22 1pcg n ARG 363 Cb 0.11 -1.31 -0.02 0.00 -1.02 0.00 0.00 32.46 30.21 1pcg n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1pcg s VAL 364 N -2.32 4.36 0.12 1.55 1.01 -0.86 -4.84 120.40 119.41 1pcg s VAL 364 Ca 0.11 1.66 -0.34 0.00 0.00 0.00 0.00 61.98 63.40 1pcg s VAL 364 Cb 0.14 -4.07 -0.17 0.00 0.00 0.00 0.00 36.38 32.27 1pcg s VAL 364 CO 0.57 -0.09 0.99 -2.65 0.00 0.00 0.00 175.10 173.92 1pcg n PRO 365 N 6.04 0.51 0.00 2.72 -0.02 -1.26 -1.42 135.00 141.56 1pcg n PRO 365 Ca 0.12 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1pcg n PRO 365 Cb 0.46 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 1pcg n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pcg n GLY 366 N 1.85 2.94 0.28 -1.23 0.00 -1.26 -4.89 105.19 102.89 1pcg n GLY 366 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 1pcg n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1pcg h PHE 367 N 0.00 -0.61 0.00 1.61 3.57 -1.53 -3.05 116.94 116.93 1pcg h PHE 367 Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1pcg h PHE 367 Cb 0.00 0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1pcg h PHE 367 CO 0.00 -0.29 0.08 -0.39 -2.23 0.00 0.00 178.31 175.48 1pcg h VAL 368 N -0.91 0.00 0.00 1.41 -1.51 -1.82 -0.80 116.25 112.61 1pcg h VAL 368 Ca -0.07 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1pcg h VAL 368 Cb 0.59 0.82 0.00 0.00 -2.13 0.00 0.00 31.29 30.57 1pcg h VAL 368 CO 0.11 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.92 1pcg n ASP 369 N -2.86 0.00 -4.92 4.19 8.00 -1.15 -4.74 116.55 115.06 1pcg n ASP 369 Ca -0.02 0.36 -0.26 0.00 0.71 0.00 0.00 54.79 55.57 1pcg n ASP 369 Cb 0.13 -0.43 0.02 0.00 -0.02 0.00 0.00 41.12 40.82 1pcg n ASP 369 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1pcg s LEU 370 N -2.86 3.42 0.77 0.64 1.43 -0.31 -5.07 118.68 116.70 1pcg s LEU 370 Ca 0.10 0.65 -0.11 0.00 -1.03 0.00 0.00 54.13 53.75 1pcg s LEU 370 Cb 0.11 -3.52 0.06 0.00 0.03 0.00 0.00 46.19 42.87 1pcg s LEU 370 CO 0.29 -0.87 1.09 0.42 0.23 0.00 0.00 176.35 177.50 1pcg s THR 371 N -2.83 3.36 0.36 5.49 -4.23 -1.26 -4.80 115.64 111.73 1pcg s THR 371 Ca 0.51 0.44 0.04 0.00 -1.18 0.00 0.00 61.69 61.51 1pcg s THR 371 Cb -0.10 -2.95 0.28 0.00 1.34 0.00 0.00 72.50 71.06 1pcg s THR 371 CO 0.43 -0.58 2.00 0.25 -0.54 0.00 0.00 174.62 176.18 1pcg h LEU 372 N -1.11 0.66 -0.35 4.79 5.85 -1.97 -0.21 115.31 122.97 1pcg h LEU 372 Ca -0.44 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.21 1pcg h LEU 372 Cb 1.23 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 1pcg h LEU 372 CO 0.52 0.46 -0.04 -0.74 -0.34 0.00 0.00 178.44 178.30 1pcg h HIS 373 N 0.77 0.72 -0.27 1.25 2.76 -1.99 -0.90 115.15 117.49 1pcg h HIS 373 Ca 0.25 -0.14 -0.14 0.00 -2.20 0.00 0.00 60.37 58.15 1pcg h HIS 373 Cb 0.06 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.82 1pcg h HIS 373 CO -0.00 0.78 -0.40 -0.44 -1.30 0.00 0.00 177.93 176.56 1pcg h ASP 374 N 0.45 0.68 0.02 3.26 3.32 -1.79 -1.60 116.42 120.76 1pcg h ASP 374 Ca 0.10 -0.31 -0.00 0.00 0.02 0.00 0.00 57.03 56.84 1pcg h ASP 374 Cb 0.51 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1pcg h ASP 374 CO 0.03 1.00 -0.01 1.56 -1.72 0.00 0.00 179.24 180.10 1pcg h GLN 375 N 0.53 -0.02 -0.24 3.56 4.20 -0.97 0.10 115.11 122.26 1pcg h GLN 375 Ca 0.04 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.81 1pcg h GLN 375 Cb 0.92 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.66 1pcg h GLN 375 CO 0.08 0.06 -0.07 0.28 -0.67 0.00 0.00 178.83 178.51 1pcg h VAL 376 N -0.10 0.73 -0.89 -0.54 2.07 -1.07 -2.33 116.25 114.13 1pcg h VAL 376 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1pcg h VAL 376 Cb 0.09 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 1pcg h VAL 376 CO 0.00 0.00 0.59 -0.74 0.02 0.00 0.00 177.57 177.44 1pcg h HIS 377 N -0.02 1.11 -0.43 1.57 -0.00 -1.01 -1.85 115.15 114.52 1pcg h HIS 377 Ca 0.12 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.50 1pcg h HIS 377 Cb 0.20 -0.37 -0.02 0.00 -0.00 0.00 0.00 27.41 27.21 1pcg h HIS 377 CO -0.26 0.69 0.19 -0.07 -0.00 0.00 0.00 177.93 178.49 1pcg h LEU 378 N 1.19 0.57 -0.62 0.26 3.38 -0.38 -2.54 115.31 117.16 1pcg h LEU 378 Ca 0.33 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 58.01 1pcg h LEU 378 Cb -0.12 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1pcg h LEU 378 CO -0.08 0.55 -0.52 -0.07 0.09 0.00 0.00 178.44 178.41 1pcg h LEU 379 N 0.55 0.49 -1.03 1.67 3.38 -1.26 -1.81 115.31 117.29 1pcg h LEU 379 Ca 0.15 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 1pcg h LEU 379 Cb 0.14 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1pcg h LEU 379 CO -0.02 0.92 -0.03 -0.33 0.09 0.00 0.00 178.44 179.08 1pcg h GLU 380 N 0.35 0.66 0.00 1.13 5.08 -1.32 0.31 114.58 120.79 1pcg h GLU 380 Ca 0.01 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.12 1pcg h GLU 380 Cb 1.03 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1pcg h GLU 380 CO 0.09 0.70 -0.39 1.03 -1.00 0.00 0.00 179.01 179.45 1pcg h SER 381 N 0.62 0.00 0.00 1.42 0.87 -1.26 -3.38 113.55 111.81 1pcg h SER 381 Ca 0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1pcg h SER 381 Cb 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1pcg h SER 381 CO 0.02 0.36 0.00 0.00 -0.53 0.00 0.00 176.83 176.68 1pcg n ALA 382 N -2.19 2.21 -0.28 6.23 0.00 -0.70 -4.82 120.51 120.96 1pcg n ALA 382 Ca 0.02 -0.38 0.09 0.00 0.00 0.00 0.00 53.44 53.17 1pcg n ALA 382 Cb 0.68 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.37 1pcg n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1pcg h TRP 383 N 0.00 0.31 -0.26 0.00 5.08 -1.13 0.32 115.95 120.26 1pcg h TRP 383 Ca 0.00 0.05 -0.19 0.00 1.08 0.00 0.00 58.89 59.82 1pcg h TRP 383 Cb 0.04 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 26.19 1pcg h TRP 383 CO 0.00 -0.15 -0.60 1.25 -1.28 0.00 0.00 178.44 177.66 1pcg h LEU 384 N 0.24 0.97 -0.70 0.11 5.85 -1.88 -0.51 115.31 119.39 1pcg h LEU 384 Ca 0.49 -0.54 0.03 0.00 0.84 0.00 0.00 57.88 58.70 1pcg h LEU 384 Cb 0.91 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.62 1pcg h LEU 384 CO -0.59 1.35 0.43 -0.33 -0.34 0.00 0.00 178.44 