#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r5k h ALA 307 N 0.00 1.00 0.00 1.47 0.00 -1.99 -3.23 119.26 116.51 1r5k h ALA 307 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r5k h ALA 307 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1r5k h ALA 307 CO 0.00 0.00 -0.50 -0.07 0.00 0.00 0.00 179.25 178.68 1r5k h LEU 308 N 0.00 0.00 -2.32 0.00 3.38 -1.97 -3.26 115.31 111.14 1r5k h LEU 308 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1r5k h LEU 308 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1r5k h LEU 308 CO 0.00 0.03 0.00 -1.54 0.09 0.00 0.00 178.44 177.02 1r5k n SER 309 N -2.60 3.41 -4.77 -0.43 3.41 -1.22 -4.94 113.62 106.48 1r5k n SER 309 Ca 0.03 -1.98 -0.37 0.00 -0.26 0.00 0.00 58.87 56.29 1r5k n SER 309 Cb 0.50 -0.24 -0.01 0.00 -0.26 0.00 0.00 64.21 64.20 1r5k n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1r5k s LEU 310 N -1.46 3.96 0.81 1.04 1.43 -1.23 -5.04 118.68 118.20 1r5k s LEU 310 Ca 0.37 2.26 -0.11 0.00 -1.03 0.00 0.00 54.13 55.62 1r5k s LEU 310 Cb 0.22 -4.31 0.11 0.00 0.03 0.00 0.00 46.19 42.24 1r5k s LEU 310 CO 0.31 -0.95 1.16 0.42 0.23 0.00 0.00 176.35 177.51 1r5k s THR 311 N -1.60 2.09 0.17 5.49 -4.23 -1.26 -4.88 115.64 111.41 1r5k s THR 311 Ca 0.65 -0.12 -0.12 0.00 -1.18 0.00 0.00 61.69 60.92 1r5k s THR 311 Cb -0.27 -2.97 0.08 0.00 1.34 0.00 0.00 72.50 70.68 1r5k s THR 311 CO 0.32 0.00 1.74 0.00 -0.54 0.00 0.00 174.62 176.15 1r5k h ALA 312 N -1.05 0.76 -0.74 3.99 0.00 -1.95 -1.77 119.26 118.52 1r5k h ALA 312 Ca -0.44 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.27 1r5k h ALA 312 Cb 1.30 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1r5k h ALA 312 CO 0.55 0.35 0.27 -0.44 0.00 0.00 0.00 179.25 179.98 1r5k h ASP 313 N 0.81 1.03 -0.09 0.00 3.32 -1.97 -1.97 116.42 117.55 1r5k h ASP 313 Ca 0.20 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 1r5k h ASP 313 Cb 0.15 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1r5k h ASP 313 CO -0.02 0.93 -0.06 1.56 -1.72 0.00 0.00 179.24 179.93 1r5k h GLN 314 N 1.08 0.35 -0.04 3.56 4.20 -1.80 -1.98 115.11 120.48 1r5k h GLN 314 Ca 0.24 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.83 1r5k h GLN 314 Cb 0.24 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1r5k h GLN 314 CO -0.02 0.43 -0.16 1.98 -0.67 0.00 0.00 178.83 180.40 1r5k h MET 315 N 0.34 0.18 -0.49 1.46 4.05 -0.89 -1.61 114.93 117.95 1r5k h MET 315 Ca 0.07 -0.14 0.08 0.00 -0.28 0.00 0.00 59.70 59.44 1r5k h MET 315 Cb 0.33 0.03 -0.07 0.00 -0.80 0.00 0.00 31.60 31.08 1r5k h MET 315 CO 0.01 0.78 0.10 0.28 0.23 0.00 0.00 176.91 178.32 1r5k h VAL 316 N -0.39 0.73 0.15 -5.77 2.07 -1.19 0.10 116.25 111.96 1r5k h VAL 316 Ca -0.01 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.45 1r5k h VAL 316 Cb 0.80 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1r5k h VAL 316 CO 0.03 0.04 -0.34 0.28 0.02 0.00 0.00 177.57 177.60 1r5k h SER 317 N 0.24 -0.99 -0.55 0.57 0.02 -1.37 0.78 113.55 112.25 1r5k h SER 317 Ca 0.25 0.11 0.11 0.00 -0.84 0.00 0.00 61.79 61.42 1r5k h SER 317 Cb 0.33 0.37 -0.09 0.00 0.14 0.00 0.00 62.40 63.14 1r5k h SER 317 CO -0.32 -0.44 -0.02 0.00 -1.14 0.00 0.00 176.83 174.91 1r5k h ALA 318 N -0.00 0.51 -0.64 3.77 0.00 -0.81 -0.62 119.26 121.46 1r5k h ALA 318 Ca 0.02 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1r5k h ALA 318 Cb 0.61 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1r5k h ALA 318 CO -0.18 -0.40 0.27 -0.07 0.00 0.00 0.00 179.25 178.87 1r5k h LEU 319 N 0.10 0.87 -0.88 0.00 3.38 -0.38 -2.31 115.31 116.09 1r5k h LEU 319 Ca 0.28 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1r5k h LEU 319 Cb 0.44 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1r5k h LEU 319 CO -0.48 0.79 -0.30 -0.07 0.09 0.00 0.00 178.44 178.48 1r5k h LEU 320 N 0.90 0.49 -0.83 1.67 3.38 -0.08 -2.71 115.31 118.13 1r5k h LEU 320 Ca 0.22 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1r5k h LEU 320 Cb 0.18 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1r5k h LEU 320 CO -0.02 0.77 -0.33 0.44 0.09 0.00 0.00 178.44 179.39 1r5k h ASP 321 N 0.42 0.00 1.83 -0.43 3.32 -0.94 -3.05 116.42 117.58 1r5k h ASP 321 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1r5k h ASP 321 Cb 0.73 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1r5k h ASP 321 CO 0.06 0.33 -0.07 0.00 -1.72 0.00 0.00 179.24 177.84 1r5k h ALA 322 N 1.67 0.97 -1.76 3.45 0.00 -1.09 -3.46 119.26 119.04 1r5k h ALA 322 Ca -0.00 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.25 1r5k h ALA 322 Cb 0.92 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.77 1r5k h ALA 322 CO 0.04 0.00 0.43 0.39 0.00 0.00 0.00 179.25 180.11 1r5k n GLU 323 N -2.91 1.24 -2.73 0.00 -0.58 -1.15 -4.71 120.64 109.80 1r5k n GLU 323 Ca 0.04 0.45 -0.26 0.00 -0.42 0.00 0.00 57.16 56.96 1r5k n GLU 323 Cb 0.51 -2.06 0.00 0.00 -0.57 0.00 0.00 31.44 29.33 1r5k n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1r5k s PRO 324 N 0.23 3.39 0.99 3.49 0.04 -1.26 -5.04 135.00 136.84 1r5k s PRO 324 Ca 0.80 0.03 -0.12 0.00 0.04 0.00 0.00 61.00 61.76 1r5k s PRO 324 Cb -0.90 -2.41 0.18 0.00 0.04 0.00 0.00 34.50 31.41 1r5k s PRO 324 CO 0.48 -0.24 1.08 -1.25 0.04 0.00 0.00 177.00 177.11 1r5k s PRO 325 N -4.71 0.51 -0.10 0.56 0.04 -1.26 -4.98 135.00 125.06 1r5k s PRO 325 Ca 0.47 0.87 -0.13 0.00 0.04 0.00 0.00 61.00 62.26 1r5k s PRO 325 Cb -0.10 -1.72 -0.05 0.00 0.04 0.00 0.00 34.50 32.67 1r5k s PRO 325 CO 0.43 -2.77 0.30 0.42 0.04 0.00 0.00 177.00 175.43 1r5k s ILE 326 N -2.78 5.26 0.19 0.56 1.01 -1.26 -5.07 121.20 119.11 1r5k s ILE 326 Ca 0.65 0.59 -0.02 0.00 0.00 0.00 0.00 60.65 61.87 1r5k s ILE 326 Cb -0.21 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 1r5k s ILE 326 CO 0.59 0.49 0.40 -0.76 0.00 0.00 0.00 174.94 175.66 1r5k s LEU 327 N -0.30 4.22 0.24 2.97 1.43 -1.26 -5.06 118.68 120.91 1r5k s LEU 327 Ca 0.19 0.46 0.06 0.00 -1.03 0.00 0.00 54.13 53.81 1r5k s LEU 327 Cb -0.14 -3.22 -0.03 0.00 0.03 0.00 0.00 46.19 42.82 1r5k s LEU 327 CO 0.07 -0.03 0.26 -0.31 0.23 0.00 0.00 176.35 176.57 1r5k s TYR 328 N -1.84 3.27 0.71 0.29 1.51 -1.26 -4.41 117.35 115.61 1r5k s TYR 328 Ca 0.39 -0.06 0.01 0.00 -1.01 0.00 0.00 57.07 56.40 1r5k s TYR 328 Cb -0.11 -1.49 0.13 0.00 -0.11 0.00 0.00 41.96 40.38 1r5k s TYR 328 CO 0.28 0.49 0.98 0.45 -1.11 0.00 0.00 175.55 176.64 1r5k s SER 329 N -3.84 4.39 0.00 2.29 0.15 -1.26 -4.97 113.70 110.46 1r5k s SER 329 Ca 0.33 -0.49 0.23 0.00 0.70 0.00 0.00 55.95 56.72 1r5k s SER 329 Cb -0.09 0.13 0.20 0.00 -1.71 0.00 0.00 66.02 64.55 1r5k s SER 329 CO 0.27 -1.84 1.23 -0.62 1.20 0.00 0.00 173.24 173.48 1r5k n GLU 330 N -2.77 2.18 0.00 5.44 -0.58 -1.26 -4.93 120.64 118.72 1r5k n GLU 330 Ca 0.16 -1.89 0.00 0.00 -0.42 0.00 0.00 57.16 55.01 1r5k n GLU 330 Cb 0.61 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 30.04 1r5k n GLU 330 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1r5k n TYR 331 N 1.29 0.00 -0.28 -0.32 4.01 -1.26 -5.16 117.16 115.44 1r5k n TYR 331 Ca 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.88 1r5k n TYR 331 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.60 1r5k n TYR 331 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1r5k n ASP 332 N 0.00 0.00 -2.61 7.72 2.03 -1.26 -5.16 116.55 117.27 1r5k n ASP 332 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 1r5k n ASP 332 Cb 0.00 -0.92 0.12 0.00 -0.72 0.00 0.00 41.12 39.61 1r5k n ASP 332 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1r5k n PHE 337 N -1.19 -1.97 -1.25 -0.67 7.35 -1.26 -5.15 117.46 113.32 1r5k n PHE 337 Ca 0.00 -1.63 -0.27 0.00 -0.76 0.00 0.00 57.45 54.79 1r5k n PHE 337 Cb 0.36 1.51 0.22 0.00 0.35 0.00 0.00 39.48 41.93 1r5k n PHE 337 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1r5k n SER 338 N -1.46 -1.41 -0.22 -2.13 3.41 -1.26 -4.75 113.62 105.79 1r5k n SER 338 Ca -0.17 -1.21 0.01 0.00 -0.26 0.00 0.00 58.87 57.24 1r5k n SER 338 Cb 0.86 -0.93 0.12 0.00 -0.26 0.00 0.00 64.21 64.00 1r5k n SER 338 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1r5k h GLU 339 N 0.00 0.50 -0.09 4.33 5.08 -1.96 -2.28 114.58 120.15 1r5k h GLU 339 Ca -0.38 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 57.77 1r5k