#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qe4 h ALA 307 N 0.00 0.67 0.00 -1.18 0.00 -1.98 -3.25 119.26 113.51 2qe4 h ALA 307 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2qe4 h ALA 307 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2qe4 h ALA 307 CO 0.00 0.63 0.00 1.28 0.00 0.00 0.00 179.25 181.16 2qe4 n LEU 308 N -3.04 0.68 0.00 0.00 4.77 -1.26 -2.33 117.00 115.82 2qe4 n LEU 308 Ca -0.02 0.70 0.10 0.00 -0.03 0.00 0.00 56.01 56.76 2qe4 n LEU 308 Cb 0.74 -0.66 -0.06 0.00 -2.33 0.00 0.00 43.42 41.12 2qe4 n LEU 308 CO 0.41 -0.69 -0.02 -1.54 -1.33 0.00 0.00 177.39 174.22 2qe4 n SER 309 N -2.29 0.83 -4.78 -1.43 3.41 -1.23 -4.96 113.62 103.17 2qe4 n SER 309 Ca 0.01 -0.77 -0.35 0.00 -0.26 0.00 0.00 58.87 57.50 2qe4 n SER 309 Cb 0.18 0.94 -0.01 0.00 -0.26 0.00 0.00 64.21 65.06 2qe4 n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qe4 s LEU 310 N -3.16 3.81 0.57 1.04 1.43 -0.98 -5.04 118.68 116.35 2qe4 s LEU 310 Ca 0.07 2.12 -0.05 0.00 -1.03 0.00 0.00 54.13 55.24 2qe4 s LEU 310 Cb 0.16 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.85 2qe4 s LEU 310 CO 0.84 -1.05 0.87 0.42 0.23 0.00 0.00 176.35 177.66 2qe4 s THR 311 N -1.80 3.84 0.23 5.49 -4.23 -1.26 -4.84 115.64 113.07 2qe4 s THR 311 Ca 0.70 0.01 -0.06 0.00 -1.18 0.00 0.00 61.69 61.16 2qe4 s THR 311 Cb -0.22 -3.51 0.20 0.00 1.34 0.00 0.00 72.50 70.30 2qe4 s THR 311 CO 0.26 -0.51 1.73 0.00 -0.54 0.00 0.00 174.62 175.56 2qe4 h ALA 312 N -0.09 0.96 -0.21 3.99 0.00 -1.95 0.03 119.26 121.99 2qe4 h ALA 312 Ca -0.46 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 2qe4 h ALA 312 Cb 1.25 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2qe4 h ALA 312 CO 0.61 -0.21 -0.14 -0.44 0.00 0.00 0.00 179.25 179.06 2qe4 h ASP 313 N 0.42 0.33 0.02 0.00 3.32 -1.96 -2.32 116.42 116.23 2qe4 h ASP 313 Ca 0.38 -0.08 -0.19 0.00 0.02 0.00 0.00 57.03 57.16 2qe4 h ASP 313 Cb 0.55 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.02 2qe4 h ASP 313 CO -0.38 0.51 -0.70 1.56 -1.72 0.00 0.00 179.24 178.51 2qe4 h GLN 314 N 0.32 0.61 -0.26 3.56 4.20 -1.45 -1.25 115.11 120.85 2qe4 h GLN 314 Ca 0.06 -0.47 -0.02 0.00 0.06 0.00 0.00 58.65 58.29 2qe4 h GLN 314 Cb 0.45 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 2qe4 h GLN 314 CO 0.03 1.09 0.10 1.98 -0.67 0.00 0.00 178.83 181.35 2qe4 h MET 315 N 0.43 0.39 -0.06 1.46 4.05 -0.84 0.23 114.93 120.60 2qe4 h MET 315 Ca -0.03 -0.07 -0.01 0.00 -0.28 0.00 0.00 59.70 59.31 2qe4 h MET 315 Cb 1.29 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 32.02 2qe4 h MET 315 CO 0.13 0.44 0.01 0.28 0.23 0.00 0.00 176.91 178.00 2qe4 h VAL 316 N 0.26 1.20 -1.00 -5.77 2.07 -1.44 -0.04 116.25 111.53 2qe4 h VAL 316 Ca 0.09 -0.60 0.05 0.00 0.82 0.00 0.00 66.70 67.05 2qe4 h VAL 316 Cb 0.20 1.49 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 2qe4 h VAL 316 CO -0.01 0.17 0.65 -1.28 0.02 0.00 0.00 177.57 177.12 2qe4 h SER 317 N -0.13 1.07 -0.15 0.57 0.87 -1.13 0.15 113.55 114.81 2qe4 h SER 317 Ca 0.02 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 2qe4 h SER 317 Cb 0.25 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2qe4 h SER 317 CO 0.00 0.72 0.03 0.00 -0.53 0.00 0.00 176.83 177.05 2qe4 h ALA 318 N 1.43 0.19 -0.57 6.23 0.00 -0.35 -2.32 119.26 123.87 2qe4 h ALA 318 Ca 0.41 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.18 2qe4 h ALA 318 Cb 0.06 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2qe4 h ALA 318 CO -0.14 -0.15 0.37 -0.07 0.00 0.00 0.00 179.25 179.26 2qe4 h LEU 319 N 0.03 0.64 -0.47 0.00 3.38 -0.16 -2.14 115.31 116.58 2qe4 h LEU 319 Ca 0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2qe4 h LEU 319 Cb 0.29 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2qe4 h LEU 319 CO 0.00 0.46 0.31 -0.07 0.09 0.00 0.00 178.44 179.23 2qe4 h LEU 320 N 0.75 0.54 -1.53 1.67 3.38 -0.72 -2.54 115.31 116.86 2qe4 h LEU 320 Ca 0.22 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2qe4 h LEU 320 Cb -0.06 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2qe4 h LEU 320 CO -0.06 0.39 -0.03 0.44 0.09 0.00 0.00 178.44 179.27 2qe4 h ASP 321 N 0.63 0.00 1.77 -0.43 5.19 -1.13 -2.74 116.42 119.71 2qe4 h ASP 321 Ca 0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 2qe4 h ASP 321 Cb -0.07 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.44 2qe4 h ASP 321 CO -0.04 0.03 -0.23 0.00 -3.12 0.00 0.00 179.24 175.88 2qe4 h ALA 322 N 1.97 0.89 -0.98 3.45 0.00 -0.97 -3.48 119.26 120.14 2qe4 h ALA 322 Ca -0.00 0.00 -0.81 0.00 0.00 0.00 0.00 54.91 54.10 2qe4 h ALA 322 Cb 0.50 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.33 2qe4 h ALA 322 CO 0.00 0.00 0.29 0.39 0.00 0.00 0.00 179.25 179.93 2qe4 n GLU 323 N -3.00 0.00 -1.37 0.00 -0.58 -1.04 -4.74 120.64 109.92 2qe4 n GLU 323 Ca 0.03 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.46 2qe4 n GLU 323 Cb 0.53 -1.47 0.08 0.00 -0.57 0.00 0.00 31.44 30.01 2qe4 n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2qe4 s PRO 324 N 1.11 2.46 0.48 3.49 0.04 -1.26 -5.04 135.00 136.28 2qe4 s PRO 324 Ca 0.94 1.12 -0.07 0.00 0.04 0.00 0.00 61.00 63.04 2qe4 s PRO 324 Cb -1.33 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 2qe4 s PRO 324 CO 0.65 -1.48 0.81 -1.25 0.04 0.00 0.00 177.00 175.77 2qe4 s PRO 325 N -4.90 3.59 -0.58 0.56 0.04 -1.26 -5.01 135.00 127.45 2qe4 s PRO 325 Ca 0.61 0.31 -0.28 0.00 0.04 0.00 0.00 61.00 61.67 2qe4 s PRO 325 Cb -0.16 -2.35 0.03 0.00 0.04 0.00 0.00 34.50 32.05 2qe4 s PRO 325 CO 0.55 -0.21 1.22 0.42 0.04 0.00 0.00 177.00 179.02 2qe4 s ILE 326 N -2.71 3.99 0.68 0.56 1.01 -1.26 -5.01 121.20 118.47 2qe4 s ILE 326 Ca 0.49 0.89 -0.11 0.00 0.00 0.00 0.00 60.65 61.92 2qe4 s ILE 326 Cb -0.10 -4.70 -0.00 0.00 0.01 0.00 0.00 42.46 37.67 2qe4 s ILE 326 CO 0.43 -1.32 1.06 -0.76 0.00 0.00 0.00 174.94 174.35 2qe4 s LEU 327 N 5.06 3.10 0.05 2.97 1.43 -1.26 -4.96 118.68 125.08 2qe4 s LEU 327 Ca 0.44 1.51 0.02 0.00 -1.03 0.00 0.00 54.13 55.07 2qe4 s LEU 327 Cb -0.08 -4.41 -0.04 0.00 0.03 0.00 0.00 46.19 41.69 2qe4 s LEU 327 CO 0.26 -1.32 0.09 -0.31 0.23 0.00 0.00 176.35 175.29 2qe4 s TYR 328 N -3.11 3.24 -0.06 0.29 1.51 -1.26 -4.35 117.35 113.62 2qe4 s TYR 328 Ca 0.57 0.13 -0.30 0.00 -1.01 0.00 0.00 57.07 56.46 2qe4 s TYR 328 Cb -0.13 -1.67 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 2qe4 s TYR 328 CO 0.55 0.53 1.21 0.45 -1.11 0.00 0.00 175.55 177.18 2qe4 s SER 329 N -2.20 7.04 0.06 2.29 0.15 -1.26 -4.91 113.70 114.87 2qe4 s SER 329 Ca 0.28 1.81 -0.34 0.00 0.70 0.00 0.00 55.95 58.39 2qe4 s SER 329 Cb -0.12 -2.56 -0.18 0.00 -1.71 0.00 0.00 66.02 61.45 2qe4 s SER 329 CO 0.20 -0.60 1.52 -0.33 1.20 0.00 0.00 173.24 175.23 2qe4 h GLU 330 N 7.52 -1.09 0.00 5.44 5.08 -1.96 -3.48 114.58 126.10 2qe4 h GLU 330 Ca -0.33 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2qe4 h GLU 330 Cb 1.16 0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.65 2qe4 h GLU 330 CO 0.89 -0.73 0.00 0.45 -1.00 0.00 0.00 179.01 178.62 2qe4 n SER 341 N -5.32 0.00 0.09 1.42 2.88 -1.26 -5.09 113.62 106.34 2qe4 n SER 341 Ca -0.14 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.27 2qe4 n SER 341 Cb 0.47 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.85 