178.96 1pcg h GLU 385 N 0.65 0.82 -0.57 1.25 5.08 -1.62 0.32 114.58 120.50 1pcg h GLU 385 Ca 0.00 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1pcg h GLU 385 Cb 1.21 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 1pcg h GLU 385 CO 0.13 0.54 -0.02 0.82 -1.00 0.00 0.00 179.01 179.48 1pcg h ILE 386 N 0.84 1.26 -0.57 3.13 2.04 -0.80 -0.28 117.51 123.14 1pcg h ILE 386 Ca 0.29 -1.15 -0.11 0.00 1.00 0.00 0.00 64.86 64.89 1pcg h ILE 386 Cb 0.04 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1pcg h ILE 386 CO -0.12 0.41 -0.06 -0.07 0.00 0.00 0.00 178.15 178.32 1pcg h LEU 387 N 0.92 1.04 -0.10 1.44 3.38 -0.36 -2.52 115.31 119.11 1pcg h LEU 387 Ca 0.16 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 1pcg h LEU 387 Cb 0.56 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1pcg h LEU 387 CO 0.03 1.12 0.02 0.24 0.09 0.00 0.00 178.44 179.94 1pcg h MET 388 N 0.93 0.16 -0.24 1.13 2.86 -0.10 -1.16 114.93 118.52 1pcg h MET 388 Ca 0.15 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.71 1pcg h MET 388 Cb 0.62 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1pcg h MET 388 CO 0.04 0.36 -0.04 0.97 1.06 0.00 0.00 176.91 179.30 1pcg h ILE 389 N -0.06 1.17 -0.57 -1.22 2.10 -1.07 0.13 117.51 117.99 1pcg h ILE 389 Ca 0.03 -0.70 -0.06 0.00 1.08 0.00 0.00 64.86 65.21 1pcg h ILE 389 Cb 0.27 1.03 -0.02 0.00 -1.09 0.00 0.00 36.82 37.01 1pcg h ILE 389 CO 0.00 0.23 0.11 1.23 -1.08 0.00 0.00 178.15 178.65 1pcg h GLY 390 N 0.73 1.01 0.82 8.18 0.00 -1.31 -0.52 103.07 111.98 1pcg h GLY 390 Ca 0.08 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.71 1pcg h GLY 390 CO 0.01 0.61 -0.39 -2.00 0.00 0.00 0.00 176.54 174.77 1pcg h LEU 391 N 0.84 -0.93 -1.11 3.11 5.85 0.22 -2.45 115.31 120.83 1pcg h LEU 391 Ca 0.18 0.03 0.20 0.00 0.84 0.00 0.00 57.88 59.13 1pcg h LEU 391 Cb 0.39 0.24 -0.10 0.00 0.37 0.00 0.00 40.66 41.56 1pcg h LEU 391 CO 0.01 -0.63 0.61 -0.37 -0.34 0.00 0.00 178.44 177.72 1pcg h VAL 392 N -1.16 0.69 -0.34 1.05 -1.51 -0.78 -1.52 116.25 112.68 1pcg h VAL 392 Ca -0.11 -0.24 -0.00 0.00 -1.23 0.00 0.00 66.70 65.12 1pcg h VAL 392 Cb 0.84 -0.06 -0.02 0.00 -2.13 0.00 0.00 31.29 29.93 1pcg h VAL 392 CO 0.18 0.13 0.20 -0.25 -1.23 0.00 0.00 177.57 176.60 1pcg h TRP 393 N 0.69 0.46 -0.00 5.19 2.91 -0.96 -2.29 115.95 121.94 1pcg h TRP 393 Ca 0.56 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.58 1pcg h TRP 393 Cb 0.98 -0.15 0.00 0.00 -0.51 0.00 0.00 29.16 29.48 1pcg h TRP 393 CO -0.00 0.34 -0.08 2.89 -1.03 0.00 0.00 178.44 180.56 1pcg n ARG 394 N -4.80 0.73 0.00 2.65 1.85 -0.86 -2.98 116.66 113.25 1pcg n ARG 394 Ca -0.01 -0.21 0.12 0.00 -1.00 0.00 0.00 57.85 56.75 1pcg n ARG 394 Cb 0.06 -1.50 0.17 0.00 -1.05 0.00 0.00 32.46 30.15 1pcg n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1pcg n SER 395 N -0.95 2.31 -0.17 2.89 7.64 -0.63 -4.50 113.62 120.21 1pcg n SER 395 Ca 0.16 -1.69 -0.01 0.00 1.01 0.00 0.00 58.87 58.34 1pcg n SER 395 Cb 0.26 0.14 0.08 0.00 -1.01 0.00 0.00 64.21 63.67 1pcg n SER 395 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1pcg h MET 396 N 3.39 0.15 -1.37 1.43 2.86 -1.32 -2.05 114.93 118.02 1pcg h MET 396 Ca 0.00 -0.01 -0.31 0.00 -2.06 0.00 0.00 59.70 57.32 1pcg h MET 396 Cb 0.81 -0.03 -0.15 0.00 0.06 0.00 0.00 31.60 32.29 1pcg h MET 396 CO 0.00 0.10 0.41 0.39 1.06 0.00 0.00 176.91 178.87 1pcg n GLU 397 N -5.21 1.78 -3.05 1.72 1.02 -1.26 -4.36 120.64 111.27 1pcg n GLU 397 Ca 0.07 -1.59 -0.16 0.00 -0.02 0.00 0.00 57.16 55.47 1pcg n GLU 397 Cb 0.29 -1.62 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1pcg n GLU 397 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1pcg n HIS 398 N 0.14 -0.78 -1.17 -0.32 8.25 -0.77 -5.11 115.22 115.45 1pcg n HIS 398 Ca 0.31 -3.29 -0.46 0.00 -0.26 0.00 0.00 57.72 54.02 1pcg n HIS 398 Cb 0.71 0.20 -0.06 0.00 1.12 0.00 0.00 29.99 31.95 1pcg n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1pcg n PRO 399 N 0.42 0.00 -1.07 -0.41 -0.02 -1.26 -0.05 135.00 132.60 1pcg n PRO 399 Ca 0.19 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.65 1pcg n PRO 399 Cb 0.66 -1.08 -0.01 0.00 -0.02 0.00 0.00 33.50 33.05 1pcg n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pcg n GLY 400 N 2.00 0.44 3.15 -1.23 0.00 -1.26 -5.00 105.19 103.29 1pcg n GLY 400 Ca 0.18 -0.11 -0.15 0.00 0.00 0.00 0.00 46.02 45.95 1pcg n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pcg s LYS 401 N -1.44 0.77 -0.24 1.61 1.02 0.92 -3.87 119.74 118.50 1pcg s LYS 401 Ca 0.00 -1.01 -0.02 0.00 0.02 0.00 0.00 55.97 54.96 1pcg s LYS 401 Cb 0.00 -0.58 0.02 0.00 -0.52 0.00 0.00 37.83 36.75 1pcg s LYS 401 CO 0.00 0.11 -0.06 -0.51 -0.92 0.00 0.00 175.35 173.97 1pcg s LEU 402 N -2.04 3.15 -1.25 3.17 1.43 0.17 -4.78 118.68 118.53 1pcg s LEU 402 Ca -0.00 -0.83 -0.10 0.00 -1.03 0.00 0.00 54.13 52.17 1pcg s LEU 402 Cb -0.07 -1.67 0.17 0.00 0.03 0.00 0.00 46.19 44.66 1pcg s LEU 402 CO 0.01 -0.12 1.75 -0.11 0.23 0.00 0.00 176.35 178.11 1pcg n LEU 403 N 4.68 6.29 -0.20 1.79 0.00 -1.26 -1.35 117.00 126.94 1pcg n LEU 403 Ca -0.17 -4.63 0.10 0.00 0.00 0.00 0.00 56.01 51.32 1pcg n LEU 403 Cb 0.47 -1.51 0.39 0.00 0.00 0.00 0.00 43.42 42.78 1pcg n LEU 403 CO 0.27 1.23 1.21 -0.26 0.00 0.00 0.00 177.39 179.85 1pcg h PHE 404 N 6.08 0.71 -3.44 1.96 0.04 -1.85 -3.44 116.94 117.00 1pcg h PHE 404 Ca 0.37 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 61.10 1pcg h PHE 404 Cb 0.69 -0.23 -0.13 0.00 2.20 0.00 0.00 35.95 38.48 1pcg h PHE 404 CO 1.20 0.32 -0.10 0.00 -0.60 0.00 0.00 178.31 179.14 1pcg s ALA 405 N -5.61 -0.84 0.57 2.45 0.00 -1.17 -4.97 121.76 112.19 1pcg s ALA 405 Ca -0.09 -0.14 0.27 0.00 0.00 0.00 0.00 51.96 51.99 1pcg s ALA 405 Cb 0.20 0.70 1.60 0.00 0.00 0.00 0.00 23.12 25.61 1pcg s ALA 405 CO 0.77 -0.65 2.12 -1.35 0.00 0.00 0.00 175.76 176.66 1pcg h PRO 406 N 2.39 0.00 -0.53 0.00 0.11 -1.85 -1.50 132.00 130.63 1pcg h PRO 406 Ca -0.33 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.45 1pcg h PRO 406 Cb 1.25 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.16 1pcg h PRO 406 CO 0.47 0.00 -0.09 0.27 -0.21 0.00 0.00 178.00 178.43 1pcg n ASN 407 N -3.98 