h GLU 339 Cb 1.14 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.28 1r5k h GLU 339 CO 0.26 0.33 -0.62 0.00 -1.00 0.00 0.00 179.01 177.97 1r5k h ALA 340 N 1.42 0.20 -0.37 3.43 0.00 -1.93 -1.50 119.26 120.51 1r5k h ALA 340 Ca 0.33 -0.55 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1r5k h ALA 340 Cb 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1r5k h ALA 340 CO -0.28 0.47 -0.07 1.03 0.00 0.00 0.00 179.25 180.40 1r5k h SER 341 N 0.21 0.60 -0.03 0.00 0.87 -1.91 -1.17 113.55 112.12 1r5k h SER 341 Ca -0.05 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.29 1r5k h SER 341 Cb 1.27 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 1r5k h SER 341 CO 0.13 0.72 -0.26 -0.03 -0.53 0.00 0.00 176.83 176.86 1r5k h MET 342 N 0.58 0.23 0.00 2.24 -1.53 -1.40 -2.83 114.93 112.22 1r5k h MET 342 Ca 0.11 -0.20 -0.03 0.00 -3.44 0.00 0.00 59.70 56.14 1r5k h MET 342 Cb 0.47 0.05 -0.00 0.00 -0.55 0.00 0.00 31.60 31.56 1r5k h MET 342 CO 0.02 0.88 -0.12 0.52 0.14 0.00 0.00 176.91 178.36 1r5k h MET 343 N -0.35 0.00 -0.05 0.39 2.07 -1.23 -1.93 114.93 113.83 1r5k h MET 343 Ca -0.02 0.00 -0.02 0.00 -2.07 0.00 0.00 59.70 57.59 1r5k h MET 343 Cb 0.95 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.68 1r5k h MET 343 CO 0.05 0.12 -0.05 0.78 1.07 0.00 0.00 176.91 178.88 1r5k h GLY 344 N 0.72 0.13 0.42 8.32 0.00 -1.17 0.14 103.07 111.62 1r5k h GLY 344 Ca -0.00 -0.13 0.04 0.00 0.00 0.00 0.00 47.33 47.24 1r5k h GLY 344 CO 0.02 0.12 -0.17 1.41 0.00 0.00 0.00 176.54 177.92 1r5k h LEU 345 N -0.34 -0.53 -0.40 3.11 3.38 -1.24 0.14 115.31 119.44 1r5k h LEU 345 Ca 0.01 0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1r5k h LEU 345 Cb 0.56 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1r5k h LEU 345 CO 0.01 -0.22 -0.07 -0.07 0.09 0.00 0.00 178.44 178.19 1r5k h LEU 346 N -0.21 0.75 -1.24 1.67 3.38 -1.34 -0.98 115.31 117.34 1r5k h LEU 346 Ca 0.10 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 1r5k h LEU 346 Cb 0.35 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1r5k h LEU 346 CO -0.26 0.93 0.44 0.74 0.09 0.00 0.00 178.44 180.37 1r5k h THR 347 N 0.57 1.19 -0.34 0.22 2.02 -0.59 0.64 112.91 116.63 1r5k h THR 347 Ca 0.10 -0.41 -0.16 0.00 0.77 0.00 0.00 66.41 66.71 1r5k h THR 347 Cb 0.58 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1r5k h THR 347 CO 0.03 0.20 -0.42 -1.13 0.37 0.00 0.00 175.52 174.58 1r5k h ASN 348 N 0.97 0.95 -0.24 4.18 -0.73 -0.37 -2.40 115.58 117.93 1r5k h ASN 348 Ca 0.26 -0.49 -0.04 0.00 1.87 0.00 0.00 56.30 57.90 1r5k h ASN 348 Cb -0.06 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.26 1r5k h ASN 348 CO -0.05 1.25 -0.00 0.25 -0.37 0.00 0.00 177.43 178.51 1r5k h LEU 349 N 0.67 0.42 -0.68 0.34 5.85 -0.82 -2.76 115.31 118.33 1r5k h LEU 349 Ca 0.04 -0.31 0.08 0.00 0.84 0.00 0.00 57.88 58.52 1r5k h LEU 349 Cb 1.02 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.87 1r5k h LEU 349 CO 0.10 0.63 0.35 0.00 -0.34 0.00 0.00 178.44 179.19 1r5k h ALA 350 N 0.80 0.92 -0.45 1.25 0.00 -0.86 -1.06 119.26 119.87 1r5k h ALA 350 Ca 0.07 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1r5k h ALA 350 Cb 0.42 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1r5k h ALA 350 CO 0.01 -0.01 -0.14 -0.44 0.00 0.00 0.00 179.25 178.67 1r5k h ASP 351 N 0.63 0.84 0.67 0.00 3.45 -1.30 0.31 116.42 121.02 1r5k h ASP 351 Ca 0.32 -0.27 -0.15 0.00 0.43 0.00 0.00 57.03 57.36 1r5k h ASP 351 Cb 0.28 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 38.80 1r5k h ASP 351 CO -0.23 0.98 -0.70 0.03 -1.57 0.00 0.00 179.24 177.76 1r5k h ARG 352 N 0.75 0.03 -0.24 3.56 3.08 -1.30 -1.78 114.38 118.47 1r5k h ARG 352 Ca 0.12 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 60.01 1r5k h ARG 352 Cb 0.65 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 1r5k h ARG 352 CO 0.05 0.72 -0.38 1.49 -1.07 0.00 0.00 179.97 180.77 1r5k h GLU 353 N 0.02 0.68 -0.67 0.04 4.57 -0.64 -2.47 114.58 116.11 1r5k h GLU 353 Ca -0.01 -0.41 0.07 0.00 -1.18 0.00 0.00 59.36 57.83 1r5k h GLU 353 Cb 1.24 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.81 1r5k h GLU 353 CO 0.09 1.03 0.34 1.25 -1.18 0.00 0.00 179.01 180.55 1r5k h LEU 354 N 0.40 0.47 -0.98 1.64 5.85 -0.22 0.29 115.31 122.76 1r5k h LEU 354 Ca 0.02 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 1r5k h LEU 354 Cb 0.97 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1r5k h LEU 354 CO 0.09 0.29 -0.18 0.58 -0.34 0.00 0.00 178.44 178.88 1r5k h VAL 355 N 0.61 1.25 -0.41 1.05 2.07 -1.17 -2.21 116.25 117.44 1r5k h VAL 355 Ca 0.31 -1.15 -0.09 0.00 0.82 0.00 0.00 66.70 66.59 1r5k h VAL 355 Cb 0.27 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1r5k h VAL 355 CO -0.23 0.37 -0.11 0.45 0.02 0.00 0.00 177.57 178.08 1r5k h HIS 356 N 0.48 0.90 -0.99 1.57 3.86 -0.88 -3.08 115.15 117.01 1r5k h HIS 356 Ca 0.08 -0.20 0.27 0.00 -1.16 0.00 0.00 60.37 59.36 1r5k h HIS 356 Cb 0.59 -0.22 -0.06 0.00 1.06 0.00 0.00 27.41 28.78 1r5k h HIS 356 CO 0.02 0.93 0.68 1.98 0.86 0.00 0.00 177.93 182.40 1r5k h MET 357 N 0.62 0.17 -0.04 2.45 -1.53 0.17 -2.16 114.93 114.61 1r5k h MET 357 Ca 0.10 -0.01 -0.00 0.00 -3.44 0.00 0.00 59.70 56.35 1r5k h MET 357 Cb 0.65 -0.04 -0.00 0.00 -0.55 0.00 0.00 31.60 31.66 1r5k h MET 357 CO 0.04 0.11 0.02 0.82 0.14 0.00 0.00 176.91 178.04 1r5k h ILE 358 N 0.18 1.12 0.00 1.77 2.04 -1.42 -0.20 117.51 120.99 1r5k h ILE 358 Ca 0.50 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 66.02 1r5k h ILE 358 Cb 1.67 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 39.02 1r5k h ILE 358 CO -0.11 0.09 0.00 0.78 0.00 0.00 0.00 178.15 178.92 1r5k h ASN 359 N -0.07 0.00 0.26 1.72 4.21 -1.55 -2.74 115.58 117.41 1r5k h ASN 359 Ca 0.01 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.51 1r5k h ASN 359 Cb 0.14 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.34 1r5k h ASN 359 CO -0.00 0.00 -0.13 -0.25 -1.29 0.00 0.00 177.43 175.76 1r5k h TRP 360 N 0.00 -0.33 -1.01 1.19 7.01 -1.24 -3.04 115.95 118.53 1r5k h TRP 360 Ca 0.00 -0.01 0.24 0.00 2.11 0.00 0.00 58.89 61.23 1r5k h TRP 360 Cb 0.66 0.11 -0.10 0.00 -2.10 0.00 0.00 29.16 27.73 1r5k h TRP 360 CO 0.00 0.04 0.64 0.00 -2.79 0.00 0.00 178.44 176.32 1r5k h ALA 361 N -0.41 2.03 -0.02 2.65 0.00 -0.84 0.31 119.26 122.98 1r5k h ALA 361 Ca -0.04 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1r5k h ALA 361 Cb 0.51 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1r5k h ALA 361 CO 0.06 -0.43 -0.37 0.87 0.00 0.00 0.00 179.25 179.38 1r5k h LYS 362 N 0.51 0.03 -0.00 0.00 1.57 -1.48 -1.77 116.57 115.43 1r5k h LYS 362 Ca 0.59 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 1r5k h LYS 362 Cb 1.29 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1r5k h LYS 362 CO -0.34 0.40 -0.01 0.54 -0.57 0.00 0.00 179.45 179.48 1r5k n ARG 363 N -4.09 0.56 -2.74 3.15 1.74 0.11 -4.53 116.66 110.86 1r5k n ARG 363 Ca -0.02 -0.02 -0.43 0.00 -0.77 0.00 0.00 57.85 56.62 1r5k n ARG 363 Cb 0.41 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.33 1r5k n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1r5k s VAL 364 N -2.45 4.72 -0.38 1.55 1.01 -0.67 -4.86 120.40 119.31 1r5k s VAL 364 Ca 0.32 1.83 -0.42 0.00 0.00 0.00 0.00 61.98 63.71 1r5k s VAL 364 Cb 0.21 -4.25 -0.17 0.00 0.00 0.00 0.00 36.38 32.16 1r5k s VAL 364 CO 0.44 -0.17 1.82 -2.65 0.00 0.00 0.00 175.10 174.54 1r5k n PRO 365 N 6.27 0.65 0.00 2.72 -0.02 -1.26 -1.47 135.00 141.88 1r5k n PRO 365 Ca 0.10 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1r5k n PRO 365 Cb 0.47 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1r5k n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r5k n GLY 366 N 4.95 2.42 0.37 -1.23 0.00 -1.26 -4.89 105.19 105.55 1r5k n GLY 366 Ca 0.34 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.44 1r5k n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1r5k h PHE 367 N 0.00 0.83 -0.00 1.61 3.57 -1.54 -1.53 116.94 119.88 1r5k h PHE 367 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1r5k h PHE 367 Cb 0.00 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.48 1r5k h PHE 367 CO 0.00 0.29 -0.09 1.55 -2.23 0.00 0.00 178.31 177.83 1r5k n VAL 368 N -4.58 0.00 0.58 1.41 3.14 -1.26 -2.78 118.33 114.84 1r5k n VAL 368 Ca 0.18 -0.02 0.13 0.00 -2.96 0.00 0.00 64.34 61.67 1r5k n VAL 368 Cb 0.50 -0.29 0.34 0.00 -1.06 0.00 0.00 33.84 33.33 1r5k n VAL 368 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 1r5k h ASP 369 N 0.18 0.00 -4.05 6.55 3.32 -1.66 -3.46 116.42 117.31 1r5k h ASP 369 Ca 0.00 -0.04 -0.49 0.00 0.02 0.00 0.00 57.03 56.53 1r5k h ASP 369 Cb 0.39 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.96 1r5k h ASP 369 CO 0.00 0.02 0.29 -0.76 -1.72 0.00 0.00 179.24 177.07 1r5k s LEU 370 N -4.62 3.62 0.81 1.55 1.02 -1.12 -5.04 118.68 114.90 1r5k s LEU 370 Ca 0.09 1.39 -0.11 0.00 0.02 0.00 0.00 54.13 55.52 1r5k s LEU 370 Cb 0.12 -4.33 0.08 0.00 0.02 0.00 0.00 46.19 42.08 1r5k s LEU 370 CO 0.63 -0.58 1.12 0.42 0.02 0.00 0.00 176.35 177.95 1r5k s THR 371 N -2.65 2.89 0.11 5.49 -4.23 -1.26 -4.75 115.64 111.24 1r5k s THR 371 Ca 0.55 0.30 -0.27 0.00 -1.18 0.00 0.00 61.69 61.10 1r5k s THR 371 Cb -0.10 -2.65 -0.10 0.00 1.34 0.00 0.00 72.50 70.98 1r5k s THR 371 CO 0.36 -0.36 1.65 0.25 -0.54 0.00 0.00 174.62 175.98 1r5k h LEU 372 N -1.23 -0.63 -2.06 4.79 5.85 -1.96 -0.24 115.31 119.82 1r5k h LEU 372 Ca -0.44 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.46 1r5k h LEU 372 Cb 1.25 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.49 1r5k h LEU 372 CO 0.48 -0.32 0.31 -0.74 -0.34 0.00 0.00 178.44 177.83 1r5k h HIS 373 N -0.45 0.00 0.20 1.25 -0.00 -1.93 0.33 115.15 114.55 1r5k h HIS 373 Ca 0.02 0.00 -0.27 0.00 -0.00 0.00 0.00 60.37 60.11 1r5k h HIS 373 Cb 0.45 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 27.89 1r5k h HIS 373 CO -0.19 0.00 -1.21 -0.44 -0.00 0.00 0.00 177.93 176.09 1r5k h ASP 374 N 0.00 0.67 -0.39 3.26 3.45 -1.75 -1.52 116.42 120.14 1r5k h ASP 374 Ca 0.17 -0.93 0.07 0.00 0.43 0.00 0.00 57.03 56.77 1r5k h ASP 374 Cb 0.78 -0.22 -0.06 0.00 -0.56 0.00 0.00 39.33 39.27 1r5k h ASP 374 CO -0.00 1.58 0.00 1.56 -1.57 0.00 0.00 179.24 180.81 1r5k h GLN 375 N -0.09 0.10 -0.38 3.56 4.20 0.89 -1.15 115.11 122.25 1r5k h GLN 375 Ca -0.21 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.40 1r5k h GLN 375 Cb 1.94 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.68 1r5k h GLN 375 CO 0.22 0.07 -0.14 0.28 -0.67 0.00 0.00 178.83 178.59 1r5k h VAL 376 N 0.11 1.25 -0.66 -0.54 2.07 -0.45 -2.16 116.25 115.87 1r5k h VAL 376 Ca 0.19 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1r5k h VAL 376 Cb 0.27 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1r5k h VAL 376 CO -0.32 0.39 0.33 -0.74 0.02 0.00 0.00 177.57 177.25 1r5k h HIS 377 N 0.62 0.95 -0.70 1.57 -0.00 -0.71 -0.91 115.15 115.96 1r5k h HIS 377 Ca 0.10 -0.04 0.06 0.00 -0.00 0.00 0.00 60.37 60.50 1r5k h HIS 377 Cb 0.59 -0.30 -0.06 0.00 -0.00 0.00 0.00 27.41 27.65 1r5k h HIS 377 CO 0.03 0.70 0.39 -0.07 -0.00 0.00 0.00 177.93 178.98 1r5k h LEU 378 N 0.92 0.59 -0.08 0.26 4.07 -0.61 -1.53 115.31 118.92 1r5k h LEU 378 Ca 0.23 0.03 -0.23 0.00 0.08 0.00 0.00 57.88 57.99 1r5k h LEU 378 Cb 0.10 -0.09 0.01 0.00 1.08 0.00 0.00 40.66 41.77 1r5k h LEU 378 CO -0.03 0.37 -0.85 -0.07 -1.08 0.00 0.00 178.44 176.78 1r5k h LEU 379 N 0.72 0.89 -0.82 1.67 3.38 -0.99 -0.98 115.31 119.18 1r5k h LEU 379 Ca 0.31 -0.68 0.17 0.00 0.09 0.00 0.00 57.88 57.77 1r5k h LEU 379 Cb 0.20 -0.27 -0.11 0.00 0.09 0.00 0.00 40.66 40.58 1r5k h LEU 379 CO -0.19 1.44 0.34 -0.08 0.09 0.00 0.00 178.44 180.05 1r5k h GLU 380 N 0.42 0.44 0.00 1.13 4.81 -0.93 -0.16 114.58 120.29 1r5k h GLU 380 Ca -0.08 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.02 1r5k h GLU 380 Cb 1.50 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.77 1r5k h GLU 380 CO 0.17 0.29 -0.56 0.00 -0.73 0.00 0.00 179.01 178.18 1r5k n ALA 382 N -2.23 3.21 -0.20 0.00 0.00 -0.41 -4.78 120.51 116.11 1r5k n ALA 382 Ca 0.01 -0.33 -0.08 0.00 0.00 0.00 0.00 53.44 53.04 1r5k n ALA 382 Cb 0.73 -0.44 0.02 0.00 0.00 0.00 0.00 19.45 19.76 1r5k n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1r5k h TRP 383 N 0.00 0.83 -0.19 0.00 5.08 -1.25 -1.00 115.95 119.42 1r5k h TRP 383 Ca 0.00 -0.05 -0.12 0.00 1.08 0.00 0.00 58.89 59.80 1r5k h TRP 383 Cb 0.39 -0.25 -0.01 0.00 -3.00 0.00 0.00 29.16 26.28 1r5k h TRP 383 CO 0.00 0.66 -0.39 1.25 -1.28 0.00 0.00 178.44 178.67 1r5k h LEU 384 N 0.76 0.45 -0.34 0.11 5.85 -1.86 -1.41 115.31 118.87 1r5k h LEU 384 Ca 0.19 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1r5k h LEU 384 Cb 0.16 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1r5k h LEU 384 CO -0.02 0.80 0.20 -0.33 -0.34 0.00 0.00 178.44 178.75 1r5k h GLU 385 N 0.36 0.47 -0.65 1.25 5.08 -1.67 -0.82 114.58 118.59 1r5k h GLU 385 Ca 0.03 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 1r5k h GLU 385 Cb 0.85 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 1r5k h GLU 385 CO 0.07 0.37 0.26 0.82 -1.00 0.00 0.00 179.01 179.53 1r5k h ILE 386 N 0.44 1.24 -0.96 3.13 2.04 -1.04 0.20 117.51 122.55 1r5k h ILE 386 Ca 0.12 -0.74 0.05 0.00 1.00 0.00 0.00 64.86 65.29 1r5k h ILE 386 Cb 0.03 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.55 1r5k h ILE 386 CO -0.02 0.29 0.62 -0.07 0.00 0.00 0.00 178.15 178.97 1r5k h LEU 387 N 0.91 1.01 0.02 1.44 4.07 -1.13 -2.56 115.31 119.07 1r5k h LEU 387 Ca 0.22 0.00 -0.27 0.00 0.08 0.00 0.00 57.88 57.90 1r5k h LEU 387 Cb 0.20 -0.22 0.02 0.00 1.08 0.00 0.00 40.66 41.75 1r5k h LEU 387 CO -0.02 0.67 -1.10 0.24 -1.08 0.00 0.00 178.44 177.15 1r5k h MET 388 N 1.16 0.65 -0.13 1.13 2.86 -0.08 -2.06 114.93 118.46 1r5k h MET 388 Ca 0.40 -0.75 -0.08 0.00 -2.06 0.00 0.00 59.70 57.21 1r5k h MET 388 Cb 0.09 0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1r5k h MET 388 CO -0.15 1.32 -0.27 0.97 1.06 0.00 0.00 176.91 179.84 1r5k h ILE 389 N 0.34 1.25 -0.09 -1.22 2.10 -0.60 0.97 117.51 120.26 1r5k h ILE 389 Ca -0.14 -1.17 -0.18 0.00 1.08 0.00 0.00 64.86 64.45 1r5k h ILE 389 Cb 1.76 1.46 -0.01 0.00 -1.09 0.00 0.00 36.82 38.94 1r5k h ILE 389 CO 0.21 0.35 -0.69 1.23 -1.08 0.00 0.00 178.15 178.18 1r5k h GLY 390 N 1.00 0.45 0.89 8.18 0.00 -1.37 -0.24 103.07 111.98 1r5k h GLY 390 Ca 0.03 -0.61 -0.08 0.00 0.00 0.00 0.00 47.33 46.68 1r5k h GLY 390 CO 0.04 0.54 -0.14 -2.00 0.00 0.00 0.00 176.54 174.98 1r5k h LEU 391 N 0.28 0.61 -1.16 3.11 5.85 -0.82 -2.03 115.31 121.14 1r5k h LEU 391 Ca -0.02 -0.41 -0.06 0.00 0.84 0.00 0.00 57.88 58.23 1r5k h LEU 391 Cb 1.25 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 1r5k h LEU 391 CO 0.12 0.89 -0.04 0.58 -0.34 0.00 0.00 178.44 179.64 1r5k h VAL 392 N 0.33 1.21 -0.07 1.05 2.07 -0.52 0.16 116.25 120.47 1r5k h VAL 392 Ca 0.06 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 1r5k h VAL 392 Cb 0.66 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1r5k h VAL 392 CO 0.04 0.29 -0.12 -0.25 0.02 0.00 0.00 177.57 177.56 1r5k h TRP 393 N 0.50 0.26 -0.37 1.57 2.91 -0.96 -2.59 115.95 117.27 1r5k h TRP 393 Ca 0.10 -0.09 0.00 0.00 1.13 0.00 0.00 58.89 60.03 1r5k h TRP 393 Cb 0.39 -0.05 -0.02 0.00 -0.51 0.00 0.00 29.16 28.97 1r5k h TRP 393 CO 0.01 0.70 0.23 0.00 -1.03 0.00 0.00 178.44 178.36 1r5k h ARG 394 N -0.26 0.49 -0.00 2.65 3.08 -1.14 -2.53 114.38 116.68 1r5k h ARG 394 Ca 0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1r5k h ARG 394 Cb 0.68 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.62 1r5k h ARG 394 CO 0.03 0.34 -0.08 0.43 -1.07 0.00 0.00 179.97 179.62 1r5k n SER 395 N -4.47 0.21 -0.25 7.04 7.64 0.02 -4.42 113.62 119.40 1r5k n SER 395 Ca 0.02 -0.21 -0.11 0.00 1.01 0.00 0.00 58.87 59.59 1r5k n SER 395 Cb 0.07 -0.20 -0.07 0.00 -1.01 0.00 0.00 64.21 63.00 1r5k n SER 395 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1r5k h MET 396 N 0.21 -0.20 -1.36 1.43 -1.53 -1.05 0.16 114.93 112.58 1r5k h MET 396 Ca 0.00 0.01 -0.29 0.00 -3.44 0.00 0.00 59.70 55.99 1r5k h MET 396 Cb 0.36 0.05 -0.14 0.00 -0.55 0.00 0.00 31.60 31.33 1r5k h MET 396 CO 0.00 -0.14 0.37 0.39 0.14 0.00 0.00 176.91 177.67 1r5k n GLU 397 N -5.36 1.70 -3.21 0.39 -0.58 -1.26 -4.32 120.64 108.01 1r5k n GLU 397 Ca 0.00 -1.46 -0.24 0.00 -0.42 0.00 0.00 57.16 55.05 1r5k n GLU 397 Cb 0.32 -1.57 -0.07 0.00 -0.57 0.00 0.00 31.44 29.56 1r5k n GLU 397 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1r5k n HIS 398 N 0.18 