2qe4 n SER 341 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 2qe4 h MET 342 N 0.00 -0.13 -0.67 -1.46 0.00 -2.02 -2.65 114.93 108.00 2qe4 h MET 342 Ca 0.00 0.01 0.07 0.00 0.00 0.00 0.00 59.70 59.78 2qe4 h MET 342 Cb 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 31.60 31.59 2qe4 h MET 342 CO 0.00 -0.08 0.45 0.52 0.00 0.00 0.00 176.91 177.79 2qe4 h MET 343 N -0.14 0.64 -0.20 1.72 0.00 -2.03 -1.96 114.93 112.96 2qe4 h MET 343 Ca -0.01 -0.04 -0.06 0.00 0.00 0.00 0.00 59.70 59.59 2qe4 h MET 343 Cb 0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 31.60 31.55 2qe4 h MET 343 CO 0.02 0.42 -0.13 0.78 0.00 0.00 0.00 176.91 178.00 2qe4 h GLY 344 N 0.66 0.35 0.77 8.32 0.00 -1.91 -0.53 103.07 110.73 2qe4 h GLY 344 Ca 0.30 -0.23 -0.12 0.00 0.00 0.00 0.00 47.33 47.27 2qe4 h GLY 344 CO -0.09 0.21 -0.44 1.41 0.00 0.00 0.00 176.54 177.63 2qe4 h LEU 345 N 0.31 0.50 -0.58 3.11 3.38 -1.18 -1.40 115.31 119.44 2qe4 h LEU 345 Ca 0.06 -0.67 -0.03 0.00 0.09 0.00 0.00 57.88 57.33 2qe4 h LEU 345 Cb 0.43 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2qe4 h LEU 345 CO 0.02 1.09 0.24 -0.07 0.09 0.00 0.00 178.44 179.82 2qe4 h LEU 346 N -0.06 0.78 -0.36 1.67 3.38 -1.26 0.27 115.31 119.73 2qe4 h LEU 346 Ca -0.04 -0.16 -0.19 0.00 0.09 0.00 0.00 57.88 57.59 2qe4 h LEU 346 Cb 1.10 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 2qe4 h LEU 346 CO 0.09 0.73 -0.65 0.71 0.09 0.00 0.00 178.44 179.40 2qe4 h THR 347 N 0.79 1.32 -0.23 0.22 1.35 -1.17 0.56 112.91 115.75 2qe4 h THR 347 Ca 0.19 -1.92 -0.02 0.00 -0.55 0.00 0.00 66.41 64.12 2qe4 h THR 347 Cb 0.18 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.47 2qe4 h THR 347 CO -0.02 0.60 0.08 -1.13 -0.25 0.00 0.00 175.52 174.80 2qe4 h ASN 348 N 0.46 0.32 -0.56 5.36 -0.73 -1.04 0.23 115.58 119.63 2qe4 h ASN 348 Ca -0.02 -0.19 -0.04 0.00 1.87 0.00 0.00 56.30 57.93 2qe4 h ASN 348 Cb 1.24 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 39.72 2qe4 h ASN 348 CO 0.13 0.43 0.21 0.25 -0.37 0.00 0.00 177.43 178.08 2qe4 h LEU 349 N 0.20 0.78 -0.78 0.34 5.85 -0.34 -1.94 115.31 119.42 2qe4 h LEU 349 Ca 0.07 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.55 2qe4 h LEU 349 Cb 0.22 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2qe4 h LEU 349 CO -0.00 0.75 0.17 0.00 -0.34 0.00 0.00 178.44 179.01 2qe4 h ALA 350 N 1.06 1.00 -0.14 1.25 0.00 0.34 -0.78 119.26 122.00 2qe4 h ALA 350 Ca 0.18 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 2qe4 h ALA 350 Cb 0.22 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2qe4 h ALA 350 CO -0.01 0.65 -0.52 0.22 0.00 0.00 0.00 179.25 179.59 2qe4 h ASP 351 N 1.03 0.42 -0.03 0.00 1.82 -0.35 -0.99 116.42 118.31 2qe4 h ASP 351 Ca 0.22 -0.21 -0.18 0.00 -0.39 0.00 0.00 57.03 56.47 2qe4 h ASP 351 Cb 0.36 -0.12 -0.00 0.00 0.68 0.00 0.00 39.33 40.25 2qe4 h ASP 351 CO 0.00 0.86 -0.59 0.03 -1.61 0.00 0.00 179.24 177.93 2qe4 h ARG 352 N 0.30 0.63 -0.37 0.28 3.08 -1.15 -2.98 114.38 114.17 2qe4 h ARG 352 Ca 0.01 -0.42 -0.04 0.00 0.07 0.00 0.00 59.98 59.59 2qe4 h ARG 352 Cb 1.02 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 2qe4 h ARG 352 CO 0.09 1.04 0.05 0.93 -1.07 0.00 0.00 179.97 181.01 2qe4 h GLU 353 N 0.47 0.56 -0.71 0.04 5.08 -0.84 -3.03 114.58 116.15 2qe4 h GLU 353 Ca -0.00 -0.11 0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2qe4 h GLU 353 Cb 1.16 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 2qe4 h GLU 353 CO 0.12 0.55 0.47 -0.07 -1.00 0.00 0.00 179.01 179.07 2qe4 h LEU 354 N 0.54 0.69 -0.62 1.33 3.38 -1.02 -1.88 115.31 117.73 2qe4 h LEU 354 Ca 0.12 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2qe4 h LEU 354 Cb 0.27 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2qe4 h LEU 354 CO 0.00 0.46 0.35 0.58 0.09 0.00 0.00 178.44 179.92 2qe4 h VAL 355 N 0.79 1.19 -0.50 1.22 2.07 -1.60 -2.64 116.25 116.79 2qe4 h VAL 355 Ca 0.29 -0.48 -0.13 0.00 0.82 0.00 0.00 66.70 67.21 2qe4 h VAL 355 Cb 0.16 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2qe4 h VAL 355 CO -0.09 0.21 -0.20 0.45 0.02 0.00 0.00 177.57 177.96 2qe4 h HIS 356 N 0.84 1.16 -0.32 1.57 3.86 -1.56 -3.17 115.15 117.53 2qe4 h HIS 356 Ca 0.22 -0.27 0.07 0.00 -1.16 0.00 0.00 60.37 59.22 2qe4 h HIS 356 Cb 0.03 -0.27 -0.06 0.00 1.06 0.00 0.00 27.41 28.16 2qe4 h HIS 356 CO -0.01 1.11 -0.10 1.98 0.86 0.00 0.00 177.93 181.77 2qe4 h MET 357 N 0.88 -0.03 -0.22 2.45 -1.53 -1.01 0.16 114.93 115.63 2qe4 h MET 357 Ca 0.12 0.00 0.06 0.00 -3.44 0.00 0.00 59.70 56.44 2qe4 h MET 357 Cb 0.78 0.01 -0.06 0.00 -0.55 0.00 0.00 31.60 31.77 2qe4 h MET 357 CO 0.06 -0.02 -0.17 0.82 0.14 0.00 0.00 176.91 177.75 2qe4 h ILE 358 N -0.03 0.53 0.00 1.77 2.04 -1.48 0.36 117.51 120.70 2qe4 h ILE 358 Ca 0.16 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.99 2qe4 h ILE 358 Cb 0.26 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 2qe4 h ILE 358 CO -0.34 0.00 -0.11 0.78 0.00 0.00 0.00 178.15 178.48 2qe4 h ASN 359 N -0.17 0.00 -0.09 1.72 2.35 -1.40 -1.49 115.58 116.50 2qe4 h ASN 359 Ca 0.13 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.66 2qe4 h ASN 359 Cb 0.36 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.75 2qe4 h ASN 359 CO -0.33 0.11 -0.82 -0.25 -1.65 0.00 0.00 177.43 174.49 2qe4 h TRP 360 N 0.00 1.00 -0.55 1.19 7.01 0.11 -3.21 115.95 121.49 2qe4 h TRP 360 Ca -0.00 -0.48 0.06 0.00 2.11 0.00 0.00 58.89 60.58 2qe4 h TRP 360 Cb 0.26 -0.14 -0.05 0.00 -2.10 0.00 0.00 29.16 27.13 2qe4 h TRP 360 CO 0.00 1.31 0.26 0.00 -2.79 0.00 0.00 178.44 177.22 2qe4 h ALA 361 N 0.48 0.71 0.00 2.65 0.00 0.64 0.18 119.26 123.92 2qe4 h ALA 361 Ca -0.08 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qe4 h ALA 361 Cb 1.47 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.22 2qe4 h ALA 361 CO 0.17 -0.11 0.00 0.87 0.00 0.00 0.00 179.25 180.18 2qe4 h LYS 362 N 0.49 0.00 -0.00 0.00 1.57 -1.46 0.26 116.57 117.42 2qe4 h LYS 362 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2qe4 h LYS 362 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2qe4 h LYS 362 CO -0.21 0.00 -0.58 0.54 -0.57 0.00 0.00 179.45 178.63 2qe4 n ARG 363 N -2.85 0.20 -2.29 3.15 5.12 0.01 -4.57 116.66 115.43 2qe4 n ARG 363 Ca -0.02 -0.13 -0.43 0.00 -1.93 0.00 0.00 57.85 55.34 2qe4 n ARG 363 Cb 0.09 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 29.86 2qe4 n ARG 363 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2qe4 s VAL 364 N -2.89 3.80 -0.04 1.55 1.01 0.91 -4.86 120.40 119.87 2qe4 s VAL 364 Ca 0.13 0.79 -0.39 0.00 0.00 0.00 0.00 61.98 62.51 2qe4 s VAL 364 Cb 0.17 -4.15 -0.17 0.00 0.00 0.00 0.00 36.38 32.23 2qe4 s VAL 364 CO 0.71 -0.78 1.37 -2.65 0.00 0.00 0.00 175.10 173.75 2qe4 n PRO 365 N 8.27 0.81 0.00 2.72 -0.02 -1.26 -0.34 135.00 145.17 2qe4 n PRO 365 Ca 0.17 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2qe4 n PRO 365 Cb 0.48 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 2qe4 n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qe4 n GLY 366 N 2.71 3.27 0.35 -1.23 0.00 -1.26 -4.95 105.19 104.08 2qe4 n GLY 366 Ca 0.21 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 2qe4 n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2qe4 