3.58 -2.73 -2.05 6.94 -1.26 -4.75 115.26 111.00 1pcg n ASN 407 Ca 0.01 -3.79 -0.06 0.00 -0.02 0.00 0.00 54.58 50.73 1pcg n ASN 407 Cb 0.29 -0.63 0.04 0.00 -2.36 0.00 0.00 39.78 37.12 1pcg n ASN 407 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1pcg n LEU 408 N -1.02 -2.73 -4.39 -4.53 7.94 -0.56 -4.77 117.00 106.94 1pcg n LEU 408 Ca 0.40 -2.78 -0.43 0.00 -1.11 0.00 0.00 56.01 52.09 1pcg n LEU 408 Cb 1.00 0.75 -0.09 0.00 0.53 0.00 0.00 43.42 45.61 1pcg n LEU 408 CO 0.32 1.85 -0.04 -0.22 -1.11 0.00 0.00 177.39 178.19 1pcg s LEU 409 N -0.01 5.30 0.32 -1.96 2.96 -1.26 -2.52 118.68 121.52 1pcg s LEU 409 Ca 0.30 -1.18 0.07 0.00 -0.22 0.00 0.00 54.13 53.10 1pcg s LEU 409 Cb 0.15 -2.13 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 1pcg s LEU 409 CO -0.16 -0.54 0.32 -0.76 -1.32 0.00 0.00 176.35 173.89 1pcg s LEU 410 N 1.62 3.71 0.26 -0.68 1.43 -0.46 -4.89 118.68 119.67 1pcg s LEU 410 Ca 0.04 -0.40 0.04 0.00 -1.03 0.00 0.00 54.13 52.78 1pcg s LEU 410 Cb -0.22 -2.34 -0.06 0.00 0.03 0.00 0.00 46.19 43.61 1pcg s LEU 410 CO 0.07 -0.33 0.01 1.51 0.23 0.00 0.00 176.35 177.84 1pcg s ASP 411 N -4.01 2.10 0.11 2.29 1.47 -1.26 0.45 116.67 117.81 1pcg s ASP 411 Ca 0.41 -1.26 -0.12 0.00 1.18 0.00 0.00 52.55 52.75 1pcg s ASP 411 Cb -0.07 -0.04 0.06 0.00 -0.34 0.00 0.00 42.92 42.53 1pcg s ASP 411 CO 0.27 -0.52 0.82 -1.14 0.68 0.00 0.00 175.17 175.28 1pcg n ARG 412 N -0.52 -0.17 -0.05 2.11 0.63 -1.25 -1.28 116.66 116.13 1pcg n ARG 412 Ca -0.04 0.81 -0.08 0.00 -0.92 0.00 0.00 57.85 57.62 1pcg n ARG 412 Cb 0.65 -1.19 -0.02 0.00 0.45 0.00 0.00 32.46 32.34 1pcg n ARG 412 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1pcg h ASN 413 N 0.00 -0.28 0.00 6.15 2.35 -1.96 0.75 115.58 122.58 1pcg h ASN 413 Ca 0.14 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1pcg h ASN 413 Cb 0.27 0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1pcg h ASN 413 CO -0.51 -0.11 0.08 0.00 -1.65 0.00 0.00 177.43 175.24 1pcg n GLN 414 N -5.24 0.08 0.19 0.81 6.02 -0.40 0.13 117.38 118.96 1pcg n GLN 414 Ca -0.01 0.55 0.07 0.00 -0.01 0.00 0.00 57.00 57.60 1pcg n GLN 414 Cb 0.16 -1.85 0.21 0.00 1.02 0.00 0.00 30.24 29.79 1pcg n GLN 414 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1pcg h GLY 415 N 0.00 0.00 2.00 1.08 0.00 -0.78 -2.70 103.07 102.67 1pcg h GLY 415 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pcg h GLY 415 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.04 1pcg h LYS 416 N 0.00 0.00 -0.40 4.80 1.57 0.11 -2.67 116.57 119.97 1pcg h LYS 416 Ca -0.00 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.89 1pcg h LYS 416 Cb 1.08 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 1pcg h LYS 416 CO 0.04 0.00 0.31 1.03 -0.57 0.00 0.00 179.45 180.26 1pcg h SER 417 N 0.00 0.00 -4.57 0.86 0.87 -1.56 -3.41 113.55 105.74 1pcg h SER 417 Ca 0.00 0.00 -0.70 0.00 -1.23 0.00 0.00 61.79 59.86 1pcg h SER 417 Cb 0.34 0.00 -0.30 0.00 -0.44 0.00 0.00 62.40 62.01 1pcg h SER 417 CO 0.00 0.00 -0.89 -0.69 -0.53 0.00 0.00 176.83 174.72 1pcg s VAL 418 N -4.92 2.08 0.24 2.23 1.01 -1.01 -3.18 120.40 116.86 1pcg s VAL 418 Ca -0.05 -1.10 -0.31 0.00 0.00 0.00 0.00 61.98 60.52 1pcg s VAL 418 Cb 0.18 -1.72 -0.12 0.00 0.00 0.00 0.00 36.38 34.73 1pcg s VAL 418 CO 0.68 0.58 1.66 1.21 0.00 0.00 0.00 175.10 179.23 1pcg n GLU 419 N 2.46 2.73 -1.32 2.72 2.13 -1.26 -1.91 120.64 126.18 1pcg n GLU 419 Ca -0.16 0.98 -0.11 0.00 0.66 0.00 0.00 57.16 58.53 1pcg n GLU 419 Cb 0.51 -2.79 -0.05 0.00 0.27 0.00 0.00 31.44 29.38 1pcg n GLU 419 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1pcg n GLY 420 N 3.16 1.09 0.14 8.31 0.00 -1.26 -4.86 105.19 111.76 1pcg n GLY 420 Ca 0.13 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1pcg n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1pcg h MET 421 N 0.03 0.35 -0.92 1.61 -1.53 -1.60 -3.39 114.93 109.48 1pcg h MET 421 Ca -0.23 -0.60 0.13 0.00 -3.44 0.00 0.00 59.70 55.56 1pcg h MET 421 Cb 1.14 0.22 -0.07 0.00 -0.55 0.00 0.00 31.60 32.34 1pcg h MET 421 CO 0.33 1.29 0.59 0.28 0.14 0.00 0.00 176.91 179.54 1pcg h VAL 422 N 0.03 0.88 -0.43 -5.77 2.07 -1.74 -0.80 116.25 110.50 1pcg h VAL 422 Ca -0.35 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1pcg h VAL 422 Cb 2.03 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 1pcg h VAL 422 CO 0.14 0.15 0.27 1.05 0.02 0.00 0.00 177.57 179.20 1pcg h GLU 423 N 0.81 0.57 -0.58 1.57 9.09 -1.94 0.20 114.58 124.30 1pcg h GLU 423 Ca 0.46 -0.04 -0.08 0.00 0.05 0.00 0.00 59.36 59.74 1pcg h GLU 423 Cb 0.60 -0.12 -0.02 0.00 -1.65 0.00 0.00 28.75 27.55 1pcg h GLU 423 CO -0.22 0.40 0.04 0.82 0.05 0.00 0.00 179.01 180.10 1pcg h ILE 424 N 0.57 1.26 -0.30 -1.06 2.04 -1.51 -1.20 117.51 117.31 1pcg h ILE 424 Ca 0.16 -1.06 -0.00 0.00 1.00 0.00 0.00 64.86 64.95 1pcg h ILE 424 Cb -0.04 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1pcg h ILE 424 CO -0.03 0.39 0.19 -0.26 0.00 0.00 0.00 178.15 178.43 1pcg h PHE 425 N 0.91 0.40 -0.59 1.37 0.05 -0.49 -1.00 116.94 117.59 1pcg h PHE 425 Ca 0.17 0.00 0.04 0.00 3.82 0.00 0.00 57.97 62.00 1pcg h PHE 425 Cb 0.48 -0.13 -0.04 0.00 2.00 0.00 0.00 35.95 38.26 1pcg h PHE 425 CO 0.03 0.29 0.34 -0.44 -0.18 0.00 0.00 178.31 178.35 1pcg h ASP 426 N 0.39 0.53 -0.21 2.17 3.32 -0.18 0.06 116.42 122.50 1pcg h ASP 426 Ca 0.11 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 1pcg h ASP 426 Cb 0.00 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1pcg h ASP 426 CO -0.02 0.37 0.11 0.24 -1.72 0.00 0.00 179.24 178.22 1pcg h MET 427 N 0.66 0.29 0.07 3.56 2.86 -0.91 -0.39 114.93 121.08 1pcg h MET 427 Ca 0.25 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.88 1pcg h MET 427 Cb 0.08 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1pcg h MET 427 CO -0.13 0.28 -0.23 -0.07 1.06 0.00 0.00 176.91 177.82 1pcg h LEU 428 N 0.23 -0.65 -1.06 1.22 3.38 -0.75 -1.44 115.31 116.25 1pcg h LEU 428 Ca 0.07 0.08 0.15 0.00 0.09 0.00 0.00 57.88 58.27 1pcg h LEU 428 Cb 0.07 0.26 -0.09 0.00 0.09 0.00 0.00 40.66 40.99 1pcg h LEU 428 CO -0.01 -0.31 0.62 -0.07 0.09 0.00 0.00 178.44 178.76 1pcg h LEU 429 N -0.39 0.84 -0.75 1.67 3.38 -0.78 