0.21 -1.50 -0.32 8.25 0.56 -5.12 115.22 117.48 1r5k n HIS 398 Ca 0.28 -3.66 -0.54 0.00 -0.26 0.00 0.00 57.72 53.55 1r5k n HIS 398 Cb 0.73 -0.38 -0.06 0.00 1.12 0.00 0.00 29.99 31.40 1r5k n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1r5k n PRO 399 N 1.20 0.36 -1.03 -0.41 -0.02 -1.26 -1.50 135.00 132.33 1r5k n PRO 399 Ca 0.23 0.13 -0.01 0.00 -2.02 0.00 0.00 63.50 61.82 1r5k n PRO 399 Cb 0.53 -1.52 -0.00 0.00 -0.02 0.00 0.00 33.50 32.48 1r5k n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r5k n GLY 400 N 1.81 0.35 3.19 -1.23 0.00 -1.26 -4.97 105.19 103.08 1r5k n GLY 400 Ca 0.18 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 1r5k n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r5k s LYS 401 N -1.21 0.89 -0.13 1.61 1.02 -0.56 -2.83 119.74 118.54 1r5k s LYS 401 Ca 0.00 -1.38 0.02 0.00 0.02 0.00 0.00 55.97 54.63 1r5k s LYS 401 Cb 0.00 -0.24 0.01 0.00 -0.52 0.00 0.00 37.83 37.08 1r5k s LYS 401 CO 0.00 -0.03 -0.18 -0.51 -0.92 0.00 0.00 175.35 173.71 1r5k s LEU 402 N -3.07 1.90 -0.96 3.17 1.43 0.39 -4.85 118.68 116.69 1r5k s LEU 402 Ca 0.14 -0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 52.57 1r5k s LEU 402 Cb 0.05 -1.27 0.18 0.00 0.03 0.00 0.00 46.19 45.19 1r5k s LEU 402 CO -0.03 0.04 1.05 -0.22 0.23 0.00 0.00 176.35 177.41 1r5k s LEU 403 N 0.97 5.79 0.29 1.79 0.20 -1.26 -0.69 118.68 125.77 1r5k s LEU 403 Ca -0.05 -2.58 0.07 0.00 0.69 0.00 0.00 54.13 52.26 1r5k s LEU 403 Cb -0.15 -2.31 0.42 0.00 -0.43 0.00 0.00 46.19 43.72 1r5k s LEU 403 CO -0.03 -0.76 1.67 -0.26 -0.29 0.00 0.00 176.35 176.68 1r5k h PHE 404 N 7.99 0.23 -2.54 5.38 0.04 -1.68 -3.42 116.94 122.93 1r5k h PHE 404 Ca 0.17 -0.07 0.04 0.00 2.80 0.00 0.00 57.97 60.91 1r5k h PHE 404 Cb 0.99 -0.05 -0.14 0.00 2.20 0.00 0.00 35.95 38.95 1r5k h PHE 404 CO 1.07 0.63 0.35 0.00 -0.60 0.00 0.00 178.31 179.76 1r5k s ALA 405 N -4.01 -1.73 0.62 2.45 0.00 -1.13 -4.94 121.76 113.03 1r5k s ALA 405 Ca -0.04 0.83 0.27 0.00 0.00 0.00 0.00 51.96 53.03 1r5k s ALA 405 Cb 0.13 0.54 1.40 0.00 0.00 0.00 0.00 23.12 25.20 1r5k s ALA 405 CO 0.77 -0.69 1.81 -1.35 0.00 0.00 0.00 175.76 176.31 1r5k h PRO 406 N 2.09 0.00 -0.09 0.00 0.11 -1.89 0.87 132.00 133.08 1r5k h PRO 406 Ca -0.27 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 1r5k h PRO 406 Cb 1.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 1r5k h PRO 406 CO 0.34 0.00 -0.01 0.27 -0.21 0.00 0.00 178.00 178.40 1r5k n ASN 407 N -3.32 2.88 -3.32 -2.05 6.94 -1.26 -4.82 115.26 110.31 1r5k n ASN 407 Ca 0.05 -3.08 -0.20 0.00 -0.02 0.00 0.00 54.58 51.33 1r5k n ASN 407 Cb 0.65 -0.47 -0.08 0.00 -2.36 0.00 0.00 39.78 37.51 1r5k n ASN 407 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1r5k s LEU 408 N -2.87 0.33 -0.31 -4.53 2.96 0.30 -4.18 118.68 110.39 1r5k s LEU 408 Ca 0.36 -2.10 -0.04 0.00 -0.22 0.00 0.00 54.13 52.12 1r5k s LEU 408 Cb 0.30 0.30 0.04 0.00 0.50 0.00 0.00 46.19 47.33 1r5k s LEU 408 CO 0.05 -0.22 0.04 -0.22 -1.32 0.00 0.00 176.35 174.68 1r5k s LEU 409 N 0.93 3.99 0.04 -0.68 2.96 -1.26 -1.66 118.68 123.00 1r5k s LEU 409 Ca 0.23 -1.13 0.02 0.00 -0.22 0.00 0.00 54.13 53.03 1r5k s LEU 409 Cb -0.10 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1r5k s LEU 409 CO -0.07 -0.27 0.04 -0.76 -1.32 0.00 0.00 176.35 173.97 1r5k s LEU 410 N 1.34 3.66 0.39 -0.68 1.43 0.14 -4.90 118.68 120.07 1r5k s LEU 410 Ca -0.03 -0.01 -0.20 0.00 -1.03 0.00 0.00 54.13 52.86 1r5k s LEU 410 Cb -0.19 -2.23 -0.10 0.00 0.03 0.00 0.00 46.19 43.69 1r5k s LEU 410 CO 0.00 0.23 0.90 -1.81 0.23 0.00 0.00 176.35 175.90 1r5k s ASP 411 N -1.97 6.95 0.18 2.29 1.01 -1.26 -0.46 116.67 123.41 1r5k s ASP 411 Ca 0.24 1.61 -0.18 0.00 0.71 0.00 0.00 52.55 54.92 1r5k s ASP 411 Cb -0.12 -2.50 0.13 0.00 1.01 0.00 0.00 42.92 41.44 1r5k s ASP 411 CO 0.16 -0.29 1.35 -1.14 0.21 0.00 0.00 175.17 175.46 1r5k n ARG 412 N -0.42 -0.25 -0.14 8.23 0.00 -1.13 -1.62 116.66 121.33 1r5k n ARG 412 Ca 0.05 1.33 0.00 0.00 -0.00 0.00 0.00 57.85 59.24 1r5k n ARG 412 Cb 0.53 -1.97 0.27 0.00 0.00 0.00 0.00 32.46 31.29 1r5k n ARG 412 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 1r5k h ASN 413 N 0.00 0.74 0.24 6.15 4.21 -1.93 -1.96 115.58 123.03 1r5k h ASN 413 Ca 0.26 -0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.71 1r5k h ASN 413 Cb 0.47 -0.19 0.00 0.00 -1.12 0.00 0.00 38.32 37.49 1r5k h ASN 413 CO -0.85 0.61 0.00 0.00 -1.29 0.00 0.00 177.43 175.90 1r5k n GLN 414 N -4.38 0.17 0.02 0.81 6.02 -0.64 -1.10 117.38 118.28 1r5k n GLN 414 Ca 0.06 0.17 -0.07 0.00 -0.01 0.00 0.00 57.00 57.15 1r5k n GLN 414 Cb 0.11 -1.50 0.10 0.00 1.02 0.00 0.00 30.24 29.97 1r5k n GLN 414 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1r5k h GLY 415 N 2.01 0.53 1.55 1.08 0.00 -1.32 -2.97 103.07 103.95 1r5k h GLY 415 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1r5k h GLY 415 CO 0.00 0.51 0.04 0.28 0.00 0.00 0.00 176.54 177.37 1r5k n LYS 416 N -3.99 0.00 0.28 4.80 5.02 -0.26 -1.67 118.16 122.35 1r5k n LYS 416 Ca -0.02 0.33 0.16 0.00 -2.02 0.00 0.00 58.31 56.76 1r5k n LYS 416 Cb 0.55 -1.54 0.78 0.00 -0.02 0.00 0.00 35.03 34.80 1r5k n LYS 416 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1r5k s VAL 418 N -3.91 1.11 -0.43 0.00 1.01 -0.67 -3.12 120.40 114.39 1r5k s VAL 418 Ca -0.01 -1.64 -0.44 0.00 0.00 0.00 0.00 61.98 59.89 1r5k s VAL 418 Cb 0.11 -1.83 -0.18 0.00 0.00 0.00 0.00 36.38 34.47 1r5k s VAL 418 CO 0.54 -0.69 1.75 -0.62 0.00 0.00 0.00 175.10 176.08 1r5k n GLU 419 N 4.64 0.38 0.00 2.72 1.02 -1.26 -0.55 120.64 127.58 1r5k n GLU 419 Ca -0.00 0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 1r5k n GLU 419 Cb 0.41 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1r5k n GLU 419 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1r5k n GLY 420 N 4.69 1.79 0.07 0.62 0.00 -1.26 -4.96 105.19 106.13 1r5k n GLY 420 Ca 0.34 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.48 1r5k n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1r5k h MET 421 N 0.35 0.00 -0.34 1.61 -1.53 -1.05 -3.35 114.93 110.62 1r5k h MET 421 Ca 0.00 0.00 -0.09 0.00 -3.44 0.00 0.00 59.70 56.17 1r5k h MET 421 Cb 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.04 1r5k h MET 421 CO 0.00 0.00 -0.14 -0.24 0.14 0.00 0.00 176.91 176.67 1r5k h VAL 422 N 0.00 1.29 -0.68 -5.77 3.04 -1.77 0.38 116.25 112.73 1r5k h VAL 422 Ca 0.00 -1.24 0.13 0.00 -1.01 0.00 0.00 66.70 64.58 1r5k h VAL 422 Cb 0.77 1.37 -0.13 0.00 -2.01 0.00 0.00 31.29 31.29 1r5k h VAL 422 CO 0.00 0.40 -0.20 -0.08 -1.01 0.00 0.00 177.57 176.68 1r5k h GLU 423 N 0.47 -0.03 -0.41 4.17 4.81 -1.96 -0.91 114.58 120.72 1r5k h GLU 423 Ca 0.08 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.16 1r5k h GLU 423 Cb 0.67 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1r5k h GLU 423 CO 0.05 -0.02 -0.32 0.82 -0.73 0.00 0.00 179.01 178.80 1r5k h ILE 424 N -0.03 1.27 -0.48 2.32 2.04 -1.62 -2.77 117.51 118.24 1r5k h ILE 424 Ca 0.32 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1r5k h ILE 424 Cb 0.52 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.87 1r5k h ILE 424 CO -0.71 0.50 0.27 -0.26 0.00 0.00 0.00 178.15 177.95 1r5k h PHE 425 N 0.78 0.65 -0.98 1.37 -1.00 -0.48 -2.00 116.94 115.28 1r5k h PHE 425 Ca 0.08 -0.01 0.06 0.00 2.81 0.00 0.00 57.97 60.91 1r5k h PHE 425 Cb 0.91 -0.21 -0.07 0.00 3.61 0.00 0.00 35.95 40.19 1r5k h PHE 425 CO 0.06 0.47 0.64 -0.44 -1.61 0.00 0.00 178.31 177.43 1r5k h ASP 426 N 0.63 1.01 -0.33 2.17 3.45 -1.11 0.76 116.42 123.01 1r5k h ASP 426 Ca 0.17 0.01 -0.13 0.00 0.43 0.00 0.00 57.03 57.51 1r5k h ASP 426 Cb 0.03 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 38.58 1r5k h ASP 426 CO -0.03 0.65 -0.27 0.24 -1.57 0.00 0.00 179.24 178.25 1r5k h MET 427 N 1.15 0.85 -0.50 3.56 2.86 -1.21 -0.74 114.93 120.90 1r5k h MET 427 Ca 0.42 -0.38 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 1r5k h MET 427 Cb 0.17 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1r5k h MET 427 CO -0.16 1.02 -0.13 -0.07 1.06 0.00 0.00 176.91 178.62 1r5k h LEU 428 N 0.72 0.95 -0.63 1.22 3.38 -0.59 -0.42 115.31 119.94 1r5k h LEU 428 Ca 0.09 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 1r5k h LEU 428 Cb 0.82 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1r5k