h PHE 367 N 0.00 -0.77 0.00 1.61 3.57 -0.97 -3.17 116.94 117.21 2qe4 h PHE 367 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2qe4 h PHE 367 Cb 0.00 0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.99 2qe4 h PHE 367 CO 0.00 -0.43 0.00 1.33 -2.23 0.00 0.00 178.31 176.98 2qe4 n VAL 368 N -5.37 1.50 1.64 1.41 0.24 -1.26 -1.77 118.33 114.72 2qe4 n VAL 368 Ca -0.12 0.37 0.08 0.00 -2.04 0.00 0.00 64.34 62.63 2qe4 n VAL 368 Cb 0.36 -1.36 0.37 0.00 -1.47 0.00 0.00 33.84 31.74 2qe4 n VAL 368 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2qe4 n ASP 369 N -1.39 0.71 -4.98 -1.34 8.00 -1.20 -4.86 116.55 111.49 2qe4 n ASP 369 Ca 0.00 -1.66 -0.20 0.00 0.71 0.00 0.00 54.79 53.65 2qe4 n ASP 369 Cb 0.01 -0.06 -0.01 0.00 -0.02 0.00 0.00 41.12 41.04 2qe4 n ASP 369 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qe4 s LEU 370 N -1.43 4.11 0.46 0.64 1.43 -0.73 -5.06 118.68 118.10 2qe4 s LEU 370 Ca 0.25 -0.09 -0.23 0.00 -1.03 0.00 0.00 54.13 53.03 2qe4 s LEU 370 Cb 0.12 -2.78 -0.08 0.00 0.03 0.00 0.00 46.19 43.48 2qe4 s LEU 370 CO 0.19 -0.27 1.12 0.42 0.23 0.00 0.00 176.35 178.04 2qe4 s THR 371 N -2.10 3.33 0.28 5.49 -4.23 -1.26 -4.79 115.64 112.36 2qe4 s THR 371 Ca 0.40 0.97 0.01 0.00 -1.18 0.00 0.00 61.69 61.89 2qe4 s THR 371 Cb -0.09 -3.47 0.28 0.00 1.34 0.00 0.00 72.50 70.55 2qe4 s THR 371 CO 0.30 -0.05 1.68 0.25 -0.54 0.00 0.00 174.62 176.27 2qe4 h LEU 372 N 2.01 0.17 -1.28 4.79 6.46 -1.98 0.24 115.31 125.72 2qe4 h LEU 372 Ca -0.49 0.16 0.04 0.00 -0.12 0.00 0.00 57.88 57.46 2qe4 h LEU 372 Cb 1.24 0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 41.30 2qe4 h LEU 372 CO 0.60 -0.04 0.51 -0.74 -0.62 0.00 0.00 178.44 178.15 2qe4 h HIS 373 N 0.33 0.91 0.00 1.25 2.76 -1.99 -0.42 115.15 117.98 2qe4 h HIS 373 Ca 0.51 0.02 -0.24 0.00 -2.20 0.00 0.00 60.37 58.46 2qe4 h HIS 373 Cb 0.95 -0.30 0.01 0.00 1.55 0.00 0.00 27.41 29.62 2qe4 h HIS 373 CO -0.20 0.53 -0.99 -0.44 -1.30 0.00 0.00 177.93 175.52 2qe4 h ASP 374 N 0.94 0.68 -0.67 3.26 3.32 -0.96 -1.72 116.42 121.26 2qe4 h ASP 374 Ca 0.31 -0.55 0.01 0.00 0.02 0.00 0.00 57.03 56.82 2qe4 h ASP 374 Cb 0.05 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 2qe4 h ASP 374 CO -0.09 1.35 0.44 1.56 -1.72 0.00 0.00 179.24 180.78 2qe4 h GLN 375 N 0.29 0.86 -0.25 3.56 4.20 -0.54 -0.32 115.11 122.91 2qe4 h GLN 375 Ca -0.10 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.41 2qe4 h GLN 375 Cb 1.63 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 29.21 2qe4 h GLN 375 CO 0.18 0.57 -0.46 0.28 -0.67 0.00 0.00 178.83 178.73 2qe4 h VAL 376 N 0.88 1.30 -0.52 -0.54 2.07 -1.06 -2.54 116.25 115.84 2qe4 h VAL 376 Ca 0.25 -1.66 -0.08 0.00 0.82 0.00 0.00 66.70 66.03 2qe4 h VAL 376 Cb -0.07 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2qe4 h VAL 376 CO -0.07 0.53 -0.00 -0.74 0.02 0.00 0.00 177.57 177.31 2qe4 h HIS 377 N 0.51 1.01 -0.30 1.57 -0.00 -0.93 -0.95 115.15 116.06 2qe4 h HIS 377 Ca 0.03 -0.18 -0.07 0.00 -0.00 0.00 0.00 60.37 60.16 2qe4 h HIS 377 Cb 1.00 -0.26 -0.02 0.00 -0.00 0.00 0.00 27.41 28.13 2qe4 h HIS 377 CO 0.05 0.93 -0.11 -0.07 -0.00 0.00 0.00 177.93 178.73 2qe4 h LEU 378 N 0.80 0.48 0.04 0.26 3.38 -0.99 -1.93 115.31 117.36 2qe4 h LEU 378 Ca 0.15 -0.12 -0.28 0.00 0.09 0.00 0.00 57.88 57.72 2qe4 h LEU 378 Cb 0.53 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 41.17 2qe4 h LEU 378 CO 0.03 0.63 -1.16 -0.07 0.09 0.00 0.00 178.44 177.95 2qe4 h LEU 379 N 0.47 0.74 -1.36 1.67 3.38 -1.29 -2.34 115.31 116.57 2qe4 h LEU 379 Ca 0.09 -0.67 -0.06 0.00 0.09 0.00 0.00 57.88 57.33 2qe4 h LEU 379 Cb 0.47 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2qe4 h LEU 379 CO 0.03 1.48 -0.23 -0.33 0.09 0.00 0.00 178.44 179.48 2qe4 h GLU 380 N 0.25 0.13 -0.02 1.13 5.08 -1.07 -1.17 114.58 118.92 2qe4 h GLU 380 Ca -0.15 -0.04 -0.21 0.00 -1.00 0.00 0.00 59.36 57.96 2qe4 h GLU 380 Cb 1.83 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 31.08 2qe4 h GLU 380 CO 0.21 0.36 -0.81 1.03 -1.00 0.00 0.00 179.01 178.80 2qe4 h SER 381 N 0.12 0.74 -0.01 1.42 0.87 -1.33 -3.39 113.55 111.97 2qe4 h SER 381 Ca 0.02 -0.73 0.00 0.00 -1.23 0.00 0.00 61.79 59.85 2qe4 h SER 381 Cb 0.48 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 2qe4 h SER 381 CO 0.03 1.38 -0.48 0.00 -0.53 0.00 0.00 176.83 177.24 2qe4 n ALA 382 N -2.62 3.46 -0.31 6.23 0.00 -0.89 -4.75 120.51 121.64 2qe4 n ALA 382 Ca -0.10 -0.47 0.17 0.00 0.00 0.00 0.00 53.44 53.04 2qe4 n ALA 382 Cb 0.77 -0.53 0.35 0.00 0.00 0.00 0.00 19.45 20.05 2qe4 n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2qe4 h TRP 383 N 0.93 0.47 -0.01 0.00 5.08 -1.42 0.44 115.95 121.44 2qe4 h TRP 383 Ca 0.00 0.05 -0.18 0.00 1.08 0.00 0.00 58.89 59.84 2qe4 h TRP 383 Cb 0.44 -0.06 -0.01 0.00 -3.00 0.00 0.00 29.16 26.52 2qe4 h TRP 383 CO 0.00 -0.25 -0.81 1.25 -1.28 0.00 0.00 178.44 177.35 2qe4 h LEU 384 N 0.20 0.20 -0.63 0.11 5.85 -1.86 -1.08 115.31 118.09 2qe4 h LEU 384 Ca 0.62 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 59.08 2qe4 h LEU 384 Cb 1.33 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 2qe4 h LEU 384 CO -0.68 0.92 -0.12 -0.33 -0.34 0.00 0.00 178.44 177.89 2qe4 h GLU 385 N 0.09 0.95 -0.19 1.25 5.08 -1.32 -0.87 114.58 119.58 2qe4 h GLU 385 Ca -0.03 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 57.97 2qe4 h GLU 385 Cb 1.41 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 2qe4 h GLU 385 CO 0.12 1.01 0.07 0.82 -1.00 0.00 0.00 179.01 180.02 2qe4 h ILE 386 N 0.85 1.18 -0.48 3.13 2.04 -0.86 0.13 117.51 123.50 2qe4 h ILE 386 Ca 0.13 -0.55 0.02 0.00 1.00 0.00 0.00 64.86 65.46 2qe4 h ILE 386 Cb 0.66 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 2qe4 h ILE 386 CO 0.05 0.17 0.29 -0.07 0.00 0.00 0.00 178.15 178.59 2qe4 h LEU 387 N 0.14 0.48 -0.52 1.44 3.38 -1.07 -2.30 115.31 116.86 2qe4 h LEU 387 Ca 0.06 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2qe4 h LEU 387 Cb 0.21 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2qe4 h LEU 387 CO -0.00 0.35 0.25 0.24 0.09 0.00 0.00 178.44 179.36 2qe4 h MET 388 N 0.59 0.74 0.00 1.13 2.86 -0.86 0.01 114.93 119.40 2qe4 h MET 388 Ca 0.19 -0.11 -0.06 0.00 -2.06 0.00 0.00 59.70 57.66 2qe4 h MET 388 Cb -0.01 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 2qe4 h MET 388 CO -0.07 0.62 -0.29 0.97 1.06 0.00 0.00 176.91 179.20 2qe4 h ILE 389 N 0.69 1.13 -0.24 -1.22 2.10 -0.57 0.06 117.51 119.46 2qe4 h ILE 389 Ca 0.18 -1.01 -0.16 0.00 1.08 0.00 0.00 64.86 64.95 2qe4 h ILE 389 Cb 0.12 1.55 0.00 0.00 -1.09 0.00 0.00 36.82 37.41 2qe4 h ILE 389 CO -0.02 0.28 -0.47 1.23 -1.08 0.00 0.00 178.15 178.09 2qe4 h GLY 390 N 0.96 0.80 0.80 8.18 0.00 -0.84 -0.70 103.07 112.27 2qe4 h GLY 390 Ca -0.00 -0.95 -0.00 0.00 0.00 0.00 0.00 47.33 46.37 2qe4 h GLY 390 CO 0.04 0.85 -0.24 -2.00 0.00 0.00 0.00 176.54 175.19 2qe4 h LEU 391 N 0.46 -0.62 -0.95 3.11 5.85 -0.60 -1.67 115.31 120.89 2qe4 h LEU 391 Ca 0.01 0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.88 2qe4 h LEU 391 Cb 1.08 0.20 -0.08 0.00 0.37 0.00 0.00 40.66 42.23 2qe4 h LEU 391 CO 0.10 -0.36 0.59 0.58 -0.34 0.00 0.00 178.44 179.01 2qe4 h VAL 392 N -0.55 0.93 0.08 1.05 2.07 -0.97 -2.55 116.25 116.31 