0.79 115.31 120.05 1pcg h LEU 429 Ca 0.04 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1pcg h LEU 429 Cb 0.44 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1pcg h LEU 429 CO -0.16 0.40 0.38 0.00 0.09 0.00 0.00 178.44 179.14 1pcg h ALA 430 N 1.58 0.97 -0.28 1.53 0.00 -0.23 0.96 119.26 123.78 1pcg h ALA 430 Ca 0.52 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 1pcg h ALA 430 Cb 0.66 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1pcg h ALA 430 CO -0.29 0.51 0.08 1.15 0.00 0.00 0.00 179.25 180.70 1pcg h THR 431 N 1.05 1.21 -0.95 0.00 2.02 0.08 -0.67 112.91 115.65 1pcg h THR 431 Ca 0.26 -0.69 0.01 0.00 0.77 0.00 0.00 66.41 66.76 1pcg h THR 431 Cb 0.09 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 67.58 1pcg h THR 431 CO -0.04 0.23 0.62 -1.28 0.37 0.00 0.00 175.52 175.42 1pcg h SER 432 N 0.29 1.11 -0.52 4.18 0.87 -0.62 -0.48 113.55 118.38 1pcg h SER 432 Ca 0.09 -0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.56 1pcg h SER 432 Cb 0.27 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 1pcg h SER 432 CO -0.00 0.82 0.13 0.28 -0.53 0.00 0.00 176.83 177.52 1pcg h SER 433 N 1.30 0.78 -0.07 6.23 0.02 -0.53 -1.30 113.55 119.99 1pcg h SER 433 Ca 0.35 -0.23 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1pcg h SER 433 Cb -0.12 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.19 1pcg h SER 433 CO -0.07 0.81 -0.03 -0.09 -1.14 0.00 0.00 176.83 176.31 1pcg h ARG 434 N 0.72 -0.03 -0.77 3.45 9.65 -0.48 0.16 114.38 127.08 1pcg h ARG 434 Ca 0.16 0.00 0.03 0.00 -1.10 0.00 0.00 59.98 59.08 1pcg h ARG 434 Cb 0.33 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.87 1pcg h ARG 434 CO 0.00 -0.02 0.49 0.74 2.80 0.00 0.00 179.97 183.98 1pcg h PHE 435 N -0.03 0.91 0.41 2.20 0.04 -0.98 0.39 116.94 119.88 1pcg h PHE 435 Ca 0.04 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 1pcg h PHE 435 Cb 0.08 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 37.92 1pcg h PHE 435 CO -0.14 0.52 -0.29 -0.09 -0.60 0.00 0.00 178.31 177.71 1pcg h ARG 436 N 0.95 -0.67 -0.78 1.51 2.43 -0.79 0.32 114.38 117.35 1pcg h ARG 436 Ca 0.31 0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.68 1pcg h ARG 436 Cb 0.01 0.15 -0.10 0.00 -0.42 0.00 0.00 29.97 29.61 1pcg h ARG 436 CO -0.11 -0.45 0.30 1.98 -1.51 0.00 0.00 179.97 180.18 1pcg h MET 437 N -0.69 0.39 0.00 0.20 4.05 -0.21 0.63 114.93 119.30 1pcg h MET 437 Ca -0.04 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1pcg h MET 437 Cb 0.59 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 1pcg h MET 437 CO 0.01 0.26 0.00 -1.33 0.23 0.00 0.00 176.91 176.08 1pcg n MET 438 N -5.04 0.29 -3.55 0.39 2.81 0.08 -4.94 117.12 107.17 1pcg n MET 438 Ca 0.16 0.00 -0.20 0.00 -1.81 0.00 0.00 57.70 55.85 1pcg n MET 438 Cb 0.47 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.54 1pcg n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1pcg n ASN 439 N -1.35 -2.85 -4.77 7.83 2.85 0.21 -4.89 115.26 112.29 1pcg n ASN 439 Ca 0.12 -0.77 -0.41 0.00 -0.11 0.00 0.00 54.58 53.40 1pcg n ASN 439 Cb 0.27 -4.45 -0.01 0.00 1.24 0.00 0.00 39.78 36.83 1pcg n ASN 439 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 1pcg s LEU 440 N -6.34 4.33 0.17 1.20 2.96 -0.84 -5.00 118.68 115.16 1pcg s LEU 440 Ca 0.14 3.02 0.01 0.00 -0.22 0.00 0.00 54.13 57.09 1pcg s LEU 440 Cb -0.03 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1pcg s LEU 440 CO 0.78 -0.89 0.33 -1.10 -1.32 0.00 0.00 176.35 174.16 1pcg s GLN 441 N -1.65 3.47 0.21 1.98 -1.52 -1.26 -4.97 119.66 115.92 1pcg s GLN 441 Ca 0.56 -0.49 -0.10 0.00 -1.95 0.00 0.00 55.36 53.37 1pcg s GLN 441 Cb -0.47 -2.91 0.20 0.00 -0.22 0.00 0.00 33.01 29.61 1pcg s GLN 441 CO 0.59 0.47 1.83 0.78 -0.25 0.00 0.00 175.29 178.70 1pcg h GLY 442 N 2.05 0.97 1.35 3.09 0.00 -1.99 0.14 103.07 108.68 1pcg h GLY 442 Ca -0.48 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.56 1pcg h GLY 442 CO 0.68 0.22 0.41 0.83 0.00 0.00 0.00 176.54 178.68 1pcg h GLU 443 N 0.76 0.87 -0.26 4.80 3.07 -1.98 -1.41 114.58 120.43 1pcg h GLU 443 Ca 0.28 -0.06 -0.17 0.00 -0.50 0.00 0.00 59.36 58.91 1pcg h GLU 443 Cb 0.09 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 27.80 1pcg h GLU 443 CO -0.14 0.59 -0.51 0.93 -1.40 0.00 0.00 179.01 178.48 1pcg h GLU 444 N 0.89 0.74 -0.44 2.33 5.08 -1.65 -3.14 114.58 118.39 1pcg h GLU 444 Ca 0.24 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1pcg h GLU 444 Cb -0.07 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1pcg h GLU 444 CO -0.05 1.07 0.28 0.35 -1.00 0.00 0.00 179.01 179.67 1pcg h PHE 445 N 0.58 0.56 0.00 4.33 3.57 0.26 -0.71 116.94 125.53 1pcg h PHE 445 Ca 0.02 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1pcg h PHE 445 Cb 1.09 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 1pcg h PHE 445 CO 0.06 0.36 -0.09 -0.39 -2.23 0.00 0.00 178.31 176.02 1pcg h VAL 446 N 0.59 0.23 -0.02 1.41 -1.51 -1.40 -1.45 116.25 114.11 1pcg h VAL 446 Ca 0.16 -0.74 -0.26 0.00 -1.23 0.00 0.00 66.70 64.64 1pcg h VAL 446 Cb -0.05 1.60 0.02 0.00 -2.13 0.00 0.00 31.29 30.72 1pcg h VAL 446 CO -0.03 0.09 -1.00 0.00 -1.23 0.00 0.00 177.57 175.40 1pcg h LEU 448 N 0.39 0.64 -1.45 0.00 3.38 -0.48 -1.97 115.31 115.82 1pcg h LEU 448 Ca -0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1pcg h LEU 448 Cb 1.64 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.21 1pcg h LEU 448 CO 0.19 0.69 0.12 0.50 0.09 0.00 0.00 178.44 180.03 1pcg h LYS 449 N 0.56 0.48 -0.06 1.13 3.64 -1.35 -1.78 116.57 119.19 1pcg h LYS 449 Ca 0.14 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 59.27 1pcg h LYS 449 Cb 0.29 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1pcg h LYS 449 CO -0.00 0.42 -0.77 0.77 -2.27 0.00 0.00 179.45 177.60 1pcg h SER 450 N 0.48 0.46 -0.44 4.20 0.02 -1.35 -2.09 113.55 114.83 1pcg h SER 450 Ca 0.12 -0.31 -0.09 0.00 -0.84 0.00 0.00 61.79 60.67 1pcg h SER 450 Cb 0.13 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1pcg h SER 450 CO -0.01 1.06 -0.05 0.40 -1.14 0.00 0.00 176.83 177.10 1pcg h ILE 451 N 0.25 1.26 0.25 3.27 2.04 -0.88 -2.21 117.51 121.49 1pcg h ILE 451 Ca -0.04 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.69 1pcg h ILE 451 Cb 1.35 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 1pcg h ILE 451 CO 0.13 0.39 -0.12 0.40 0.00 0.00 0.00 178.15 178.95 1pcg h ILE 452 N 0.80 0.80 -0.48 -0.67 2.04 -1.18 0.29 117.51 119.12 1pcg h ILE 452 Ca 0.14 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.76 1pcg h ILE 452 Cb 0.54 1.