h LEU 428 CO 0.07 1.08 0.11 -0.07 0.09 0.00 0.00 178.44 179.72 1r5k h LEU 429 N 0.84 1.00 -0.45 1.67 3.38 -0.70 -0.22 115.31 120.83 1r5k h LEU 429 Ca 0.13 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1r5k h LEU 429 Cb 0.67 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1r5k h LEU 429 CO 0.05 1.00 0.13 0.00 0.09 0.00 0.00 178.44 179.72 1r5k h ALA 430 N 1.03 0.59 -0.28 1.53 0.00 -0.92 -0.46 119.26 120.76 1r5k h ALA 430 Ca 0.19 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1r5k h ALA 430 Cb 0.42 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1r5k h ALA 430 CO 0.01 0.25 0.17 1.15 0.00 0.00 0.00 179.25 180.83 1r5k h THR 431 N 0.59 1.04 0.00 0.00 2.02 -0.75 -1.45 112.91 114.36 1r5k h THR 431 Ca 0.14 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.16 1r5k h THR 431 Cb 0.28 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1r5k h THR 431 CO -0.00 0.06 -0.23 0.77 0.37 0.00 0.00 175.52 176.49 1r5k h SER 432 N 0.34 0.00 -0.49 4.18 4.64 -0.70 -1.91 113.55 119.62 1r5k h SER 432 Ca 0.11 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.36 1r5k h SER 432 Cb -0.01 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 1r5k h SER 432 CO -0.04 0.23 0.04 0.28 -0.87 0.00 0.00 176.83 176.46 1r5k h SER 433 N 0.00 0.81 -0.59 4.97 0.02 -0.64 -1.74 113.55 116.38 1r5k h SER 433 Ca -0.00 -0.29 -0.03 0.00 -0.84 0.00 0.00 61.79 60.63 1r5k h SER 433 Cb 0.84 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 1r5k h SER 433 CO 0.03 0.90 0.26 -0.09 -1.14 0.00 0.00 176.83 176.79 1r5k h ARG 434 N 0.70 0.86 -0.71 3.45 9.65 -0.61 -0.89 114.38 126.83 1r5k h ARG 434 Ca 0.14 -0.14 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1r5k h ARG 434 Cb 0.46 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.86 1r5k h ARG 434 CO 0.02 0.72 0.32 0.74 2.80 0.00 0.00 179.97 184.57 1r5k h PHE 435 N 0.81 1.02 -0.37 2.20 0.05 -1.19 -0.69 116.94 118.76 1r5k h PHE 435 Ca 0.20 -0.05 -0.04 0.00 3.82 0.00 0.00 57.97 61.90 1r5k h PHE 435 Cb 0.16 -0.32 -0.01 0.00 2.00 0.00 0.00 35.95 37.78 1r5k h PHE 435 CO 0.00 0.75 0.07 -0.09 -0.18 0.00 0.00 178.31 178.87 1r5k h ARG 436 N 1.01 0.60 -0.84 1.51 2.43 -0.95 0.43 114.38 118.57 1r5k h ARG 436 Ca 0.24 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1r5k h ARG 436 Cb 0.13 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.56 1r5k h ARG 436 CO -0.03 0.65 0.55 0.52 -1.51 0.00 0.00 179.97 180.15 1r5k h MET 437 N 0.45 1.07 0.00 0.20 2.86 -0.69 -1.84 114.93 116.98 1r5k h MET 437 Ca 0.11 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1r5k h MET 437 Cb 0.33 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1r5k h MET 437 CO 0.00 0.71 0.00 -1.33 1.06 0.00 0.00 176.91 177.36 1r5k n MET 438 N -4.52 0.35 -3.84 1.72 2.81 -0.31 -4.91 117.12 108.42 1r5k n MET 438 Ca 0.09 0.00 -0.24 0.00 -1.81 0.00 0.00 57.70 55.75 1r5k n MET 438 Cb 0.04 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 1r5k n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1r5k n ASN 439 N -1.33 -0.82 -4.59 7.83 4.05 0.01 -4.87 115.26 115.54 1r5k n ASN 439 Ca 0.13 -0.93 -0.45 0.00 0.45 0.00 0.00 54.58 53.78 1r5k n ASN 439 Cb 0.26 -3.48 -0.02 0.00 1.23 0.00 0.00 39.78 37.77 1r5k n ASN 439 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 1r5k n LEU 440 N -4.34 1.80 -4.77 1.20 7.94 -0.40 -4.98 117.00 113.45 1r5k n LEU 440 Ca -0.30 1.18 -0.23 0.00 -1.11 0.00 0.00 56.01 55.55 1r5k n LEU 440 Cb 0.68 -1.29 -0.05 0.00 0.53 0.00 0.00 43.42 43.29 1r5k n LEU 440 CO 0.72 -1.38 -0.22 -1.10 -1.11 0.00 0.00 177.39 174.30 1r5k s GLN 441 N -1.47 2.75 0.13 1.96 -1.52 -1.26 -4.98 119.66 115.27 1r5k s GLN 441 Ca 0.60 -1.12 -0.19 0.00 -1.95 0.00 0.00 55.36 52.69 1r5k s GLN 441 Cb -0.71 -2.47 -0.03 0.00 -0.22 0.00 0.00 33.01 29.59 1r5k s GLN 441 CO 0.59 0.40 1.74 0.78 -0.25 0.00 0.00 175.29 178.56 1r5k h GLY 442 N 1.75 0.24 0.46 3.09 0.00 -1.98 0.34 103.07 106.96 1r5k h GLY 442 Ca -0.47 -0.02 0.16 0.00 0.00 0.00 0.00 47.33 47.00 1r5k h GLY 442 CO 0.61 0.00 0.58 0.83 0.00 0.00 0.00 176.54 178.55 1r5k h GLU 443 N 0.13 0.58 0.04 4.80 3.07 -1.97 -0.84 114.58 120.39 1r5k h GLU 443 Ca 0.10 -0.03 -0.25 0.00 -0.50 0.00 0.00 59.36 58.67 1r5k h GLU 443 Cb 0.09 -0.13 0.01 0.00 -0.84 0.00 0.00 28.75 27.88 1r5k h GLU 443 CO -0.13 0.38 -1.05 0.93 -1.40 0.00 0.00 179.01 177.75 1r5k h GLU 444 N 0.60 0.45 -0.10 2.33 5.08 -1.63 -3.12 114.58 118.20 1r5k h GLU 444 Ca 0.46 -0.54 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1r5k h GLU 444 Cb 0.86 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 1r5k h GLU 444 CO -0.20 1.19 0.06 0.35 -1.00 0.00 0.00 179.01 179.40 1r5k h PHE 445 N 0.23 0.10 -0.36 4.33 3.57 0.65 -0.80 116.94 124.67 1r5k h PHE 445 Ca -0.11 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.38 1r5k h PHE 445 Cb 1.70 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 40.39 1r5k h PHE 445 CO 0.07 0.06 0.15 0.28 -2.23 0.00 0.00 178.31 176.65 1r5k h VAL 446 N 0.12 1.14 -0.04 1.41 2.07 -1.31 -0.93 116.25 118.72 1r5k h VAL 446 Ca 0.04 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 1r5k h VAL 446 Cb -0.00 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1r5k h VAL 446 CO -0.02 0.17 -0.03 0.00 0.02 0.00 0.00 177.57 177.70 1r5k h LEU 448 N -0.36 0.14 -0.68 0.00 4.07 -0.82 -1.59 115.31 116.06 1r5k h LEU 448 Ca 0.01 0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.07 1r5k h LEU 448 Cb 0.51 0.10 -0.03 0.00 1.08 0.00 0.00 40.66 42.32 1r5k h LEU 448 CO 0.01 0.07 0.44 0.50 -1.08 0.00 0.00 178.44 178.38 1r5k h LYS 449 N 0.35 0.91 -0.19 1.13 3.64 -1.09 -0.93 116.57 120.39 1r5k h LYS 449 Ca 0.33 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.59 1r5k h LYS 449 Cb 0.46 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1r5k h LYS 449 CO -0.36 0.62 -0.09 0.77 -2.27 0.00 0.00 179.45 178.12 1r5k h SER 450 N 0.93 0.28 -0.52 4.20 0.02 -1.14 -2.57 113.55 114.75 1r5k h SER 450 Ca 0.25 -0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 61.08 1r5k h SER 450 Cb -0.07 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 1r5k h SER 450 CO -0.05 0.41 0.05 0.40 -1.14 0.00 0.00 176.83 176.51 1r5k h ILE 451 N 0.29 1.26 -0.48 3.27 2.04 -0.21 -2.28 117.51 121.39 1r5k h ILE 451 Ca 0.06 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 64.92 1r5k h ILE 451 Cb 0.35 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 1r5k h ILE 451 CO 0.02 0.36 0.29 0.40 0.00 0.00 0.00 178.15 179.21 1r5k h ILE 452 N 0.75 1.15 -0.63 -0.67 2.04 -1.14 0.19 117.51 119.19 1r5k h ILE 452 Ca 0.15 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.73 1r5k h ILE 452 Cb 0.45 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 36.97 1r5k h ILE 452 CO 0.02 0.15 0.33 0.25 0.00 0.00 0.00 178.15 178.90 1r5k h LEU 453 N 0.65 0.47 0.00 1.44 5.85 -1.25 -2.55 115.31 119.93 1r5k h LEU 453 Ca 0.17 0.04 -0.20 0.00 0.84 0.00 0.00 57.88 58.73 1r5k h LEU 453 Cb -0.01 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 1r5k h LEU 453 CO -0.03 0.30 -1.36 -0.07 -0.34 0.00 0.00 178.44 176.94 1r5k h LEU 454 N 0.61 0.00 0.00 2.25 3.38 -0.94 -3.39 115.31 117.22 1r5k h LEU 454 Ca 0.29 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.14 1r5k h LEU 454 Cb 0.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1r5k h LEU 454 CO -0.20 0.73 -1.57 -3.20 0.09 0.00 0.00 178.44 174.29 1r5k n ASN 455 N -3.01 0.56 0.25 -0.43 5.15 0.61 -4.07 115.26 114.31 1r5k n ASN 455 Ca -0.10 0.23 0.14 0.00 -0.60 0.00 0.00 54.58 54.26 1r5k n ASN 455 Cb 0.90 0.74 0.55 0.00 -0.53 0.00 0.00 39.78 41.45 1r5k n ASN 455 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1r5k h SER 456 N 0.00 0.00 -0.00 1.20 0.02 -1.65 -3.18 113.55 109.94 1r5k h SER 456 Ca -0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1r5k h SER 456 Cb 1.