2qe4 h VAL 392 Ca -0.02 -0.33 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2qe4 h VAL 392 Cb 0.48 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2qe4 h VAL 392 CO -0.01 0.17 -0.04 -0.25 0.02 0.00 0.00 177.57 177.46 2qe4 h TRP 393 N 0.95 -0.10 0.00 1.57 2.91 -0.54 -2.65 115.95 118.10 2qe4 h TRP 393 Ca 0.46 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.48 2qe4 h TRP 393 Cb 0.42 0.03 0.00 0.00 -0.51 0.00 0.00 29.16 29.10 2qe4 h TRP 393 CO -0.02 0.01 0.00 2.89 -1.03 0.00 0.00 178.44 180.28 2qe4 n ARG 394 N -5.10 0.34 0.00 2.65 1.85 -0.68 -2.67 116.66 113.05 2qe4 n ARG 394 Ca -0.08 0.08 0.13 0.00 -1.00 0.00 0.00 57.85 56.97 2qe4 n ARG 394 Cb 0.10 -1.50 0.27 0.00 -1.05 0.00 0.00 32.46 30.28 2qe4 n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2qe4 n SER 395 N -1.26 2.25 -0.09 2.89 7.64 -0.98 -4.42 113.62 119.64 2qe4 n SER 395 Ca 0.11 -1.71 0.02 0.00 1.01 0.00 0.00 58.87 58.29 2qe4 n SER 395 Cb 0.16 0.04 0.33 0.00 -1.01 0.00 0.00 64.21 63.73 2qe4 n SER 395 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2qe4 h MET 396 N 3.46 0.73 -1.03 1.43 2.86 -1.44 -2.70 114.93 118.24 2qe4 h MET 396 Ca 0.00 -0.06 -0.59 0.00 -2.06 0.00 0.00 59.70 56.99 2qe4 h MET 396 Cb 0.77 -0.16 -0.28 0.00 0.06 0.00 0.00 31.60 31.98 2qe4 h MET 396 CO 0.00 0.52 0.75 0.39 1.06 0.00 0.00 176.91 179.63 2qe4 n GLU 397 N -4.42 2.44 -2.86 1.72 1.02 -1.26 -4.31 120.64 112.97 2qe4 n GLU 397 Ca 0.05 -3.03 -0.12 0.00 -0.02 0.00 0.00 57.16 54.04 2qe4 n GLU 397 Cb 0.08 -2.19 0.05 0.00 -0.02 0.00 0.00 31.44 29.36 2qe4 n GLU 397 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2qe4 n HIS 398 N -0.92 -2.16 -1.64 -0.32 8.25 -1.02 -5.13 115.22 112.28 2qe4 n HIS 398 Ca 0.59 -2.52 -0.48 0.00 -0.26 0.00 0.00 57.72 55.05 2qe4 n HIS 398 Cb 1.05 1.08 -0.05 0.00 1.12 0.00 0.00 29.99 33.20 2qe4 n HIS 398 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2qe4 n PRO 399 N 0.58 1.81 -0.13 -0.41 -0.04 -1.26 -0.92 135.00 134.63 2qe4 n PRO 399 Ca 0.11 0.65 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 2qe4 n PRO 399 Cb 0.67 -2.38 0.00 0.00 -0.04 0.00 0.00 33.50 31.75 2qe4 n PRO 399 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qe4 n GLY 400 N 3.12 0.90 3.21 0.55 0.00 -1.26 -5.04 105.19 106.67 2qe4 n GLY 400 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 2qe4 n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qe4 s LYS 401 N -0.66 0.96 -0.28 1.61 1.02 -0.10 -3.95 119.74 118.35 2qe4 s LYS 401 Ca 0.00 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 54.71 2qe4 s LYS 401 Cb 0.00 -0.63 0.05 0.00 -0.52 0.00 0.00 37.83 36.73 2qe4 s LYS 401 CO 0.00 0.09 -0.06 -0.51 -0.92 0.00 0.00 175.35 173.96 2qe4 s LEU 402 N -2.72 3.59 -1.15 3.17 1.43 0.52 -4.82 118.68 118.70 2qe4 s LEU 402 Ca 0.10 -1.25 -0.17 0.00 -1.03 0.00 0.00 54.13 51.78 2qe4 s LEU 402 Cb -0.01 -1.64 0.12 0.00 0.03 0.00 0.00 46.19 44.69 2qe4 s LEU 402 CO 0.01 -0.21 1.46 -0.22 0.23 0.00 0.00 176.35 177.62 2qe4 s LEU 403 N 1.21 4.50 0.22 1.79 2.96 -1.26 -1.87 118.68 126.23 2qe4 s LEU 403 Ca -0.06 -2.43 -0.07 0.00 -0.22 0.00 0.00 54.13 51.35 2qe4 s LEU 403 Cb -0.19 -2.47 0.19 0.00 0.50 0.00 0.00 46.19 44.22 2qe4 s LEU 403 CO -0.03 -1.04 1.78 -0.26 -1.32 0.00 0.00 176.35 175.48 2qe4 h PHE 404 N 7.99 1.17 -3.13 5.38 0.04 -1.81 -3.44 116.94 123.13 2qe4 h PHE 404 Ca 0.30 -0.10 -0.07 0.00 2.80 0.00 0.00 57.97 60.91 2qe4 h PHE 404 Cb 0.92 -0.35 -0.15 0.00 2.20 0.00 0.00 35.95 38.57 2qe4 h PHE 404 CO 1.23 0.90 -0.09 0.00 -0.60 0.00 0.00 178.31 179.75 2qe4 s ALA 405 N -5.48 -1.00 0.50 2.45 0.00 -1.18 -4.95 121.76 112.10 2qe4 s ALA 405 Ca -0.12 0.21 0.29 0.00 0.00 0.00 0.00 51.96 52.34 2qe4 s ALA 405 Cb 0.16 0.46 1.38 0.00 0.00 0.00 0.00 23.12 25.12 2qe4 s ALA 405 CO 0.84 -0.52 1.84 -1.35 0.00 0.00 0.00 175.76 176.56 2qe4 h PRO 406 N 2.79 0.12 -0.50 0.00 0.11 -1.88 0.16 132.00 132.80 2qe4 h PRO 406 Ca -0.32 -0.01 -0.27 0.00 0.11 0.00 0.00 66.00 65.51 2qe4 h PRO 406 Cb 1.22 -0.03 -0.16 0.00 0.11 0.00 0.00 31.00 32.14 2qe4 h PRO 406 CO 0.44 0.08 0.04 0.27 -0.21 0.00 0.00 178.00 178.63 2qe4 n ASN 407 N -4.34 2.90 -2.81 -2.05 6.94 -1.26 -4.64 115.26 110.00 2qe4 n ASN 407 Ca 0.22 -3.77 -0.10 0.00 -0.02 0.00 0.00 54.58 50.91 2qe4 n ASN 407 Cb 1.00 -0.67 0.06 0.00 -2.36 0.00 0.00 39.78 37.81 2qe4 n ASN 407 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 2qe4 n LEU 408 N -1.11 -2.01 -4.49 -4.53 7.94 0.54 -4.79 117.00 108.55 2qe4 n LEU 408 Ca 0.39 -3.80 -0.43 0.00 -1.11 0.00 0.00 56.01 51.06 2qe4 n LEU 408 Cb 1.14 0.88 -0.09 0.00 0.53 0.00 0.00 43.42 45.87 2qe4 n LEU 408 CO 0.29 2.08 0.04 -0.22 -1.11 0.00 0.00 177.39 178.47 2qe4 s LEU 409 N -1.85 4.85 0.06 -1.96 0.20 -1.24 -2.41 118.68 116.33 2qe4 s LEU 409 Ca 0.27 -0.65 0.05 0.00 0.69 0.00 0.00 54.13 54.49 2qe4 s LEU 409 Cb 0.28 -2.31 -0.04 0.00 -0.43 0.00 0.00 46.19 43.69 2qe4 s LEU 409 CO -0.11 -0.49 -0.07 -0.76 -0.29 0.00 0.00 176.35 174.63 2qe4 s LEU 410 N 1.98 3.16 0.54 -0.68 1.43 -0.78 -4.91 118.68 119.41 2qe4 s LEU 410 Ca 0.10 -0.26 0.07 0.00 -1.03 0.00 0.00 54.13 53.01 2qe4 s LEU 410 Cb -0.17 -1.89 0.04 0.00 0.03 0.00 0.00 46.19 44.20 2qe4 s LEU 410 CO 0.12 0.22 0.49 1.51 0.23 0.00 0.00 176.35 178.92 2qe4 s ASP 411 N -1.92 4.79 0.20 2.29 1.47 -1.26 -0.36 116.67 121.88 2qe4 s ASP 411 Ca 0.20 -1.09 -0.14 0.00 1.18 0.00 0.00 52.55 52.70 2qe4 s ASP 411 Cb -0.11 0.27 0.21 0.00 -0.34 0.00 0.00 42.92 42.95 2qe4 s ASP 411 CO 0.12 -1.11 1.64 -0.09 0.68 0.00 0.00 175.17 176.41 2qe4 h ARG 412 N 0.65 0.01 -0.97 2.11 2.43 -1.99 -2.40 114.38 114.22 2qe4 h ARG 412 Ca -0.36 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 58.85 2qe4 h ARG 412 Cb 1.29 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.79 2qe4 h ARG 412 CO 0.53 0.01 0.63 -0.91 -1.51 0.00 0.00 179.97 178.72 2qe4 h ASN 413 N 0.01 1.06 0.70 -3.80 2.35 -1.96 -0.93 115.58 113.01 2qe4 h ASN 413 Ca 0.28 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2qe4 h ASN 413 Cb 0.43 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 2qe4 h ASN 413 CO -0.58 0.73 -0.02 1.56 -1.65 0.00 0.00 177.43 177.46 2qe4 h GLN 414 N 1.23 0.00 -0.07 0.81 4.20 -1.83 -2.84 115.11 116.60 2qe4 h GLN 414 Ca 0.38 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 59.04 2qe4 h GLN 414 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 2qe4 h GLN 414 CO -0.12 0.02 -0.17 0.78 -0.67 0.00 0.00 178.83 178.67 2qe4 h GLY 415 N 1.42 0.26 0.11 3.46 0.00 -0.97 -2.95 103.07 104.39 2qe4 h GLY 415 Ca -0.00 -0.32 0.16 0.00 0.00 0.00 0.00 47.33 47.18 2qe4 h GLY 415 CO 0.00 0.28 0.79 0.50 0.00 0.00 0.00 176.54 178.11 2qe4 h LYS 416 N -0.25 0.00 -0.44 4.80 1.57 -1.36 -1.07 116.57 119.82 2qe4 h LYS 416 Ca -0.00 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 2qe4 h LYS 416 Cb 0.76 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.98 2qe4 h LYS 416 CO 0.04 0.00 -0.25 1.03 -0.57 0.00 0.00 179.45 179.69 2qe4 h SER 417 N 0.00 -0.85 -3.53 0.86 0.87 -1.59 -3.40 113.55 105.90 2qe4 h SER 417 Ca 0.27 0.18 -0.52 0.00 -1.23 0.00 0.00 61.79 60.48 2qe4 h SER 417 Cb 1.84 0.44 -0.03 0.00 -0.44 0.00 0.00 62.40 64.20 2qe4 h SER 417 CO -0.00 -0.27 0.03 -0.69 -0.53 0.00 0.00 176.83 175.37 2qe4 s VAL 