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.54 1pcg h ILE 452 CO 0.03 0.07 0.00 0.25 0.00 0.00 0.00 178.15 178.51 1pcg h LEU 453 N -0.50 -0.19 -0.05 1.44 5.85 -1.27 -1.59 115.31 118.99 1pcg h LEU 453 Ca -0.03 0.11 -0.23 0.00 0.84 0.00 0.00 57.88 58.57 1pcg h LEU 453 Cb 0.38 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1pcg h LEU 453 CO 0.06 -0.06 -1.05 -0.07 -0.34 0.00 0.00 178.44 176.98 1pcg h LEU 454 N 0.12 0.25 0.00 2.25 3.38 -1.33 -3.36 115.31 116.62 1pcg h LEU 454 Ca 0.24 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1pcg h LEU 454 Cb 0.36 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1pcg h LEU 454 CO -0.39 1.14 -1.16 -1.13 0.09 0.00 0.00 178.44 176.99 1pcg h ASN 455 N 0.07 0.00 0.12 -0.43 -0.73 -0.27 -3.39 115.58 110.96 1pcg h ASN 455 Ca -0.07 0.00 0.01 0.00 1.87 0.00 0.00 56.30 58.11 1pcg h ASN 455 Cb 1.75 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 40.32 1pcg h ASN 455 CO 0.16 0.44 -0.18 0.28 -0.37 0.00 0.00 177.43 177.77 1pcg h SER 456 N 0.00 -0.48 -0.57 1.15 0.02 -1.45 -3.26 113.55 108.96 1pcg h SER 456 Ca -0.10 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1pcg h SER 456 Cb 1.43 0.18 0.00 0.00 0.14 0.00 0.00 62.40 64.15 1pcg h SER 456 CO 0.04 -0.26 0.00 0.61 -1.14 0.00 0.00 176.83 176.08 1pcg n GLY 457 N -1.30 2.19 0.27 -3.77 0.00 -1.26 -4.61 105.19 96.70 1pcg n GLY 457 Ca -0.07 -0.75 0.12 0.00 0.00 0.00 0.00 46.02 45.33 1pcg n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1pcg h VAL 458 N 4.21 0.64 -0.01 1.61 3.04 -1.75 -1.76 116.25 122.23 1pcg h VAL 458 Ca 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 1pcg h VAL 458 Cb 0.97 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.50 1pcg h VAL 458 CO 0.00 0.09 -0.65 -1.22 -1.01 0.00 0.00 177.57 174.79 1pcg n TYR 459 N -3.80 0.00 -0.49 3.17 4.02 -1.26 -3.52 117.16 115.27 1pcg n TYR 459 Ca -0.02 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.94 1pcg n TYR 459 Cb 0.19 0.00 0.34 0.00 -0.02 0.00 0.00 39.34 39.85 1pcg n TYR 459 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1pcg n THR 460 N -0.61 1.97 0.05 -0.72 -2.24 -0.70 -4.06 114.28 107.97 1pcg n THR 460 Ca 0.07 -1.12 -0.05 0.00 -2.27 0.00 0.00 64.05 60.67 1pcg n THR 460 Cb 0.39 -0.08 -0.10 0.00 -2.10 0.00 0.00 70.33 68.44 1pcg n THR 460 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1pcg h PHE 461 N 3.61 0.00 0.00 4.78 -1.00 -1.51 -3.50 116.94 119.31 1pcg h PHE 461 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1pcg h PHE 461 Cb 1.53 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.09 1pcg h PHE 461 CO 0.81 0.87 0.00 1.28 -1.61 0.00 0.00 178.31 179.66 1pcg n LEU 462 N -3.19 0.27 0.00 1.54 4.32 -1.26 -5.13 117.00 113.55 1pcg n LEU 462 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1pcg n LEU 462 Cb 0.93 -0.77 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 1pcg n LEU 462 CO 0.45 -0.21 0.00 1.57 -1.22 0.00 0.00 177.39 177.98 1pcg n HIS 474 N -2.42 0.00 -0.12 -1.77 -0.00 -1.26 -5.18 115.22 104.47 1pcg n HIS 474 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.67 1pcg n HIS 474 Cb 0.08 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.10 1pcg n HIS 474 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 1pcg h ILE 475 N 0.00 0.80 -0.60 3.57 2.04 -1.96 -0.98 117.51 120.38 1pcg h ILE 475 Ca 0.00 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1pcg h ILE 475 Cb 0.00 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1pcg h ILE 475 CO 0.00 0.04 0.33 0.45 0.00 0.00 0.00 178.15 178.96 1pcg h HIS 476 N 0.21 0.80 -0.49 1.37 3.86 -1.98 0.13 115.15 119.04 1pcg h HIS 476 Ca 0.19 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.34 1pcg h HIS 476 Cb 0.23 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1pcg h HIS 476 CO -0.20 0.56 0.10 0.00 0.86 0.00 0.00 177.93 179.25 1pcg h ARG 477 N 0.83 0.80 -0.25 2.45 3.08 -1.76 -0.60 114.38 118.93 1pcg h ARG 477 Ca 0.21 -0.21 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 1pcg h ARG 477 Cb 0.02 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1pcg h ARG 477 CO -0.03 0.79 -0.32 0.28 -1.07 0.00 0.00 179.97 179.62 1pcg h VAL 478 N 0.68 1.28 -0.61 2.04 2.07 -0.50 -1.75 116.25 119.46 1pcg h VAL 478 Ca 0.15 -1.41 -0.06 0.00 0.82 0.00 0.00 66.70 66.21 1pcg h VAL 478 Cb 0.36 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1pcg h VAL 478 CO 0.01 0.45 0.15 -0.07 0.02 0.00 0.00 177.57 178.12 1pcg h LEU 479 N 0.45 0.92 -0.72 2.57 3.38 -0.41 -1.25 115.31 120.25 1pcg h LEU 479 Ca 0.05 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1pcg h LEU 479 Cb 0.77 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1pcg h LEU 479 CO 0.06 0.92 0.38 0.44 0.09 0.00 0.00 178.44 180.33 1pcg h ASP 480 N 0.88 0.91 -0.42 -0.43 3.32 -0.85 -0.77 116.42 119.05 1pcg h ASP 480 Ca 0.19 -0.11 0.02 0.00 0.02 0.00 0.00 57.03 57.15 1pcg h ASP 480 Cb 0.36 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1pcg h ASP 480 CO 0.00 0.75 0.26 0.50 -1.72 0.00 0.00 179.24 179.03 1pcg h LYS 481 N 0.99 0.51 -0.39 3.56 1.63 -0.92 -0.32 116.57 121.63 1pcg h LYS 481 Ca 0.25 -0.03 -0.05 0.00 -0.85 0.00 0.00 60.65 59.97 1pcg h LYS 481 Cb 0.06 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 1pcg h LYS 481 CO -0.04 0.33 0.02 0.82 -3.45 0.00 0.00 179.45 177.13 1pcg h ILE 482 N 0.52 1.21 -0.59 2.00 2.04 -0.76 -0.66 117.51 121.27 1pcg h ILE 482 Ca 0.17 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 1pcg h ILE 482 Cb -0.01 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 36.95 1pcg h ILE 482 CO -0.07 0.29 0.21 0.74 0.00 0.00 0.00 178.15 179.32 1pcg h THR 483 N 0.58 1.23 -0.52 -0.27 2.02 -0.32 -1.50 112.91 114.13 1pcg h THR 483 Ca 0.12 -0.76 0.08 0.00 0.77 0.00 0.00 66.41 66.62 1pcg h THR 483 