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.94 1r5k h SER 456 CO 0.02 0.09 0.00 0.61 -1.14 0.00 0.00 176.83 176.41 1r5k n GLY 457 N 0.17 -1.17 0.28 -3.77 0.00 -1.26 -4.75 105.19 94.70 1r5k n GLY 457 Ca 0.01 -0.05 0.17 0.00 0.00 0.00 0.00 46.02 46.15 1r5k n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1r5k h VAL 458 N 0.34 0.05 -0.35 1.61 3.04 -1.69 -2.60 116.25 116.64 1r5k h VAL 458 Ca 0.00 -0.49 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1r5k h VAL 458 Cb 0.09 1.46 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 1r5k h VAL 458 CO 0.00 0.02 0.00 -1.22 -1.01 0.00 0.00 177.57 175.36 1r5k n TYR 459 N -3.12 0.46 -2.24 3.17 4.01 -1.26 -4.39 117.16 113.79 1r5k n TYR 459 Ca 0.00 -0.23 -0.07 0.00 -0.16 0.00 0.00 57.90 57.44 1r5k n TYR 459 Cb 0.28 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.38 1r5k n TYR 459 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1r5k n THR 460 N 1.04 1.72 0.00 -0.72 -2.24 -0.98 -5.02 114.28 108.08 1r5k n THR 460 Ca 0.18 -3.16 0.00 0.00 -2.27 0.00 0.00 64.05 58.80 1r5k n THR 460 Cb 0.49 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1r5k n THR 460 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1r5k n PHE 461 N -0.57 0.00 -2.20 4.78 0.99 -1.26 -5.03 117.46 114.16 1r5k n PHE 461 Ca 0.23 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.66 1r5k n PHE 461 Cb 0.89 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 39.35 1r5k n PHE 461 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.76 178.23 1r5k n LEU 462 N 0.00 -0.08 0.00 4.37 -0.00 -1.26 -5.03 117.00 115.01 1r5k n LEU 462 Ca 0.00 -1.89 0.00 0.00 -0.00 0.00 0.00 56.01 54.12 1r5k n LEU 462 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1r5k n LEU 462 CO 0.00 1.00 0.00 -1.54 -0.00 0.00 0.00 177.39 176.85 1r5k n SER 463 N 0.20 0.00 -4.57 1.45 3.41 -1.26 -4.24 113.62 108.62 1r5k n SER 463 Ca -0.11 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.18 1r5k n SER 463 Cb 0.87 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.78 1r5k n SER 463 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1r5k s SER 464 N 0.00 5.58 0.00 4.04 0.01 -1.26 -4.75 113.70 117.32 1r5k s SER 464 Ca 0.00 -1.38 0.00 0.00 1.31 0.00 0.00 55.95 55.88 1r5k s SER 464 Cb 0.00 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1r5k s SER 464 CO 0.00 -2.42 0.00 1.07 0.41 0.00 0.00 173.24 172.30 1r5k n THR 465 N 7.47 0.00 0.24 1.44 5.66 -1.26 -4.94 114.28 122.90 1r5k n THR 465 Ca 0.42 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.55 1r5k n THR 465 Cb 0.47 0.00 0.44 0.00 -1.55 0.00 0.00 70.33 69.70 1r5k n THR 465 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 1r5k h LEU 466 N 0.00 0.00 0.02 1.09 6.46 -1.99 -3.07 115.31 117.82 1r5k h LEU 466 Ca 0.00 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.50 1r5k h LEU 466 Cb 0.00 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 39.90 1r5k h LEU 466 CO 0.00 0.09 -1.39 0.50 -0.62 0.00 0.00 178.44 177.02 1r5k h LYS 467 N 0.00 0.05 0.00 1.25 3.11 -1.95 -3.15 116.57 115.87 1r5k h LYS 467 Ca -0.00 -0.08 -0.03 0.00 -2.81 0.00 0.00 60.65 57.73 1r5k h LYS 467 Cb 0.76 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.02 1r5k h LYS 467 CO 0.01 0.82 -0.15 1.03 -2.81 0.00 0.00 179.45 178.35 1r5k h SER 468 N 0.01 0.00 -0.32 4.20 0.87 -1.90 -1.89 113.55 114.53 1r5k h SER 468 Ca -0.17 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.35 1r5k h SER 468 Cb 1.91 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.86 1r5k h SER 468 CO 0.11 0.15 0.01 0.25 -0.53 0.00 0.00 176.83 176.83 1r5k h LEU 469 N 0.00 0.55 -0.46 2.23 7.12 -1.57 -2.40 115.31 120.78 1r5k h LEU 469 Ca -0.00 -0.30 -0.17 0.00 0.13 0.00 0.00 57.88 57.54 1r5k h LEU 469 Cb 0.85 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.82 1r5k h LEU 469 CO 0.02 0.71 -0.75 -0.33 -0.13 0.00 0.00 178.44 177.96 1r5k h GLU 470 N 0.37 0.19 0.45 1.25 5.08 -1.47 -0.59 114.58 119.85 1r5k h GLU 470 Ca 0.09 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1r5k h GLU 470 Cb 0.43 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1r5k h GLU 470 CO 0.01 0.85 -0.21 1.49 -1.00 0.00 0.00 179.01 180.15 1r5k h GLU 471 N 0.12 -0.58 -0.65 2.33 4.57 -1.38 -0.65 114.58 118.35 1r5k h GLU 471 Ca -0.02 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.28 1r5k h GLU 471 Cb 1.32 0.13 -0.07 0.00 -0.16 0.00 0.00 28.75 29.97 1r5k h GLU 471 CO 0.11 -0.33 0.30 0.87 -1.18 0.00 0.00 179.01 178.79 1r5k h LYS 472 N -0.72 0.52 -0.88 1.92 1.57 -1.38 -1.46 116.57 116.14 1r5k h LYS 472 Ca -0.06 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1r5k h LYS 472 Cb 0.52 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.67 1r5k h LYS 472 CO 0.10 0.34 0.58 0.22 -0.57 0.00 0.00 179.45 180.12 1r5k h ASP 473 N 0.53 1.01 -0.18 0.86 -0.00 -0.97 -1.53 116.42 116.15 1r5k h ASP 473 Ca 0.32 -0.03 -0.05 0.00 -0.00 0.00 0.00 57.03 57.27 1r5k h ASP 473 Cb 0.34 -0.25 -0.00 0.00 -0.00 0.00 0.00 39.33 39.41 1r5k h ASP 473 CO -0.26 0.74 -0.08 -0.74 -0.00 0.00 0.00 179.24 178.89 1r5k h HIS 474 N 1.20 0.42 -0.90 0.28 2.76 -0.40 -2.14 115.15 116.36 1r5k h HIS 474 Ca 0.32 -0.10 -0.00 0.00 -2.20 0.00 0.00 60.37 58.39 1r5k h HIS 474 Cb -0.13 -0.10 -0.04 0.00 1.55 0.00 0.00 27.41 28.69 1r5k h HIS 474 CO 0.00 0.66 0.55 0.82 -1.30 0.00 0.00 177.93 178.66 1r5k h ILE 475 N 0.05 1.25 -0.03 6.26 2.04 -1.07 -1.99 117.51 124.01 1r5k h ILE 475 Ca 0.04 -0.53 -0.11 0.00 1.00 0.00 0.00 64.86 65.26 1r5k h ILE 475 Cb 0.55 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1r5k h ILE 475 CO 0.02 0.26 -0.49 0.45 0.00 0.00 0.00 178.15 178.39 1r5k h HIS 476 N 1.23 0.08 -0.38 1.37 3.86 -1.20 -0.40 115.15 119.73 1r5k h HIS 476 Ca 0.32 -0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.45 1r5k h HIS 476 Cb -0.06 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 1r5k h HIS 476 CO 0.00 0.55 0.03 0.00 0.86 0.00 0.00 177.93 179.37 1r5k h ARG 477 N 0.06 0.65 -0.49 2.45 3.08 -0.88 -1.29 114.38 117.95 1r5k h ARG 477 Ca -0.00 -0.19 -0.07 0.00 0.07 0.00 0.00 59.98 59.79 1r5k h ARG 477 Cb 0.89 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 1r5k h ARG 477 CO 0.07 0.73 0.03 0.28 -1.07 0.00 0.00 179.97 180.01 1r5k h VAL 478 N 0.48 1.26 -0.63 2.04 2.07 -1.10 -1.84 116.25 118.53 1r5k h VAL 478 Ca 0.11 -1.02 0.08 0.00 0.82 0.00 0.00 66.70 66.70 1r5k h VAL 478 Cb 0.42 0.96 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 1r5k h VAL 478 CO 0.01 0.36 0.29 -0.07 0.02 0.00 0.00 177.57 178.18 1r5k h LEU 479 N 0.70 0.37 -1.07 2.57 3.38 -0.99 -0.06 115.31 120.21 1r5k h LEU 479 Ca 0.14 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.22 1r5k h LEU 479 Cb 0.47 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 1r5k h LEU 479 CO 0.02 0.23 0.63 0.44 0.09 0.00 0.00 178.44 179.84 1r5k h ASP 480 N 0.52 1.01 0.12 -0.43 3.45 -1.01 -1.43 116.42 118.66 1r5k h ASP 480 Ca 0.31 -0.00 -0.07 0.00 0.43 0.00 0.00 57.03 57.70 1r5k h ASP 480 Cb 0.31 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 1r5k h ASP 480 CO -0.25 0.68 -0.23 0.50 -1.57 0.00 0.00 179.24 178.37 1r5k h LYS 481 N 1.17 0.20 0.00 3.56 1.63 -0.21 -0.72 116.57 122.20 1r5k h LYS 481 Ca 0.39 -0.06 -0.17 0.00 -0.85 0.00 0.00 60.65 59.97 1r5k h LYS 481 Cb 0.08 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.66 1r5k h LYS 481 CO -0.13 0.43 -0.79 0.82 -3.45 0.00 0.00 179.45 176.32 1r5k h ILE 482 N 0.19 1.44 -0.03 2.00 2.04 -0.39 -1.61 117.51 121.15 1r5k h ILE 482 Ca 0.03 -2.83 -0.00 0.00 1.00 0.00 0.00 64.86 63.06 1r5k h ILE 482 Cb 0.51 2.58 -0.00 0.00 -0.74 0.00 0.00 36.82 39.17 1r5k h ILE 482 CO 0.03 0.77 0.00 0.74 0.00 0.00 0.00 178.15 179.70 1r5k h THR 483 N 0.00 1.22 -0.82 -0.27 2.02 -0.70 0.30 112.91 114.65 1r5k h THR 483 Ca -0.01 -0.64 0.19 0.00 0.77 0.00 0.00 66.41 66.71 1r5k h THR 483 Cb 1.52 1.59 -0.11 0.00 -1.74 0.00 0.00 68.15 69.41 1r5k h THR 483 CO 0.10 0.17 0.31 0.44 0.37 0.00 0.00 175.52 176.92 1r5k h ASP 484 N -0.21 0.23 -0.61 4.18 3.45 -1.06 -0.49 116.42 121.90 1r5k h ASP 484 Ca 0.01 0.14 -0.08 0.00 0.43 0.00 0.00 57.03 57.53 1r5k h ASP 484 Cb 0.27 0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.16 1r5k h ASP 484 CO 0.00 0.01 0.08 0.74 -1.57 0.00 0.00 179.24 178.50 1r5k h THR 485 N 0.38 1.26 -0.03 0.35 2.02 -0.71 -1.00 112.91 115.17 1r5k h THR 485 Ca 0.49 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.62 1r5k h THR 485 Cb 0.86 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1r5k h THR 485 CO -0.50 0.38 0.02 -0.07 0.37 0.00 0.00 175.52 175.72 1r5k h LEU 486 N 0.94 0.04 -1.06 2.58 3.38 0.58 -1.15 115.31 120.62 1r5k h LEU 