418 N -6.09 4.71 0.06 2.23 1.01 -0.40 -5.02 120.40 116.90 2qe4 s VAL 418 Ca -0.15 0.98 -0.31 0.00 0.00 0.00 0.00 61.98 62.51 2qe4 s VAL 418 Cb 0.15 -3.73 -0.07 0.00 0.00 0.00 0.00 36.38 32.73 2qe4 s VAL 418 CO 0.70 0.08 1.39 -0.70 0.00 0.00 0.00 175.10 176.56 2qe4 s GLU 419 N -2.34 4.31 0.00 2.72 2.12 -1.26 -2.93 118.70 121.32 2qe4 s GLU 419 Ca 0.45 2.01 0.00 0.00 0.36 0.00 0.00 54.97 57.79 2qe4 s GLU 419 Cb -0.14 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.84 2qe4 s GLU 419 CO 0.20 -0.49 0.00 0.41 -0.54 0.00 0.00 175.26 174.83 2qe4 n GLY 420 N 3.56 0.61 0.09 -1.50 0.00 -1.26 -4.92 105.19 101.77 2qe4 n GLY 420 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2qe4 n GLY 420 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2qe4 n MET 421 N -2.45 0.50 0.03 1.61 1.56 -1.15 -4.13 117.12 113.09 2qe4 n MET 421 Ca 0.00 0.10 -0.01 0.00 -0.27 0.00 0.00 57.70 57.52 2qe4 n MET 421 Cb 0.03 -1.77 0.26 0.00 2.15 0.00 0.00 33.22 33.89 2qe4 n MET 421 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 2qe4 h VAL 422 N 0.00 1.23 -0.45 1.12 2.07 -1.79 -1.20 116.25 117.23 2qe4 h VAL 422 Ca 0.00 -1.04 -0.12 0.00 0.82 0.00 0.00 66.70 66.35 2qe4 h VAL 422 Cb 0.91 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2qe4 h VAL 422 CO 0.00 0.34 -0.21 -0.33 0.02 0.00 0.00 177.57 177.39 2qe4 h GLU 423 N 0.42 0.93 -0.26 1.57 5.08 -1.98 -2.10 114.58 118.25 2qe4 h GLU 423 Ca 0.08 -0.40 -0.19 0.00 -1.00 0.00 0.00 59.36 57.84 2qe4 h GLU 423 Cb 0.52 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2qe4 h GLU 423 CO 0.03 1.06 -0.58 0.82 -1.00 0.00 0.00 179.01 179.34 2qe4 h ILE 424 N 0.77 1.28 -0.08 3.13 2.04 -1.71 -2.90 117.51 120.04 2qe4 h ILE 424 Ca 0.10 -1.77 0.02 0.00 1.00 0.00 0.00 64.86 64.22 2qe4 h ILE 424 Cb 0.78 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.54 2qe4 h ILE 424 CO 0.06 0.57 -0.06 -0.26 0.00 0.00 0.00 178.15 178.47 2qe4 h PHE 425 N 0.63 -0.15 -0.28 1.37 0.05 -1.15 0.07 116.94 117.47 2qe4 h PHE 425 Ca 0.00 0.01 0.03 0.00 3.82 0.00 0.00 57.97 61.83 2qe4 h PHE 425 Cb 1.20 0.08 -0.01 0.00 2.00 0.00 0.00 35.95 39.21 2qe4 h PHE 425 CO 0.08 -0.10 0.19 -0.44 -0.18 0.00 0.00 178.31 177.86 2qe4 h ASP 426 N -0.07 0.24 -0.19 2.17 3.32 -1.39 0.45 116.42 120.95 2qe4 h ASP 426 Ca 0.06 -0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.90 2qe4 h ASP 426 Cb 0.15 -0.06 0.01 0.00 0.22 0.00 0.00 39.33 39.65 2qe4 h ASP 426 CO -0.13 0.16 -0.66 0.24 -1.72 0.00 0.00 179.24 177.14 2qe4 h MET 427 N 0.28 0.77 -0.11 3.56 2.86 -1.16 -1.51 114.93 119.62 2qe4 h MET 427 Ca 0.12 -0.58 -0.01 0.00 -2.06 0.00 0.00 59.70 57.17 2qe4 h MET 427 Cb 0.12 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 2qe4 h MET 427 CO -0.02 1.20 0.05 -0.07 1.06 0.00 0.00 176.91 179.13 2qe4 h LEU 428 N 0.50 0.15 -0.61 1.22 3.38 0.91 -0.39 115.31 120.49 2qe4 h LEU 428 Ca -0.03 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2qe4 h LEU 428 Cb 1.28 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 2qe4 h LEU 428 CO 0.14 0.26 0.39 -0.07 0.09 0.00 0.00 178.44 179.24 2qe4 h LEU 429 N 0.04 0.66 -0.46 1.67 3.38 -0.22 -0.83 115.31 119.55 2qe4 h LEU 429 Ca 0.04 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2qe4 h LEU 429 Cb 0.15 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2qe4 h LEU 429 CO -0.00 0.47 0.26 0.00 0.09 0.00 0.00 178.44 179.26 2qe4 h ALA 430 N 1.24 0.58 -0.35 1.53 0.00 -0.94 0.41 119.26 121.74 2qe4 h ALA 430 Ca 0.23 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2qe4 h ALA 430 Cb -0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2qe4 h ALA 430 CO -0.07 -0.07 0.09 1.15 0.00 0.00 0.00 179.25 180.35 2qe4 h THR 431 N 0.52 1.16 -0.42 0.00 2.02 -0.69 -1.29 112.91 114.21 2qe4 h THR 431 Ca 0.19 -0.57 -0.10 0.00 0.77 0.00 0.00 66.41 66.70 2qe4 h THR 431 Cb 0.04 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 2qe4 h THR 431 CO -0.10 0.20 -0.14 -1.28 0.37 0.00 0.00 175.52 174.58 2qe4 h SER 432 N 0.50 0.85 -0.13 4.18 0.87 0.16 -1.70 113.55 118.27 2qe4 h SER 432 Ca 0.12 -0.38 -0.00 0.00 -1.23 0.00 0.00 61.79 60.30 2qe4 h SER 432 Cb 0.19 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2qe4 h SER 432 CO -0.00 1.03 0.07 0.28 -0.53 0.00 0.00 176.83 177.68 2qe4 h SER 433 N 0.66 0.16 -0.77 6.23 0.02 -0.56 -0.89 113.55 118.40 2qe4 h SER 433 Ca 0.10 -0.07 0.15 0.00 -0.84 0.00 0.00 61.79 61.13 2qe4 h SER 433 Cb 0.68 -0.04 -0.10 0.00 0.14 0.00 0.00 62.40 63.08 2qe4 h SER 433 CO 0.05 0.19 0.31 -0.09 -1.14 0.00 0.00 176.83 176.15 2qe4 h ARG 434 N 0.12 0.43 -0.60 3.45 9.65 -1.07 0.93 114.38 127.30 2qe4 h ARG 434 Ca 0.05 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.82 2qe4 h ARG 434 Cb 0.06 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.52 2qe4 h ARG 434 CO -0.01 0.29 0.04 0.74 2.80 0.00 0.00 179.97 183.83 2qe4 h PHE 435 N 0.44 1.08 -0.45 2.20 0.04 -0.80 -0.55 116.94 118.91 2qe4 h PHE 435 Ca 0.43 -0.16 -0.09 0.00 2.80 0.00 0.00 57.97 60.94 2qe4 h PHE 435 Cb 0.67 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 2qe4 h PHE 435 CO -0.16 0.94 -0.08 -0.09 -0.60 0.00 0.00 178.31 178.32 2qe4 h ARG 436 N 0.93 0.85 -0.03 1.51 2.43 0.57 0.28 114.38 120.93 2qe4 h ARG 436 Ca 0.18 -0.32 -0.04 0.00 -0.81 0.00 0.00 59.98 58.99 2qe4 h ARG 436 Cb 0.49 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 2qe4 h ARG 436 CO 0.02 0.95 -0.19 1.98 -1.51 0.00 0.00 179.97 181.22 2qe4 h MET 437 N 0.69 0.04 0.00 0.20 4.05 0.96 -2.37 114.93 118.51 2qe4 h MET 437 Ca 0.12 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.53 2qe4 h MET 437 Cb 0.62 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.41 2qe4 h MET 437 CO 0.04 0.23 -0.86 -1.33 0.23 0.00 0.00 176.91 175.23 2qe4 n MET 438 N -4.29 0.40 -3.18 0.39 2.81 -0.23 -4.97 117.12 108.03 2qe4 n MET 438 Ca -0.02 0.07 -0.15 0.00 -1.81 0.00 0.00 57.70 55.79 2qe4 n MET 438 Cb 0.26 -1.71 0.06 0.00 -0.71 0.00 0.00 33.22 31.13 2qe4 n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2qe4 n ASN 439 N -2.26 -3.86 -4.65 7.83 2.85 0.90 -4.91 115.26 111.16 2qe4 n ASN 439 Ca 0.02 -0.41 -0.46 0.00 -0.11 0.00 0.00 54.58 53.61 2qe4 n ASN 439 Cb 0.48 -3.81 -0.04 0.00 1.24 0.00 0.00 39.78 37.65 2qe4 n ASN 439 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2qe4 n LEU 440 N -3.55 2.82 -4.93 1.20 7.94 -0.70 -4.97 117.00 114.82 2qe4 n LEU 440 Ca -0.08 1.12 -0.27 0.00 -1.11 0.00 0.00 56.01 55.67 2qe4 n LEU 440 Cb 0.58 -1.39 -0.03 0.00 0.53 0.00 0.00 43.42 43.11 2qe4 n LEU 440 CO 0.46 -0.55 0.09 -1.10 -1.11 0.00 0.00 177.39 175.18 2qe4 s GLN 441 N 0.10 3.54 0.44 1.96 -1.52 -1.26 -4.96 119.66 117.96 2qe4 s GLN 441 Ca 0.74 -0.27 0.10 0.00 -1.95 0.00 0.00 55.36 53.98 2qe4 s GLN 441 Cb -0.70 -2.76 0.97 0.00 -0.22 0.00 0.00 33.01 30.30 2qe4 s GLN 441 CO 0.46 0.31 2.08 0.78 -0.25 0.00 0.00 175.29 178.66 2qe4 h GLY 442 N 1.66 0.39 1.16 3.09 0.00 -1.99 0.24 103.07 107.62 2qe4 h GLY 442 Ca -0.48 -0.15 -0.12 0.00 0.00 0.00 0.00 47.33 46.57 2qe4 h GLY 442 CO 0.66 0.15 -0.17 0.83 0.00 0.00 0.00 176.54 178.00 2qe4 h GLU 443 N 0.37 0.97 -0.12 4.80 3.07 -1.99 -2.72 114.58 118.96 2qe4 h GLU 443 Ca 0.10 -0.38 -0.03 0.00 -0.50 0.00 0.00 59.36 58.55 2qe4 h GLU 443 Cb -0.01 