Cb 0.35 0.63 -0.06 0.00 -1.74 0.00 0.00 68.15 67.32 1pcg h THR 483 CO 0.01 0.29 0.16 0.44 0.37 0.00 0.00 175.52 176.79 1pcg h ASP 484 N 0.82 0.13 -0.57 4.18 3.32 0.12 -1.45 116.42 122.98 1pcg h ASP 484 Ca 0.19 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.32 1pcg h ASP 484 Cb 0.24 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 1pcg h ASP 484 CO -0.01 0.10 0.36 0.74 -1.72 0.00 0.00 179.24 178.70 1pcg h THR 485 N 0.33 1.16 -0.84 0.35 2.02 -0.74 -0.99 112.91 114.20 1pcg h THR 485 Ca 0.26 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1pcg h THR 485 Cb 0.31 0.36 -0.04 0.00 -1.74 0.00 0.00 68.15 67.04 1pcg h THR 485 CO -0.29 0.16 0.43 -0.07 0.37 0.00 0.00 175.52 176.12 1pcg h LEU 486 N 0.77 1.07 -0.62 2.58 3.38 -0.60 -0.69 115.31 121.20 1pcg h LEU 486 Ca 0.21 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 1pcg h LEU 486 Cb -0.05 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1pcg h LEU 486 CO -0.04 0.88 -0.16 0.40 0.09 0.00 0.00 178.44 179.61 1pcg h ILE 487 N 1.18 1.27 -0.37 1.22 1.08 -0.88 -1.75 117.51 119.25 1pcg h ILE 487 Ca 0.29 -1.30 -0.00 0.00 -0.39 0.00 0.00 64.86 63.46 1pcg h ILE 487 Cb 0.07 1.08 -0.02 0.00 -3.07 0.00 0.00 36.82 34.88 1pcg h ILE 487 CO -0.04 0.45 0.23 -0.74 -0.69 0.00 0.00 178.15 177.36 1pcg h HIS 488 N 0.81 0.49 -0.57 1.37 2.76 -0.60 0.39 115.15 119.80 1pcg h HIS 488 Ca 0.12 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.31 1pcg h HIS 488 Cb 0.71 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.48 1pcg h HIS 488 CO 0.04 0.34 0.36 -0.07 -1.30 0.00 0.00 177.93 177.30 1pcg h LEU 489 N 0.50 0.61 -0.65 0.26 3.38 -0.98 -0.18 115.31 118.26 1pcg h LEU 489 Ca 0.14 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 1pcg h LEU 489 Cb -0.01 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1pcg h LEU 489 CO -0.03 0.44 -0.02 0.24 0.09 0.00 0.00 178.44 179.16 1pcg h MET 490 N 0.73 1.04 0.22 1.13 2.86 -0.73 -1.79 114.93 118.39 1pcg h MET 490 Ca 0.22 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1pcg h MET 490 Cb -0.04 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.53 1pcg h MET 490 CO -0.07 1.03 -0.11 0.00 1.06 0.00 0.00 176.91 178.82 1pcg h ALA 491 N 1.02 -0.30 -0.21 6.32 0.00 0.11 -2.66 119.26 123.55 1pcg h ALA 491 Ca 0.17 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1pcg h ALA 491 Cb 0.57 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1pcg h ALA 491 CO 0.03 -0.55 0.18 0.87 0.00 0.00 0.00 179.25 179.78 1pcg h LYS 492 N -0.53 0.00 0.00 0.00 1.57 -0.98 0.23 116.57 116.86 1pcg h LYS 492 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1pcg h LYS 492 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1pcg h LYS 492 CO 0.05 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.93 1pcg n ALA 493 N -2.47 2.10 -0.01 3.86 0.00 -0.68 -4.92 120.51 118.39 1pcg n ALA 493 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1pcg n ALA 493 Cb 0.32 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1pcg n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pcg n GLY 494 N 0.97 0.91 3.80 0.00 0.00 0.80 -5.08 105.19 106.58 1pcg n GLY 494 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1pcg n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pcg s LEU 495 N 0.00 3.86 0.92 0.99 1.43 -1.02 -5.04 118.68 119.82 1pcg s LEU 495 Ca 0.00 1.88 -0.12 0.00 -1.03 0.00 0.00 54.13 54.86 1pcg s LEU 495 Cb 0.00 -4.56 0.14 0.00 0.03 0.00 0.00 46.19 41.81 1pcg s LEU 495 CO 0.00 -0.70 1.11 0.42 0.23 0.00 0.00 176.35 177.40 1pcg s THR 496 N -2.02 2.32 0.28 5.49 -4.23 -1.26 -4.68 115.64 111.54 1pcg s THR 496 Ca 0.66 0.11 -0.01 0.00 -1.18 0.00 0.00 61.69 61.27 1pcg s THR 496 Cb -0.15 -2.72 0.28 0.00 1.34 0.00 0.00 72.50 71.24 1pcg s THR 496 CO 0.19 -0.14 1.87 -0.07 -0.54 0.00 0.00 174.62 175.93 1pcg h LEU 497 N -1.57 0.99 -0.14 4.79 3.38 -1.99 -0.01 115.31 120.76 1pcg h LEU 497 Ca -0.51 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.45 1pcg h LEU 497 Cb 1.31 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1pcg h LEU 497 CO 0.59 0.59 -0.04 -0.61 0.09 0.00 0.00 178.44 179.06 1pcg h GLN 498 N 1.10 0.27 0.00 1.13 4.15 -2.00 -2.62 115.11 117.14 1pcg h GLN 498 Ca 0.45 -0.11 -0.02 0.00 0.77 0.00 0.00 58.65 59.74 1pcg h GLN 498 Cb 0.30 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.97 1pcg h GLN 498 CO -0.21 0.57 -0.10 1.96 -1.93 0.00 0.00 178.83 179.13 1pcg h GLN 499 N -0.04 0.00 0.14 1.69 4.20 -1.80 -1.54 115.11 117.77 1pcg h GLN 499 Ca 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1pcg h GLN 499 Cb 0.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1pcg h GLN 499 CO 0.02 0.10 -0.07 1.96 -0.67 0.00 0.00 178.83 180.17 1pcg h GLN 500 N 0.00 -0.18 -0.56 1.46 4.20 -0.82 -2.35 115.11 116.86 1pcg h GLN 500 Ca -0.00 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1pcg h GLN 500 Cb 0.22 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1pcg h GLN 500 CO 0.01 0.19 0.31 0.45 -0.67 0.00 0.00 178.83 179.12 1pcg h HIS 501 N -0.60 0.77 -0.27 2.96 3.86 -1.18 -0.02 115.15 120.67 1pcg h HIS 501 Ca -0.02 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 1pcg h HIS 501 Cb 0.46 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 1pcg h HIS 501 CO 0.05 0.56 0.17 1.96 0.86 0.00 0.00 177.93 181.53 1pcg h GLN 502 N 0.75 0.37 -0.40 2.45 4.20 -1.34 -0.55 115.11 120.60 1pcg h GLN 502 Ca 0.20 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.80 1pcg h GLN 502 Cb 0.04 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1pcg h GLN 502 CO -0.03 0.27 -0.05 -0.09 -0.67 0.00 0.00 178.83 178.26 1pcg h ARG 503 N 0.36 0.74 -0.98 1.46 2.43 -1.26 0.87 114.38 118.00 1pcg h ARG 503 Ca 0.10 -0.26 0.09 0.00 -0.81 0.00 0.00 59.98 59.09 1pcg h ARG 503 Cb -0.01 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.42 1pcg h ARG 503 CO -0.02 0.85 0.62 1.25 -1.51 0.00 0.00 179.97 181.16 1pcg h LEU 504 N 0.55 0.96 -0.31 3.80 5.85 -0.74 0.71 115.31 126.14 1pcg h LEU 504 Ca 0.11 0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 1pcg h LEU 504 Cb 0.55 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 1pcg h LEU 504 CO 0.03 0.58 -0.33 