486 Ca 0.18 -0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.10 1r5k h LEU 486 Cb 0.46 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 1r5k h LEU 486 CO 0.02 0.16 0.63 0.40 0.09 0.00 0.00 178.44 179.73 1r5k h ILE 487 N -0.08 1.06 -0.11 1.22 1.08 -1.16 -1.92 117.51 117.60 1r5k h ILE 487 Ca 0.01 -0.38 -0.00 0.00 -0.39 0.00 0.00 64.86 64.10 1r5k h ILE 487 Cb 0.13 -0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 33.73 1r5k h ILE 487 CO -0.00 0.20 0.07 -0.74 -0.69 0.00 0.00 178.15 176.99 1r5k h HIS 488 N 1.10 0.15 -0.66 1.37 2.76 -0.66 0.14 115.15 119.35 1r5k h HIS 488 Ca 0.43 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.67 1r5k h HIS 488 Cb 0.22 -0.05 -0.06 0.00 1.55 0.00 0.00 27.41 29.07 1r5k h HIS 488 CO -0.00 0.13 0.33 -0.07 -1.30 0.00 0.00 177.93 177.02 1r5k h LEU 489 N 0.12 0.45 -0.42 0.26 3.38 -0.71 -1.54 115.31 116.85 1r5k h LEU 489 Ca 0.04 0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1r5k h LEU 489 Cb 0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1r5k h LEU 489 CO -0.01 0.28 -0.14 0.24 0.09 0.00 0.00 178.44 178.90 1r5k h MET 490 N 0.59 0.83 -0.84 1.13 2.86 -0.81 -0.60 114.93 118.10 1r5k h MET 490 Ca 0.31 -0.34 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1r5k h MET 490 Cb 0.28 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.86 1r5k h MET 490 CO -0.23 0.97 0.56 0.00 1.06 0.00 0.00 176.91 179.26 1r5k h ALA 491 N 0.84 1.41 -0.25 6.32 0.00 -0.53 -2.25 119.26 124.79 1r5k h ALA 491 Ca 0.10 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1r5k h ALA 491 Cb 0.68 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1r5k h ALA 491 CO 0.05 0.54 -0.46 -0.22 0.00 0.00 0.00 179.25 179.16 1r5k h LYS 492 N 1.13 0.64 0.00 0.00 3.64 -1.00 -2.12 116.57 118.85 1r5k h LYS 492 Ca 0.31 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1r5k h LYS 492 Cb -0.11 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1r5k h LYS 492 CO -0.07 0.97 0.00 0.00 -2.27 0.00 0.00 179.45 178.08 1r5k n ALA 493 N -2.52 1.60 -0.18 5.00 0.00 -0.26 -4.88 120.51 119.27 1r5k n ALA 493 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1r5k n ALA 493 Cb 0.56 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1r5k n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r5k n GLY 494 N -0.15 0.83 3.78 0.00 0.00 -0.80 -5.07 105.19 103.77 1r5k n GLY 494 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1r5k n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r5k s LEU 495 N 0.00 3.72 0.77 0.99 1.43 -0.89 -5.02 118.68 119.68 1r5k s LEU 495 Ca 0.00 2.13 -0.11 0.00 -1.03 0.00 0.00 54.13 55.13 1r5k s LEU 495 Cb 0.00 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.70 1r5k s LEU 495 CO 0.00 -1.22 1.09 0.42 0.23 0.00 0.00 176.35 176.88 1r5k s THR 496 N -1.85 3.30 0.25 5.49 -4.23 -1.26 -4.65 115.64 112.69 1r5k s THR 496 Ca 0.72 0.43 -0.08 0.00 -1.18 0.00 0.00 61.69 61.57 1r5k s THR 496 Cb -0.23 -2.90 0.34 0.00 1.34 0.00 0.00 72.50 71.05 1r5k s THR 496 CO 0.28 -0.54 1.60 0.25 -0.54 0.00 0.00 174.62 175.66 1r5k h LEU 497 N -1.11 -0.61 -0.73 4.79 5.85 -1.99 0.19 115.31 121.71 1r5k h LEU 497 Ca -0.44 0.24 -0.07 0.00 0.84 0.00 0.00 57.88 58.45 1r5k h LEU 497 Cb 1.23 0.46 -0.03 0.00 0.37 0.00 0.00 40.66 42.69 1r5k h LEU 497 CO 0.51 -0.26 0.20 -0.61 -0.34 0.00 0.00 178.44 177.94 1r5k h GLN 498 N 0.03 1.16 -0.41 1.25 4.15 -1.99 -1.24 115.11 118.06 1r5k h GLN 498 Ca 0.43 -0.27 -0.11 0.00 0.77 0.00 0.00 58.65 59.47 1r5k h GLN 498 Cb 0.72 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.24 1r5k h GLN 498 CO -0.81 1.00 -0.18 1.96 -1.93 0.00 0.00 178.83 178.87 1r5k h GLN 499 N 1.10 0.79 0.57 1.69 4.20 -1.58 -0.91 115.11 120.97 1r5k h GLN 499 Ca 0.23 -0.30 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 1r5k h GLN 499 Cb 0.35 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1r5k h GLN 499 CO -0.00 0.92 -0.30 1.96 -0.67 0.00 0.00 178.83 180.74 1r5k h GLN 500 N 0.70 -0.77 -0.55 1.46 4.20 -0.17 -0.15 115.11 119.82 1r5k h GLN 500 Ca 0.10 0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.89 1r5k h GLN 500 Cb 0.69 0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.62 1r5k h GLN 500 CO 0.05 -0.52 0.36 0.45 -0.67 0.00 0.00 178.83 178.51 1r5k h HIS 501 N -0.80 0.62 -0.20 2.96 3.86 -1.16 -0.87 115.15 119.56 1r5k h HIS 501 Ca -0.07 0.02 -0.19 0.00 -1.16 0.00 0.00 60.37 58.96 1r5k h HIS 501 Cb 0.63 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.89 1r5k h HIS 501 CO -0.06 0.37 -0.65 1.96 0.86 0.00 0.00 177.93 180.42 1r5k h GLN 502 N 0.65 0.74 -0.15 2.45 4.20 -0.88 -2.77 115.11 119.35 1r5k h GLN 502 Ca 0.22 -0.53 -0.17 0.00 0.06 0.00 0.00 58.65 58.22 1r5k h GLN 502 Cb 0.06 0.09 0.01 0.00 0.30 0.00 0.00 27.48 27.93 1r5k h GLN 502 CO -0.06 1.15 -0.58 -0.09 -0.67 0.00 0.00 178.83 178.59 1r5k h ARG 503 N 0.54 0.66 -0.48 1.46 2.43 -0.51 -0.17 114.38 118.31 1r5k h ARG 503 Ca -0.01 -0.51 0.09 0.00 -0.81 0.00 0.00 59.98 58.74 1r5k h ARG 503 Cb 1.25 0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 30.79 1r5k h ARG 503 CO 0.13 1.13 -0.27 1.25 -1.51 0.00 0.00 179.97 180.70 1r5k h LEU 504 N 0.34 -0.92 -0.40 3.80 5.85 -1.22 0.12 115.31 122.88 1r5k h LEU 504 Ca -0.03 0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 1r5k h LEU 504 Cb 1.21 0.47 -0.01 0.00 0.37 0.00 0.00 40.66 42.69 1r5k h LEU 504 CO 0.12 -0.28 -0.06 0.00 -0.34 0.00 0.00 178.44 177.88 1r5k h ALA 505 N 1.05 0.54 -0.51 1.25 0.00 -1.25 -1.20 119.26 119.14 1r5k h ALA 505 Ca 0.22 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1r5k h ALA 505 Cb 0.51 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1r5k h ALA 505 CO -0.58 0.38 0.21 1.96 0.00 0.00 0.00 179.25 181.22 1r5k h GLN 506 N 0.56 0.40 -0.23 0.00 4.20 -0.58 -0.36 115.11 119.10 1r5k h GLN 506 Ca 0.10 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.72 1r5k h GLN 506 Cb 0.57 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 1r5k h GLN 506 CO 0.03 0.27 -0.13 -0.07 -0.67 0.00 0.00 178.83 178.26 1r5k h LEU 507 N 0.41 0.51 -1.29 1.46 3.38 -0.59 -2.88 115.31 116.32 1r5k h LEU 507 Ca 0.24 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 1r5k h LEU 507 Cb 0.22 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1r5k h LEU 507 CO -0.21 0.82 -0.27 -0.07 0.09 0.00 0.00 178.44 178.80 1r5k h LEU 508 N 0.21 0.00 -0.90 1.67 3.38 -0.98 -1.95 115.31 116.74 1r5k h LEU 508 Ca 0.05 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1r5k h LEU 508 Cb 0.63 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1r5k h LEU 508 CO 0.04 0.27 -0.54 -0.07 0.09 0.00 0.00 178.44 178.22 1r5k h LEU 509 N 0.00 0.02 -0.96 1.67 3.38 -1.00 -2.85 115.31 115.57 1r5k h LEU 509 Ca -0.00 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1r5k h LEU 509 Cb 0.68 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1r5k h LEU 509 CO 0.03 0.56 -0.18 0.40 0.09 0.00 0.00 178.44 179.35 1r5k h ILE 510 N 0.02 1.25 -0.14 1.22 2.04 -1.14 -1.61 117.51 119.14 1r5k h ILE 510 Ca -0.00 -1.17 0.04 0.00 1.00 0.00 0.00 64.86 64.73 1r5k h ILE 510 Cb 0.96 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 1r5k h ILE 510 CO 0.07 0.38 0.14 -0.07 0.00 0.00 0.00 178.15 178.67 1r5k h LEU 511 N 0.50 0.00 -0.75 1.44 4.07 -1.28 0.13 115.31 119.42 1r5k h LEU 511 Ca 0.08 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.92 1r5k h LEU 511 Cb 0.60 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 1r5k h LEU 511 CO 0.04 0.00 -0.40 -1.28 -1.08 0.00 0.00 178.44 175.72 1r5k h SER 512 N 0.00 0.49 0.77 -0.43 0.87 -1.29 -1.66 113.55 112.30 1r5k h SER 512 Ca 0.07 -0.21 -0.19 0.00 -1.23 0.00 0.00 61.79 60.22 1r5k h SER 512 Cb 0.35 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.16 1r5k h SER 512 CO -0.00 0.84 -0.90 -0.74 -0.53 0.00 0.00 176.83 175.51 1r5k h HIS 513 N 0.39 0.12 -0.31 2.24 -0.00 -0.77 -2.39 115.15 114.43 1r5k h HIS 513 Ca 0.03 -0.07 -0.16 0.00 -0.00 0.00 0.00 60.37 60.18 1r5k h HIS 513 Cb 0.88 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 28.27 1r5k h HIS 513 CO 0.03 0.93 -0.43 0.82 -0.00 0.00 0.00 177.93 179.28 1r5k h ILE 514 N 0.04 1.28 -0.66 6.26 2.04 -1.14 -0.60 117.51 124.73 1r5k h ILE 514 Ca -0.03 -1.61 0.07 0.00 1.00 0.00 0.00 64.86 64.30 1r5k h ILE 