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 27.84 2qe4 h GLU 443 CO -0.02 1.05 -0.04 0.93 -1.40 0.00 0.00 179.01 179.53 2qe4 h GLU 444 N 0.85 0.23 -0.54 2.33 5.08 -1.66 -3.20 114.58 117.67 2qe4 h GLU 444 Ca 0.12 -0.10 0.11 0.00 -1.00 0.00 0.00 59.36 58.49 2qe4 h GLU 444 Cb 0.73 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.87 2qe4 h GLU 444 CO 0.06 0.56 -0.17 0.35 -1.00 0.00 0.00 179.01 178.80 2qe4 h PHE 445 N -0.10 -0.40 0.00 4.33 3.57 -0.91 0.22 116.94 123.64 2qe4 h PHE 445 Ca 0.03 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 2qe4 h PHE 445 Cb 0.48 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.47 2qe4 h PHE 445 CO 0.06 -0.27 -0.15 -0.39 -2.23 0.00 0.00 178.31 175.33 2qe4 h VAL 446 N -0.04 1.03 0.01 1.41 -1.51 -1.53 -1.62 116.25 113.99 2qe4 h VAL 446 Ca 0.26 -0.53 -0.00 0.00 -1.23 0.00 0.00 66.70 65.20 2qe4 h VAL 446 Cb 0.44 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 30.89 2qe4 h VAL 446 CO -0.58 0.15 -0.00 0.00 -1.23 0.00 0.00 177.57 175.90 2qe4 h LEU 448 N -0.43 0.95 -0.72 0.00 3.38 -0.83 -0.34 115.31 117.32 2qe4 h LEU 448 Ca -0.00 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2qe4 h LEU 448 Cb 0.42 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2qe4 h LEU 448 CO 0.00 0.59 0.35 0.50 0.09 0.00 0.00 178.44 179.97 2qe4 h LYS 449 N 1.08 1.04 -0.22 1.13 3.64 -1.29 -0.81 116.57 121.13 2qe4 h LYS 449 Ca 0.43 -0.15 -0.14 0.00 -1.27 0.00 0.00 60.65 59.51 2qe4 h LYS 449 Cb 0.23 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2qe4 h LYS 449 CO -0.19 0.82 -0.45 0.77 -2.27 0.00 0.00 179.45 178.12 2qe4 h SER 450 N 1.01 0.61 -0.69 4.20 0.02 -0.99 -2.06 113.55 115.66 2qe4 h SER 450 Ca 0.25 -0.29 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 2qe4 h SER 450 Cb 0.12 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 2qe4 h SER 450 CO -0.03 0.98 0.30 0.40 -1.14 0.00 0.00 176.83 177.33 2qe4 h ILE 451 N 0.46 1.24 -0.74 3.27 2.04 -0.74 -1.87 117.51 121.17 2qe4 h ILE 451 Ca 0.03 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 2qe4 h ILE 451 Cb 0.97 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2qe4 h ILE 451 CO 0.09 0.29 0.34 0.40 0.00 0.00 0.00 178.15 179.27 2qe4 h ILE 452 N 0.98 1.24 0.44 -0.67 2.04 -0.93 0.12 117.51 120.73 2qe4 h ILE 452 Ca 0.23 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 2qe4 h ILE 452 Cb 0.18 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2qe4 h ILE 452 CO -0.02 0.29 -0.25 0.25 0.00 0.00 0.00 178.15 178.42 2qe4 h LEU 453 N 1.04 -0.62 -0.89 1.44 5.85 -0.98 -2.25 115.31 118.89 2qe4 h LEU 453 Ca 0.25 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2qe4 h LEU 453 Cb 0.14 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.34 2qe4 h LEU 453 CO -0.03 -0.41 0.00 -0.07 -0.34 0.00 0.00 178.44 177.59 2qe4 h LEU 454 N -0.65 0.00 0.00 2.25 3.38 -1.25 -3.35 115.31 115.69 2qe4 h LEU 454 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2qe4 h LEU 454 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2qe4 h LEU 454 CO 0.07 0.00 -1.69 -3.20 0.09 0.00 0.00 178.44 173.70 2qe4 n ASN 455 N -2.98 0.60 0.13 -0.43 2.85 0.39 -4.21 115.26 111.62 2qe4 n ASN 455 Ca 0.02 -0.19 0.02 0.00 -0.11 0.00 0.00 54.58 54.32 2qe4 n ASN 455 Cb 0.37 1.72 0.02 0.00 1.24 0.00 0.00 39.78 43.12 2qe4 n ASN 455 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2qe4 h SER 456 N 0.00 0.00 -0.01 1.20 0.02 -1.55 -3.32 113.55 109.90 2qe4 h SER 456 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2qe4 h SER 456 Cb 0.80 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.34 2qe4 h SER 456 CO 0.00 0.52 -0.37 0.61 -1.14 0.00 0.00 176.83 176.45 2qe4 n GLY 457 N 1.23 -0.12 0.31 -3.77 0.00 -1.26 -4.64 105.19 96.94 2qe4 n GLY 457 Ca 0.02 -0.37 0.17 0.00 0.00 0.00 0.00 46.02 45.84 2qe4 n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2qe4 h VAL 458 N 0.98 0.39 -0.01 1.61 3.04 -1.73 -1.96 116.25 118.56 2qe4 h VAL 458 Ca 0.00 -0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2qe4 h VAL 458 Cb 0.39 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.68 2qe4 h VAL 458 CO 0.00 0.00 -0.65 -1.22 -1.01 0.00 0.00 177.57 174.69 2qe4 n TYR 459 N -3.64 0.00 -1.35 3.17 4.01 -1.26 -4.16 117.16 113.92 2qe4 n TYR 459 Ca -0.03 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.73 2qe4 n TYR 459 Cb 0.08 0.00 0.20 0.00 -0.31 0.00 0.00 39.34 39.31 2qe4 n TYR 459 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 2qe4 n THR 460 N -0.52 2.35 0.00 -0.72 5.66 -0.76 -5.24 114.28 115.05 2qe4 n THR 460 Ca 0.07 -2.63 0.00 0.00 -3.05 0.00 0.00 64.05 58.45 2qe4 n THR 460 Cb 0.42 -0.28 0.00 0.00 -1.55 0.00 0.00 70.33 68.92 2qe4 n THR 460 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2qe4 n PHE 461 N -1.06 0.00 0.00 1.09 3.72 -1.06 -5.06 117.46 115.09 2qe4 n PHE 461 Ca 0.26 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.66 2qe4 n PHE 461 Cb 0.89 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.43 2qe4 n PHE 461 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2qe4 n GLU 471 N 0.00 0.00 -0.30 -1.08 -0.58 -1.26 -5.14 120.64 112.28 2qe4 n GLU 471 Ca 0.00 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.82 2qe4 n GLU 471 Cb 0.00 0.00 0.30 0.00 -0.57 0.00 0.00 31.44 31.17 2qe4 n GLU 471 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2qe4 h LYS 472 N 0.00 0.86 -0.29 3.49 1.57 -1.99 0.47 116.57 120.67 2qe4 h LYS 472 Ca 0.00 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.59 2qe4 h LYS 472 Cb 0.00 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 2qe4 h LYS 472 CO 0.00 0.57 -0.37 0.22 -0.57 0.00 0.00 179.45 179.29 2qe4 h ASP 473 N 0.88 0.72 0.12 0.86 3.58 -2.02 -2.06 116.42 118.49 2qe4 h ASP 473 Ca 0.44 -0.31 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 2qe4 h ASP 473 Cb 0.48 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2qe4 h ASP 473 CO -0.20 1.01 -0.06 -0.74 -2.88 0.00 0.00 179.24 176.38 2qe4 h HIS 474 N 0.56 -0.14 -0.86 0.28 2.76 -1.53 -1.49 115.15 114.73 2qe4 h HIS 474 Ca 0.05 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.31 2qe4 h HIS 474 Cb 0.90 0.05 -0.07 0.00 1.55 0.00 0.00 27.41 29.83 2qe4 h HIS 474 CO 0.04 -0.08 0.51 0.82 -1.30 0.00 0.00 177.93 177.92 2qe4 h ILE 475 N -0.16 0.95 0.00 6.26 2.04 -0.84 -1.63 117.51 124.12 2qe4 h ILE 475 Ca -0.02 -0.30 -0.10 0.00 1.00 0.00 0.00 64.86 65.45 2qe4 h ILE 475 Cb 0.12 -0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 2qe4 h ILE 475 CO 0.03 0.16 -0.45 0.45 0.00 0.00 0.00 178.15 178.33 2qe4 h HIS 476 N 0.87 0.00 -0.05 1.37 3.86 -1.05 -0.89 115.15 119.27 2qe4 h HIS 476 Ca 0.41 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.40 2qe4 h HIS 476 Cb 0.33 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.80 2qe4 h HIS 476 CO -0.04 0.45 -0.85 0.00 0.86 0.00 0.00 177.93 178.35 2qe4 h ARG 477 N 0.00 0.48 -0.59 2.45 3.08 -0.53 -1.87 114.38 117.40 2qe4 h ARG 477 Ca -0.00 -0.45 -0.10 0.00 0.07 0.00 0.00 59.98 59.49 2qe4 h ARG 477 Cb 0.82 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.96 2qe4 h ARG 477 CO 0.06 1.09 -0.04 0.28 -1.07 0.00 0.00 179.97 180.29 2qe4 h VAL 478 N 0.30 1.27 -0.68 2.04 2.07 -1.02 0.36 116.25 120.59 2qe4 h VAL 478 Ca -0.06 -1.19 -0.08 0.00 0.82 0.00 0.00 66.70 66.19 2qe4 h VAL 478 Cb 1.46 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 2qe4 h VAL 478 CO 0.15 0.43 0.12 -0.07 0.02 0.00 0.00 177.57 178.23 2qe4 h LEU 479 N 0.96 1.07 -1.09 2.57 3.38 -1.13 -0.26 115.31 120.81 2qe4 h LEU 479 Ca 0.16 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 2qe4 h LEU 479 Cb 0.60 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2qe4 h LEU 479 CO 0.04 1.05 0.20 0.44 0.09 0.00 0.00 178.44 180.26 2qe4 h ASP 480 N 1.05 0.78 -0.01 -0.43 3.32 -0.97 -0.32 116.42 119.83 2qe4 h ASP 480 Ca 0.21 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.16 2qe4 h ASP 480 Cb 0.43 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2qe4 h ASP 480 CO 0.01 0.72 -0.04 0.50 -1.72 0.00 0.00 179.24 178.71 2qe4 h LYS 481 N 0.83 -0.06 -0.39 3.56 1.63 0.09 0.51 116.57 122.73 2qe4 h LYS 481 Ca 0.19 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.96 2qe4 h LYS 481 Cb 0.20 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 2qe4 h LYS 481 CO -0.01 -0.04 0.07 0.82 -3.45 0.00 0.00 179.45 176.84 2qe4 h ILE 482 N -0.06 1.19 -0.24 2.00 2.04 -0.72 -0.31 117.51 121.41 2qe4 h ILE 482 Ca 0.02 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 2qe4 h ILE 482 Cb 0.09 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2qe4 h ILE 482 CO -0.05 0.25 0.10 0.74 0.00 0.00 0.00 178.15 179.19 2qe4 h THR 483 N 0.57 1.16 -0.49 -0.27 2.02 -0.38 0.26 112.91 115.79 2qe4 h THR 483 Ca 0.13 -0.49 0.07 0.00 0.77 0.00 0.00 66.41 66.89 2qe4 h THR 483 Cb 0.26 1.05 -0.06 0.00 -1.74 0.00 0.00 68.15 67.66 2qe4 h THR 483 CO 0.00 0.16 0.15 0.44 0.37 0.00 0.00 175.52 176.65 2qe4 h ASP 484 N 0.24 0.12 -0.08 4.18 3.32 -0.37 0.24 116.42 124.06 2qe4 h ASP 484 Ca 0.08 0.07 0.03 0.00 0.02 0.00 0.00 57.03 57.22 2qe4 h ASP 484 Cb 0.17 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 2qe4 h ASP 484 CO -0.01 0.10 -0.08 0.74 -1.72 0.00 0.00 179.24 178.27 2qe4 h THR 485 N 0.31 0.77 -0.50 0.35 2.02 -0.57 0.32 112.91 115.61 2qe4 h THR 485 Ca 0.24 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.49 2qe4 h THR 485 Cb 0.27 0.77 -0.06 0.00 -1.74 0.00 0.00 68.15 67.39 2qe4 h THR 485 CO -0.26 0.00 0.18 -0.07 0.37 0.00 0.00 175.52 175.74 2qe4 h LEU 486 N -0.10 0.19 -0.75 2.58 3.38 0.42 -0.42 115.31 120.60 2qe4 h LEU 486 Ca 0.06 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 2qe4 h LEU 486 Cb 0.19 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 2qe4 h LEU 486 CO -0.14 0.13 0.18 0.40 0.09 0.00 0.00 178.44 179.10 2qe4 h ILE 487 N 0.36 1.26 -0.56 1.22 1.08 -0.45 -2.62 117.51 117.80 2qe4 h ILE 487 Ca 0.24 -0.96 0.03 0.00 -0.39 0.00 0.00 64.86 63.79 2qe4 h ILE 487 Cb 0.26 0.52 -0.04 0.00 -3.07 0.00 0.00 36.82 34.49 2qe4 h ILE 487 CO -0.25 0.37 0.32 -0.74 -0.69 0.00 0.00 178.15 177.17 2qe4 h HIS 488 N 1.07 0.60 -0.99 1.37 2.76 0.83 -0.80 115.15 119.98 2qe4 h HIS 488 Ca 0.22 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.44 2qe4 h HIS 488 Cb 0.36 -0.19 -0.05 0.00 1.55 0.00 0.00 27.41 29.08 2qe4 h HIS 488 CO 0.03 0.33 0.66 -0.07 -1.30 0.00 0.00 177.93 177.57 2qe4 h LEU 489 N 0.63 1.11 -0.56 0.26 3.38 -0.82 -1.83 115.31 117.49 2qe4 h LEU 489 Ca 0.23 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 58.04 2qe4 h LEU 489 Cb 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2qe4 h LEU 489 CO -0.12 0.78 -0.43 0.24 0.09 0.00 0.00 178.44 179.00 2qe4 h MET 490 N 1.30 0.67 0.01 1.13 2.86 -1.03 -0.26 114.93 119.61 2qe4 h MET 490 Ca 0.38 -0.36 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2qe4 h MET 490 Cb -0.07 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.61 2qe4 h MET 490 CO -0.10 0.97 -0.00 0.00 1.06 0.00 0.00 176.91 178.83 2qe4 h ALA 491 N 0.98 -0.01 -0.39 6.32 0.00 -0.71 -1.62 119.26 123.82 2qe4 h ALA 491 Ca 0.04 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2qe4 h ALA 491 Cb 0.97 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2qe4 h ALA 491 CO 0.09 -0.49 0.05 0.87 0.00 0.00 0.00 179.25 179.77 2qe4 h LYS 492 N -0.04 0.58 0.00 0.00 1.57 -1.24 0.63 116.57 118.09 2qe4 h LYS 492 Ca -0.00 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2qe4 h LYS 492 Cb 0.03 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2qe4 h LYS 492 CO 0.00 0.57 0.00 0.00 -0.57 0.00 0.00 179.45 179.45 2qe4 h ALA 493 N 1.50 1.00 0.00 3.86 0.00 -0.52 -3.45 119.26 121.64 2qe4 h ALA 493 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qe4 h ALA 493 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2qe4 h ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2qe4 n GLY 494 N -0.80 1.07 3.79 0.00 0.00 0.21 -5.08 105.19 104.39 2qe4 n GLY 494 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2qe4 n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qe4 s LEU 495 N 0.00 3.92 0.70 0.99 1.43 -0.67 -5.02 118.68 120.04 2qe4 s LEU 495 Ca 0.00 1.99 -0.11 0.00 -1.03 0.00 0.00 54.13 54.98 2qe4 s LEU 495 Cb 0.00 -4.45 0.01 0.00 0.03 0.00 0.00 46.19 41.78 2qe4 s LEU 495 CO 0.00 -0.75 1.06 0.42 0.23 0.00 0.00 176.35 177.31 2qe4 s THR 496 N -1.86 3.96 0.25 5.49 -4.23 -1.26 -4.64 115.64 113.35 2qe4 s THR 496 Ca 0.65 0.64 -0.06 0.00 -1.18 0.00 0.00 61.69 61.74 2qe4 s THR 496 Cb -0.19 -3.38 0.28 0.00 1.34 0.00 0.00 72.50 70.56 2qe4 s THR 496 CO 0.23 -0.83 1.64 -0.07 -0.54 0.00 0.00 174.62 175.04 2qe4 h LEU 497 N -0.75 -0.31 -0.99 4.79 3.38 -1.99 0.17 115.31 119.61 2qe4 h LEU 497 Ca -0.44 0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 2qe4 h LEU 497 Cb 1.21 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 42.28 2qe4 h LEU 497 CO 0.57 -0.18 -0.07 -0.61 0.09 0.00 0.00 178.44 178.24 2qe4 h GLN 498 N 0.11 0.66 -0.13 1.13 4.15 -2.00 -2.50 115.11 116.53 2qe4 h GLN 498 Ca 0.43 -0.19 -0.15 0.00 0.77 0.00 0.00 58.65 59.52 2qe4 h GLN 498 Cb 0.77 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.37 2qe4 h GLN 498 CO -0.67 0.72 -0.55 1.96 -1.93 0.00 0.00 178.83 178.37 2qe4 h GLN 499 N 0.61 0.38 -0.10 1.69 4.20 -1.22 -2.49 115.11 118.18 2qe4 h GLN 499 Ca 0.12 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2qe4 h GLN 499 Cb 0.48 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 2qe4 h GLN 499 CO 0.03 0.83 0.06 1.96 -0.67 0.00 0.00 178.83 181.04 2qe4 h GLN 500 N 0.30 0.13 0.00 1.46 4.20 -0.36 -0.43 115.11 120.40 2qe4 h GLN 500 Ca 0.01 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2qe4 h GLN 500 Cb 1.05 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.80 2qe4 h GLN 500 CO 0.09 0.09 -0.02 1.12 -0.67 0.00 0.00 178.83 179.44 2qe4 h HIS 501 N 0.12 0.00 -0.03 2.96 2.07 -1.51 -2.23 115.15 116.52 2qe4 h HIS 501 Ca 0.03 0.00 -0.22 0.00 -2.85 0.00 0.00 60.37 57.34 2qe4 h HIS 501 Cb -0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2qe4 h HIS 501 CO -0.07 0.00 -0.89 1.96 -3.07 0.00 0.00 177.93 175.86 2qe4 h GLN 502 N 0.00 0.46 -0.04 5.12 4.20 -1.17 -2.59 115.11 121.09 2qe4 h GLN 502 Ca 0.00 -0.46 -0.09 0.00 0.06 0.00 0.00 58.65 58.17 2qe4 h GLN 502 Cb 0.88 0.12 0.01 0.00 0.30 0.00 0.00 27.48 28.78 2qe4 h GLN 502 CO 0.00 1.10 -0.31 -0.09 -0.67 0.00 0.00 178.83 178.86 2qe4 h ARG 503 N 0.28 0.28 -0.78 1.46 2.43 -1.04 -2.18 114.38 114.83 2qe4 h ARG 503 Ca -0.07 -0.25 0.14 