0.00 -0.34 0.00 0.00 178.44 178.37 1pcg h ALA 505 N 1.48 0.46 -0.96 1.25 0.00 -0.55 -1.81 119.26 119.13 1pcg h ALA 505 Ca 0.45 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1pcg h ALA 505 Cb 0.29 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1pcg h ALA 505 CO -0.21 0.51 0.58 1.96 0.00 0.00 0.00 179.25 182.10 1pcg h GLN 506 N 0.53 1.29 -0.11 0.00 4.20 0.18 0.50 115.11 121.71 1pcg h GLN 506 Ca 0.05 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 1pcg h GLN 506 Cb 0.92 -0.27 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 1pcg h GLN 506 CO 0.08 0.90 -0.19 -0.07 -0.67 0.00 0.00 178.83 178.88 1pcg h LEU 507 N 1.32 0.35 -0.95 1.46 3.38 -0.83 -2.70 115.31 117.34 1pcg h LEU 507 Ca 0.34 -0.54 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1pcg h LEU 507 Cb -0.07 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 1pcg h LEU 507 CO -0.07 0.83 0.63 -0.07 0.09 0.00 0.00 178.44 179.85 1pcg h LEU 508 N -0.11 1.09 -1.04 1.67 3.38 -1.12 -2.37 115.31 116.80 1pcg h LEU 508 Ca 0.01 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1pcg h LEU 508 Cb 0.76 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1pcg h LEU 508 CO 0.04 0.79 0.65 -0.07 0.09 0.00 0.00 178.44 179.94 1pcg h LEU 509 N 1.29 1.09 -2.33 1.67 3.38 -0.86 0.01 115.31 119.56 1pcg h LEU 509 Ca 0.35 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.31 1pcg h LEU 509 Cb -0.15 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.34 1pcg h LEU 509 CO -0.08 0.77 0.05 0.40 0.09 0.00 0.00 178.44 179.68 1pcg h ILE 510 N 1.28 0.60 -0.61 1.22 2.04 -1.09 -2.04 117.51 118.91 1pcg h ILE 510 Ca 0.38 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.21 1pcg h ILE 510 Cb -0.07 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1pcg h ILE 510 CO -0.10 0.00 0.30 -0.07 0.00 0.00 0.00 178.15 178.28 1pcg h LEU 511 N 0.00 0.79 -1.93 1.44 3.38 -0.86 -1.57 115.31 116.57 1pcg h LEU 511 Ca 0.02 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1pcg h LEU 511 Cb 0.13 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1pcg h LEU 511 CO -0.00 0.69 -0.08 0.77 0.09 0.00 0.00 178.44 179.91 1pcg h SER 512 N 0.83 0.00 0.03 -0.43 4.64 -1.42 -0.41 113.55 116.80 1pcg h SER 512 Ca 0.21 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.28 1pcg h SER 512 Cb 0.11 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1pcg h SER 512 CO -0.03 0.08 -0.99 -0.74 -0.87 0.00 0.00 176.83 174.29 1pcg h HIS 513 N 0.00 0.98 -0.12 4.77 -0.00 -1.34 -2.23 115.15 117.21 1pcg h HIS 513 Ca -0.00 -0.52 -0.05 0.00 -0.00 0.00 0.00 60.37 59.80 1pcg h HIS 513 Cb 0.35 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.64 1pcg h HIS 513 CO 0.00 1.35 -0.15 0.82 -0.00 0.00 0.00 177.93 179.95 1pcg h ILE 514 N 0.39 1.18 -0.30 6.26 2.04 -0.43 0.31 117.51 126.96 1pcg h ILE 514 Ca -0.11 -0.79 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 1pcg h ILE 514 Cb 1.63 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 38.95 1pcg h ILE 514 CO 0.19 0.24 0.06 -0.09 0.00 0.00 0.00 178.15 178.55 1pcg h ARG 515 N 0.18 0.48 -0.59 2.37 9.65 -1.03 -1.01 114.38 124.44 1pcg h ARG 515 Ca 0.04 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.79 1pcg h ARG 515 Cb 0.38 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.88 1pcg h ARG 515 CO 0.02 0.58 0.35 1.25 2.80 0.00 0.00 179.97 184.97 1pcg h HIS 516 N 0.31 0.78 -0.36 2.20 2.76 -0.71 -1.40 115.15 118.73 1pcg h HIS 516 Ca 0.09 -0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.20 1pcg h HIS 516 Cb 0.32 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 1pcg h HIS 516 CO 0.02 0.54 -0.00 0.52 -1.30 0.00 0.00 177.93 177.71 1pcg h MET 517 N 0.79 0.57 -0.72 5.26 2.86 -0.77 -2.01 114.93 120.90 1pcg h MET 517 Ca 0.21 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1pcg h MET 517 Cb -0.00 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.55 1pcg h MET 517 CO -0.04 0.59 0.27 1.03 1.06 0.00 0.00 176.91 179.82 1pcg h SER 518 N 0.54 1.02 -0.31 1.22 0.87 -0.44 0.72 113.55 117.18 1pcg h SER 518 Ca 0.11 -0.19 -0.04 0.00 -1.23 0.00 0.00 61.79 60.45 1pcg h SER 518 Cb 0.35 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 1pcg h SER 518 CO 0.01 0.93 0.05 0.78 -0.53 0.00 0.00 176.83 178.07 1pcg h ASN 519 N 1.05 0.50 -0.56 6.23 2.35 -0.75 -0.59 115.58 123.80 1pcg h ASN 519 Ca 0.24 -0.26 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 1pcg h ASN 519 Cb 0.24 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 1pcg h ASN 519 CO -0.02 0.63 0.17 0.11 -1.65 0.00 0.00 177.43 176.68 1pcg h LYS 520 N 0.34 0.88 -0.71 0.81 1.79 -1.24 -2.44 116.57 116.00 1pcg h LYS 520 Ca 0.09 -0.19 0.07 0.00 -2.18 0.00 0.00 60.65 58.44 1pcg h LYS 520 Cb 0.35 -0.13 -0.06 0.00 -1.58 0.00 0.00 32.23 30.81 1pcg h LYS 520 CO 0.01 0.80 0.40 0.78 -1.08 0.00 0.00 179.45 180.35 1pcg h GLY 521 N 0.79 1.05 0.97 3.86 0.00 -0.62 0.04 103.07 109.17 1pcg h GLY 521 Ca 0.18 -0.28 0.01 0.00 0.00 0.00 0.00 47.33 47.24 1pcg h GLY 521 CO -0.00 0.16 0.15 -0.33 0.00 0.00 0.00 176.54 176.51 1pcg h MET 522 N 0.72 0.29 -1.00 4.80 2.86 -0.83 0.14 114.93 121.92 1pcg h MET 522 Ca 0.32 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.96 1pcg h MET 522 Cb 0.22 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.76 1pcg h MET 522 CO -0.20 0.19 0.66 0.93 1.06 0.00 0.00 176.91 179.56 1pcg h GLU 523 N 0.30 1.30 0.04 1.72 5.08 -0.90 0.50 114.58 122.62 1pcg h GLU 523 Ca 0.09 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1pcg h GLU 523 Cb -0.02 -0.29 0.00 0.00 0.50 0.00 0.00 28.75 28.94 1pcg h GLU 523 CO -0.04 0.86 -0.02 1.25 -1.00 0.00 0.00 179.01 180.07 1pcg h HIS 524 N 1.34 -0.05 -0.73 4.33 2.76 -0.39 -1.55 115.15 120.86 1pcg h HIS 524 Ca 0.37 -0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.56 1pcg h HIS 524 Cb -0.13 0.02 -0.04 0.00 1.55 0.00 0.00 27.41 28.80 1pcg h HIS 524 CO -0.00 0.25 0.47 1.25 -1.30 0.00 0.00 177.93 178.60 1pcg h LEU 525 N -0.35 0.78 -1.02 0.26 5.85 -0.50 -0.80 115.31 119.54 1pcg h LEU 525 Ca -0.01 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 1pcg h LEU 525 Cb 0.33 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1pcg