514 Cb 1.56 1.50 -0.06 0.00 -0.74 0.00 0.00 36.82 39.08 1r5k h ILE 514 CO 0.13 0.52 0.34 -0.09 0.00 0.00 0.00 178.15 179.05 1r5k h ARG 515 N 0.63 0.59 -0.39 2.37 9.65 -1.28 -1.34 114.38 124.61 1r5k h ARG 515 Ca 0.04 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1r5k h ARG 515 Cb 0.99 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 29.42 1r5k h ARG 515 CO 0.09 0.39 0.25 1.25 2.80 0.00 0.00 179.97 184.75 1r5k h HIS 516 N 0.61 0.50 -0.86 2.20 2.76 -0.86 -1.13 115.15 118.35 1r5k h HIS 516 Ca 0.31 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.46 1r5k h HIS 516 Cb 0.26 -0.17 -0.04 0.00 1.55 0.00 0.00 27.41 29.02 1r5k h HIS 516 CO -0.10 0.33 0.43 0.52 -1.30 0.00 0.00 177.93 177.80 1r5k h MET 517 N 0.52 1.23 -0.44 5.26 2.86 -0.82 -2.04 114.93 121.50 1r5k h MET 517 Ca 0.14 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 1r5k h MET 517 Cb -0.04 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.37 1r5k h MET 517 CO -0.03 0.94 0.12 1.03 1.06 0.00 0.00 176.91 180.03 1r5k h SER 518 N 1.23 0.66 -0.87 1.22 0.87 -0.72 0.12 113.55 116.06 1r5k h SER 518 Ca 0.30 -0.22 0.08 0.00 -1.23 0.00 0.00 61.79 60.72 1r5k h SER 518 Cb 0.10 -0.17 -0.07 0.00 -0.44 0.00 0.00 62.40 61.82 1r5k h SER 518 CO -0.04 0.71 0.53 0.78 -0.53 0.00 0.00 176.83 178.28 1r5k h ASN 519 N 0.58 0.80 -0.09 6.23 2.35 -0.81 0.13 115.58 124.77 1r5k h ASN 519 Ca 0.14 0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 1r5k h ASN 519 Cb 0.29 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1r5k h ASN 519 CO -0.00 0.49 -0.27 0.50 -1.65 0.00 0.00 177.43 176.50 1r5k h LYS 520 N 0.92 0.33 -0.48 0.81 1.63 -1.04 -1.17 116.57 117.58 1r5k h LYS 520 Ca 0.40 -0.24 0.07 0.00 -0.85 0.00 0.00 60.65 60.03 1r5k h LYS 520 Cb 0.27 0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 31.88 1r5k h LYS 520 CO -0.21 0.86 0.12 0.78 -3.45 0.00 0.00 179.45 177.56 1r5k h GLY 521 N -0.13 0.59 1.17 5.01 0.00 -0.78 -0.67 103.07 108.26 1r5k h GLY 521 Ca -0.01 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.30 1r5k h GLY 521 CO 0.06 -0.04 0.52 1.98 0.00 0.00 0.00 176.54 179.06 1r5k h MET 522 N 0.27 0.99 -0.02 4.80 -1.53 -0.65 0.70 114.93 119.47 1r5k h MET 522 Ca 0.23 -0.06 -0.21 0.00 -3.44 0.00 0.00 59.70 56.23 1r5k h MET 522 Cb 0.29 -0.22 -0.00 0.00 -0.55 0.00 0.00 31.60 31.11 1r5k h MET 522 CO -0.28 0.65 -0.87 1.49 0.14 0.00 0.00 176.91 178.04 1r5k h GLU 523 N 1.02 0.37 -0.12 0.39 4.81 -0.51 -0.44 114.58 120.10 1r5k h GLU 523 Ca 0.30 -0.37 -0.06 0.00 -0.13 0.00 0.00 59.36 59.10 1r5k h GLU 523 Cb -0.04 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.44 1r5k h GLU 523 CO -0.08 1.04 -0.15 1.25 -0.73 0.00 0.00 179.01 180.34 1r5k h HIS 524 N 0.22 0.39 -0.60 0.92 2.76 -0.71 -2.47 115.15 115.67 1r5k h HIS 524 Ca -0.06 -0.13 0.12 0.00 -2.20 0.00 0.00 60.37 58.10 1r5k h HIS 524 Cb 1.48 -0.08 -0.09 0.00 1.55 0.00 0.00 27.41 30.27 1r5k h HIS 524 CO 0.05 0.75 0.07 -0.07 -1.30 0.00 0.00 177.93 177.43 1r5k h LEU 525 N -0.09 -0.12 -1.48 0.26 4.07 -0.80 -2.12 115.31 115.03 1r5k h LEU 525 Ca 0.01 0.13 -0.04 0.00 0.08 0.00 0.00 57.88 58.06 1r5k h LEU 525 Cb 0.70 0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.64 1r5k h LEU 525 CO 0.04 -0.05 -0.19 0.22 -1.08 0.00 0.00 178.44 177.37 1r5k h TYR 526 N 0.19 0.00 0.00 1.13 5.03 -0.91 -2.97 116.97 119.44 1r5k h TYR 526 Ca 0.31 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.62 1r5k h TYR 526 Cb 0.49 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.77 1r5k h TYR 526 CO -0.30 0.19 -1.01 -1.13 -1.32 0.00 0.00 178.16 174.60 1r5k n SER 527 N -3.53 0.62 0.08 -2.11 3.41 -0.85 -3.97 113.62 107.27 1r5k n SER 527 Ca -0.01 -0.21 0.02 0.00 -0.26 0.00 0.00 58.87 58.41 1r5k n SER 527 Cb 0.35 0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 65.03 1r5k n SER 527 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1r5k h MET 528 N 0.00 0.00 -6.67 4.33 2.86 -1.26 -3.48 114.93 110.72 1r5k h MET 528 Ca 0.00 0.00 -0.50 0.00 -2.06 0.00 0.00 59.70 57.14 1r5k h MET 528 Cb 0.72 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.36 1r5k h MET 528 CO 0.00 0.35 0.06 -1.59 1.06 0.00 0.00 176.91 176.79 1r5k s LYS 529 N -2.97 3.98 0.36 1.72 -2.85 -1.17 -5.02 119.74 113.78 1r5k s LYS 529 Ca -0.00 0.61 -0.27 0.00 -1.00 0.00 0.00 55.97 55.31 1r5k s LYS 529 Cb 0.08 -2.49 -0.12 0.00 -2.06 0.00 0.00 37.83 33.25 1r5k s LYS 529 CO 0.78 0.19 1.19 0.00 0.10 0.00 0.00 175.35 177.62 1r5k n LYS 531 N 0.45 0.26 -0.09 0.00 4.81 -1.26 -2.96 118.16 119.37 1r5k n LYS 531 Ca 0.07 0.09 0.01 0.00 -0.87 0.00 0.00 58.31 57.61 1r5k n LYS 531 Cb 0.36 -1.68 0.05 0.00 0.02 0.00 0.00 35.03 33.77 1r5k n LYS 531 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1r5k n ASN 532 N -2.07 1.39 -4.10 3.14 4.13 -1.26 -4.87 115.26 111.61 1r5k n ASN 532 Ca 0.04 -2.09 -0.29 0.00 1.68 0.00 0.00 54.58 53.92 1r5k n ASN 532 Cb 0.43 -0.46 -0.17 0.00 -1.54 0.00 0.00 39.78 38.05 1r5k n ASN 532 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1r5k s VAL 533 N -1.30 1.59 -0.38 2.41 1.01 -1.16 -5.10 120.40 117.48 1r5k s VAL 533 Ca 0.06 -0.73 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 1r5k s VAL 533 Cb 0.04 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 35.01 1r5k s VAL 533 CO 0.02 0.46 0.63 -0.69 0.00 0.00 0.00 175.10 175.52 1r5k s VAL 534 N 0.68 4.88 0.80 2.92 1.01 -1.26 -4.94 120.40 124.49 1r5k s VAL 534 Ca -0.13 0.43 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 1r5k s VAL 534 Cb -0.16 -4.11 0.07 0.00 0.00 0.00 0.00 36.38 32.19 1r5k s VAL 534 CO 0.03 -0.39 1.09 -2.16 0.00 0.00 0.00 175.10 173.67 1r5k s PRO 535 N 2.73 2.01 0.41 2.72 0.04 -1.26 -4.80 135.00 136.84 1r5k s PRO 535 Ca 0.24 0.99 0.09 0.00 0.04 0.00 0.00 61.00 62.35 1r5k s PRO 535 Cb -0.14 -1.88 0.86 0.00 0.04 0.00 0.00 34.50 33.37 1r5k s PRO 535 CO 0.16 -1.76 2.00 1.25 0.04 0.00 0.00 177.00 178.69 1r5k h LEU 536 N -1.21 0.33 -0.01 -3.56 6.46 -2.00 -2.29 115.31 113.03 1r5k h LEU 536 Ca -0.46 -0.03 0.01 0.00 -0.12 0.00 0.00 57.88 57.28 1r5k h LEU 536 Cb 1.25 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 41.08 1r5k h LEU 536 CO 0.54 0.34 -0.04 0.10 -0.62 0.00 0.00 178.44 178.75 1r5k h TYR 537 N 0.37 -0.11 -0.49 1.25 -0.00 -1.98 -2.03 116.97 113.97 1r5k h TYR 537 Ca 0.09 0.00 0.10 0.00 0.00 0.00 0.00 58.73 58.92 1r5k h TYR 537 Cb 0.13 0.05 -0.09 0.00 0.00 0.00 0.00 36.73 36.82 1r5k h TYR 537 CO 0.00 -0.07 -0.12 -0.44 -0.00 0.00 0.00 178.16 177.53 1r5k h ASP 538 N -0.07 -0.46 -0.51 0.10 3.32 -1.78 -2.18 116.42 114.84 1r5k h ASP 538 Ca 0.02 0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 1r5k h ASP 538 Cb 0.10 0.31 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 1r5k h ASP 538 CO -0.06 -0.16 0.16 -0.07 -1.72 0.00 0.00 179.24 177.39 1r5k h LEU 539 N 0.00 0.79 -0.26 1.55 3.38 -1.25 0.27 115.31 119.79 1r5k h LEU 539 Ca 0.24 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 1r5k h LEU 539 Cb 0.36 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1r5k h LEU 539 CO -0.51 0.75 -0.37 0.25 0.09 0.00 0.00 178.44 178.65 1r5k h LEU 540 N 0.82 0.77 -0.40 1.67 5.85 -0.81 0.14 115.31 123.36 1r5k h LEU 540 Ca 0.19 -0.51 -0.17 0.00 0.84 0.00 0.00 57.88 58.22 1r5k h LEU 540 Cb 0.26 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 1r5k h LEU 540 CO -0.01 1.13 -0.50 -0.07 -0.34 0.00 0.00 178.44 178.65 1r5k h LEU 541 N 0.44 0.88 0.00 2.25 3.38 -1.05 -3.15 115.31 118.05 1r5k h LEU 541 Ca 0.03 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1r5k h LEU 541 Cb 0.96 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1r5k h LEU 541 CO 0.09 1.22 0.00 1.21 0.09 0.00 0.00 178.44 181.05 1r5k n GLU 542 N -4.01 0.00 -0.26 1.13 4.07 0.93 -1.91 120.64 120.59 1r5k n GLU 542 Ca -0.03 0.34 -0.09 0.00 -0.06 0.00 0.00 57.16 57.31 1r5k n GLU 542 Cb 0.60 -0.85 -0.02 0.00 -0.06 0.00 0.00 31.44 31.11 1r5k n GLU 542 CO 0.00 0.00 0.00 -0.12 -0.06 0.00 0.00 177.13 176.95 1r5k n MET 543 N -0.68 0.00 0.00 5.31 0.00 0.46 -5.08 117.12 117.13 1r5k n MET 543 Ca 0.00 -0.48 0.00 0.00 -0.00 0.00 0.00 57.70 57.22 1r5k n MET 543 Cb 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 33.22 31.36 1r5k n MET 543 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86