0.00 -0.81 0.00 0.00 59.98 58.99 2qe4 h ARG 503 Cb 1.51 0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 31.03 2qe4 h ARG 503 CO 0.16 0.92 0.36 1.25 -1.51 0.00 0.00 179.97 181.14 2qe4 h LEU 504 N -0.27 0.39 -0.35 3.80 5.85 -1.46 0.11 115.31 123.39 2qe4 h LEU 504 Ca -0.03 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2qe4 h LEU 504 Cb 1.00 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.06 2qe4 h LEU 504 CO 0.06 0.17 0.18 0.00 -0.34 0.00 0.00 178.44 178.51 2qe4 h ALA 505 N 1.54 0.44 -0.50 1.25 0.00 -1.44 -1.06 119.26 119.50 2qe4 h ALA 505 Ca 0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2qe4 h ALA 505 Cb 0.61 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2qe4 h ALA 505 CO -0.37 -0.01 0.27 1.96 0.00 0.00 0.00 179.25 181.09 2qe4 h GLN 506 N 0.43 0.69 -0.68 0.00 4.20 -0.44 -0.15 115.11 119.17 2qe4 h GLN 506 Ca 0.12 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 2qe4 h GLN 506 Cb 0.09 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 2qe4 h GLN 506 CO -0.02 0.55 0.25 -0.07 -0.67 0.00 0.00 178.83 178.87 2qe4 h LEU 507 N 0.66 0.93 -0.29 1.46 3.38 -0.69 -2.59 115.31 118.16 2qe4 h LEU 507 Ca 0.17 -0.14 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 2qe4 h LEU 507 Cb 0.06 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2qe4 h LEU 507 CO -0.03 0.84 -0.85 -0.07 0.09 0.00 0.00 178.44 178.42 2qe4 h LEU 508 N 0.99 0.38 -1.06 1.67 3.38 -0.86 -3.15 115.31 116.66 2qe4 h LEU 508 Ca 0.23 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2qe4 h LEU 508 Cb 0.22 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2qe4 h LEU 508 CO -0.02 1.07 0.08 -0.07 0.09 0.00 0.00 178.44 179.59 2qe4 h LEU 509 N 0.18 0.71 -1.56 1.67 3.38 -0.83 -1.80 115.31 117.05 2qe4 h LEU 509 Ca -0.05 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.82 2qe4 h LEU 509 Cb 1.47 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 42.00 2qe4 h LEU 509 CO 0.14 0.73 0.34 0.40 0.09 0.00 0.00 178.44 180.13 2qe4 h ILE 510 N 0.72 1.05 -0.09 1.22 2.04 -1.42 -0.14 117.51 120.88 2qe4 h ILE 510 Ca 0.16 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 65.84 2qe4 h ILE 510 Cb 0.33 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2qe4 h ILE 510 CO 0.00 0.11 0.12 -0.07 0.00 0.00 0.00 178.15 178.31 2qe4 h LEU 511 N 0.58 0.00 -0.32 1.44 3.38 -1.35 0.07 115.31 119.10 2qe4 h LEU 511 Ca 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 2qe4 h LEU 511 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2qe4 h LEU 511 CO -0.05 0.00 -0.04 0.28 0.09 0.00 0.00 178.44 178.71 2qe4 h SER 512 N 0.00 0.60 -0.83 -0.43 0.02 -1.09 -0.52 113.55 111.30 2qe4 h SER 512 Ca 0.04 -0.34 -0.03 0.00 -0.84 0.00 0.00 61.79 60.62 2qe4 h SER 512 Cb 0.28 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 2qe4 h SER 512 CO -0.00 0.80 0.39 0.45 -1.14 0.00 0.00 176.83 177.32 2qe4 h HIS 513 N 0.39 1.20 -0.64 3.45 3.86 -1.06 0.36 115.15 122.70 2qe4 h HIS 513 Ca 0.09 -0.07 -0.07 0.00 -1.16 0.00 0.00 60.37 59.17 2qe4 h HIS 513 Cb 0.52 -0.37 -0.03 0.00 1.06 0.00 0.00 27.41 28.59 2qe4 h HIS 513 CO 0.04 0.88 0.14 0.82 0.86 0.00 0.00 177.93 180.67 2qe4 h ILE 514 N 1.18 1.25 -0.52 2.45 2.04 -1.07 0.19 117.51 123.03 2qe4 h ILE 514 Ca 0.28 -0.94 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 2qe4 h ILE 514 Cb 0.14 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2qe4 h ILE 514 CO -0.03 0.36 0.26 -0.09 0.00 0.00 0.00 178.15 178.64 2qe4 h ARG 515 N 0.97 0.74 -0.44 2.37 9.65 -0.42 -0.77 114.38 126.49 2qe4 h ARG 515 Ca 0.20 -0.10 -0.02 0.00 -1.10 0.00 0.00 59.98 58.96 2qe4 h ARG 515 Cb 0.37 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.79 2qe4 h ARG 515 CO 0.00 0.60 0.20 1.25 2.80 0.00 0.00 179.97 184.83 2qe4 h HIS 516 N 0.69 0.65 -0.78 2.20 2.76 -0.18 -1.77 115.15 118.72 2qe4 h HIS 516 Ca 0.18 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.27 2qe4 h HIS 516 Cb 0.10 -0.20 -0.04 0.00 1.55 0.00 0.00 27.41 28.83 2qe4 h HIS 516 CO -0.01 0.54 0.33 0.52 -1.30 0.00 0.00 177.93 178.01 2qe4 h MET 517 N 0.57 1.15 -0.59 5.26 2.86 -0.42 -1.72 114.93 122.03 2qe4 h MET 517 Ca 0.15 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 2qe4 h MET 517 Cb 0.15 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.59 2qe4 h MET 517 CO -0.02 0.92 0.19 1.03 1.06 0.00 0.00 176.91 180.10 2qe4 h SER 518 N 1.13 0.81 -0.11 1.22 0.87 -0.78 0.12 113.55 116.81 2qe4 h SER 518 Ca 0.26 -0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 2qe4 h SER 518 Cb 0.18 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 2qe4 h SER 518 CO -0.03 0.76 -0.01 0.78 -0.53 0.00 0.00 176.83 177.81 2qe4 h ASN 519 N 0.86 0.20 -0.74 6.23 2.35 -0.86 -0.76 115.58 122.87 2qe4 h ASN 519 Ca 0.20 -0.33 0.03 0.00 -0.55 0.00 0.00 56.30 55.65 2qe4 h ASN 519 Cb 0.23 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 2qe4 h ASN 519 CO -0.01 0.48 0.47 0.11 -1.65 0.00 0.00 177.43 176.83 2qe4 h LYS 520 N -0.08 0.89 -0.75 0.81 1.79 -1.07 -1.84 116.57 116.31 2qe4 h LYS 520 Ca 0.03 -0.05 0.05 0.00 -2.18 0.00 0.00 60.65 58.49 2qe4 h LYS 520 Cb 0.39 -0.20 -0.05 0.00 -1.58 0.00 0.00 32.23 30.78 2qe4 h LYS 520 CO 0.01 0.59 0.46 0.78 -1.08 0.00 0.00 179.45 180.21 2qe4 h GLY 521 N 0.92 1.11 1.03 3.86 0.00 -0.52 -0.06 103.07 109.41 2qe4 h GLY 521 Ca 0.29 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 47.23 2qe4 h GLY 521 CO -0.10 0.25 0.22 -0.33 0.00 0.00 0.00 176.54 176.58 2qe4 h MET 522 N 0.87 1.04 -0.48 4.80 2.86 -0.55 -0.83 114.93 122.64 2qe4 h MET 522 Ca 0.32 -0.22 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2qe4 h MET 522 Cb 0.11 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 2qe4 h MET 522 CO -0.15 0.90 0.29 0.93 1.06 0.00 0.00 176.91 179.94 2qe4 h GLU 523 N 0.98 0.65 -0.26 1.72 5.08 -0.57 0.66 114.58 122.84 2qe4 h GLU 523 Ca 0.22 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2qe4 h GLU 523 Cb 0.28 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2qe4 h GLU 523 CO -0.01 0.48 0.02 1.25 -1.00 0.00 0.00 179.01 179.75 2qe4 h HIS 524 N 0.64 0.39 0.09 4.33 2.76 -0.64 -2.74 115.15 119.98 2qe4 h HIS 524 Ca 0.17 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.31 2qe4 h HIS 524 Cb -0.00 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 28.84 2qe4 h HIS 524 CO -0.03 0.38 -0.04 -0.07 -1.30 0.00 0.00 177.93 176.87 2qe4 h LEU 525 N 0.38 -0.10 -2.07 0.26 3.38 -0.46 -3.26 115.31 113.44 2qe4 h LEU 525 Ca 0.09 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2qe4 h LEU 525 Cb 0.22 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2qe4 h LEU 525 CO 0.00 0.52 0.21 0.22 0.09 0.00 0.00 178.44 179.48 2qe4 h TYR 526 N -0.82 0.00 -0.44 1.13 5.03 -0.79 -0.30 116.97 120.78 2qe4 h TYR 526 Ca -0.01 0.00 -0.13 0.00 2.58 0.00 0.00 58.73 61.16 2qe4 h TYR 526 Cb 0.59 0.00 -0.08 0.00 1.55 0.00 0.00 36.73 38.79 2qe4 h TYR 526 CO 0.12 0.00 0.17 -1.13 -1.32 0.00 0.00 178.16 176.00 2qe4 n SER 527 N -2.77 3.63 0.00 -2.11 3.41 -1.04 -5.09 113.62 109.64 2qe4 n SER 527 Ca -0.02 -2.72 0.00 0.00 -0.26 0.00 0.00 58.87 55.87 2qe4 n SER 527 Cb 0.25 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2qe4 n SER 527 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11