h LEU 525 CO 0.01 0.55 0.12 0.22 -0.34 0.00 0.00 178.44 179.00 1pcg h TYR 526 N 0.93 0.86 -0.25 1.25 3.20 -0.82 -2.13 116.97 120.00 1pcg h TYR 526 Ca 0.28 -0.08 -0.16 0.00 3.14 0.00 0.00 58.73 61.91 1pcg h TYR 526 Cb -0.03 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.00 1pcg h TYR 526 CO -0.03 0.72 -0.47 0.66 -1.64 0.00 0.00 178.16 177.40 1pcg h SER 527 N 0.80 0.84 -0.33 -2.11 4.64 -0.72 -2.79 113.55 113.88 1pcg h SER 527 Ca 0.17 -0.54 0.06 0.00 -0.47 0.00 0.00 61.79 61.01 1pcg h SER 527 Cb 0.30 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 1pcg h SER 527 CO -0.00 1.22 0.23 0.24 -0.87 0.00 0.00 176.83 177.65 1pcg h MET 528 N 0.49 0.20 0.00 4.77 2.86 -0.90 -1.23 114.93 121.11 1pcg h MET 528 Ca 0.01 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1pcg h MET 528 Cb 1.08 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.69 1pcg h MET 528 CO 0.11 0.13 -0.00 -0.22 1.06 0.00 0.00 176.91 177.98 1pcg h LYS 529 N 0.20 -0.01 -0.68 1.72 3.64 -1.17 -2.70 116.57 117.57 1pcg h LYS 529 Ca 0.15 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.66 1pcg h LYS 529 Cb 0.33 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.06 1pcg h LYS 529 CO -0.03 0.34 0.22 0.77 -2.27 0.00 0.00 179.45 178.48 1pcg h SER 530 N -0.35 0.15 0.04 4.20 0.02 -1.01 0.44 113.55 117.04 1pcg h SER 530 Ca -0.00 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1pcg h SER 530 Cb 0.34 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.00 1pcg h SER 530 CO 0.00 0.06 0.00 0.29 -1.14 0.00 0.00 176.83 176.04 1pcg n LYS 531 N -5.06 0.36 -3.64 3.45 4.01 -0.68 -4.87 118.16 111.73 1pcg n LYS 531 Ca 0.12 0.03 -0.24 0.00 -0.51 0.00 0.00 58.31 57.71 1pcg n LYS 531 Cb 0.37 -1.50 0.04 0.00 -0.51 0.00 0.00 35.03 33.43 1pcg n LYS 531 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1pcg n ASN 532 N -1.05 -3.36 -0.00 4.39 3.02 0.15 -4.88 115.26 113.53 1pcg n ASN 532 Ca 0.09 -0.88 0.01 0.00 -0.03 0.00 0.00 54.58 53.76 1pcg n ASN 532 Cb 0.05 -3.93 -0.01 0.00 -0.61 0.00 0.00 39.78 35.28 1pcg n ASN 532 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1pcg n VAL 533 N -4.09 0.00 -4.05 2.41 0.31 -1.03 -5.01 118.33 106.87 1pcg n VAL 533 Ca -0.19 -0.09 -0.35 0.00 -0.01 0.00 0.00 64.34 63.70 1pcg n VAL 533 Cb 0.64 0.55 -0.09 0.00 -0.91 0.00 0.00 33.84 34.03 1pcg n VAL 533 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1pcg s VAL 534 N -1.93 4.81 0.06 2.52 1.01 -1.25 -4.61 120.40 121.00 1pcg s VAL 534 Ca -0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 61.98 61.63 1pcg s VAL 534 Cb 0.01 -3.14 -0.07 0.00 0.00 0.00 0.00 36.38 33.18 1pcg s VAL 534 CO 0.04 0.50 1.46 -2.84 0.00 0.00 0.00 175.10 174.27 1pcg s PRO 535 N 0.01 4.27 -1.07 2.72 0.02 -1.26 -4.89 135.00 134.80 1pcg s PRO 535 Ca 0.06 2.09 -0.24 0.00 0.02 0.00 0.00 61.00 62.93 1pcg s PRO 535 Cb -0.12 -3.47 -0.10 0.00 0.02 0.00 0.00 34.50 30.83 1pcg s PRO 535 CO 0.01 -0.57 2.00 -0.51 -0.33 0.00 0.00 177.00 177.60 1pcg s LEU 536 N 2.02 2.96 0.02 -5.54 2.01 -1.26 -4.93 118.68 113.95 1pcg s LEU 536 Ca 0.66 -1.19 -0.30 0.00 0.01 0.00 0.00 54.13 53.32 1pcg s LEU 536 Cb -0.35 -2.58 -0.04 0.00 0.01 0.00 0.00 46.19 43.23 1pcg s LEU 536 CO 0.29 -3.32 1.06 -0.31 1.01 0.00 0.00 176.35 175.08 1pcg s TYR 537 N 12.02 3.56 0.08 0.29 2.02 -1.26 -4.98 117.35 129.08 1pcg s TYR 537 Ca 0.73 1.54 -0.28 0.00 -0.37 0.00 0.00 57.07 58.69 1pcg s TYR 537 Cb -0.04 -3.23 -0.12 0.00 -0.40 0.00 0.00 41.96 38.17 1pcg s TYR 537 CO 0.10 -0.49 1.44 -0.44 -1.57 0.00 0.00 175.55 174.59 1pcg h ASP 538 N 6.83 -1.29 -0.58 2.29 3.32 -2.00 -1.37 116.42 123.63 1pcg h ASP 538 Ca -0.41 0.14 -0.06 0.00 0.02 0.00 0.00 57.03 56.72 1pcg h ASP 538 Cb 1.21 0.48 -0.02 0.00 0.22 0.00 0.00 39.33 41.22 1pcg h ASP 538 CO 0.78 -0.44 0.14 0.25 -1.72 0.00 0.00 179.24 178.25 1pcg h LEU 539 N -0.59 0.88 -0.41 1.55 5.85 -1.96 -2.20 115.31 118.43 1pcg h LEU 539 Ca -0.00 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.52 1pcg h LEU 539 Cb 0.60 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 1pcg h LEU 539 CO -0.24 0.89 0.19 0.25 -0.34 0.00 0.00 178.44 179.18 1pcg h LEU 540 N 0.84 0.26 -0.63 2.25 5.85 -1.88 -2.13 115.31 119.87 1pcg h LEU 540 Ca 0.18 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 1pcg h LEU 540 Cb 0.35 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1pcg h LEU 540 CO 0.00 0.19 0.21 -0.07 -0.34 0.00 0.00 178.44 178.44 1pcg h LEU 541 N 0.38 0.90 -0.49 2.25 3.38 -1.13 0.11 115.31 120.71 1pcg h LEU 541 Ca 0.18 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1pcg h LEU 541 Cb 0.11 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1pcg h LEU 541 CO -0.14 0.85 0.26 -0.08 0.09 0.00 0.00 178.44 179.42 1pcg h GLU 542 N 0.89 0.49 -0.72 1.13 4.81 -1.06 0.44 114.58 120.56 1pcg h GLU 542 Ca 0.20 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.36 1pcg h GLU 542 Cb 0.26 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 1pcg h GLU 542 CO -0.01 0.33 0.28 0.52 -0.73 0.00 0.00 179.01 179.40 1pcg h MET 543 N 0.51 1.08 -0.32 1.92 2.86 -1.15 -0.47 114.93 119.35 1pcg h MET 543 Ca 0.21 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1pcg h MET 543 Cb 0.10 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1pcg h MET 543 CO -0.14 0.88 0.08 1.25 1.06 0.00 0.00 176.91 180.05 1pcg h LEU 544 N 1.05 0.48 -0.88 1.22 5.85 0.52 -3.08 115.31 120.47 1pcg h LEU 544 Ca 0.24 -0.22 -0.12 0.00 0.84 0.00 0.00 57.88 58.62 1pcg h LEU 544 Cb 0.21 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1pcg h LEU 544 CO -0.02 0.58 -0.53 0.44 -0.34 0.00 0.00 178.44 178.57 1pcg h ASP 545 N 0.36 0.08 -0.82 1.25 3.32 0.08 -3.27 116.42 117.42 1pcg h ASP 545 Ca 0.10 -0.04 0.22 0.00 0.02 0.00 0.00 57.03 57.33 1pcg h ASP 545 Cb 0.28 -0.02 -0.15 0.00 0.22 0.00 0.00 39.33 39.66 1pcg h ASP 545 CO -0.00 0.59 0.00 0.00 -1.72 0.00 0.00 179.24 178.12 1pcg n ALA 546 N -2.45 0.41 1.04 3.45 0.00 -0.21 -5.10 120.51 117.65 1pcg n ALA 546 Ca -0.02 0.88 0.08 0.00 0.00 0.00 0.00 53.44 54.39 1pcg n ALA 546 Cb 0.55 -0.64 0.49 0.00 0.00 0.00 0.00 19.45 19.85 1pcg n ALA 546 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22