#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 1.98 0.00 1.47 0.00 -1.98 -2.08 119.26 118.65 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 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1r5k h ALA 307 CO 0.00 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.55 1r5k n LEU 308 N -4.53 0.70 -0.36 0.00 4.32 -1.26 -3.01 117.00 112.87 1r5k n LEU 308 Ca -0.02 0.62 0.08 0.00 -0.02 0.00 0.00 56.01 56.67 1r5k n LEU 308 Cb 0.10 -0.45 -0.01 0.00 -1.62 0.00 0.00 43.42 41.44 1r5k n LEU 308 CO 0.34 -0.36 0.25 -1.54 -1.22 0.00 0.00 177.39 174.86 1r5k n SER 309 N -2.21 1.62 -4.64 -1.43 3.41 -0.79 -4.98 113.62 104.60 1r5k n SER 309 Ca 0.04 -1.31 -0.40 0.00 -0.26 0.00 0.00 58.87 56.94 1r5k n SER 309 Cb 0.32 0.50 0.03 0.00 -0.26 0.00 0.00 64.21 64.80 1r5k n SER 309 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1r5k n LEU 310 N -0.19 3.46 -4.94 1.04 4.77 -1.16 -5.01 117.00 114.97 1r5k n LEU 310 Ca 0.07 0.98 -0.25 0.00 -0.03 0.00 0.00 56.01 56.78 1r5k n LEU 310 Cb 0.35 -1.42 0.07 0.00 -2.33 0.00 0.00 43.42 40.09 1r5k n LEU 310 CO 0.22 -1.32 0.58 0.42 -1.33 0.00 0.00 177.39 175.96 1r5k s THR 311 N -1.33 2.32 0.34 -5.08 -4.23 -1.26 -4.85 115.64 101.55 1r5k s THR 311 Ca 0.67 -0.35 0.07 0.00 -1.18 0.00 0.00 61.69 60.90 1r5k s THR 311 Cb -0.49 -2.98 0.31 0.00 1.34 0.00 0.00 72.50 70.68 1r5k s THR 311 CO 0.54 0.00 1.88 0.00 -0.54 0.00 0.00 174.62 176.49 1r5k h ALA 312 N -0.51 1.74 0.01 3.99 0.00 -1.94 0.17 119.26 122.71 1r5k h ALA 312 Ca -0.44 0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.22 1r5k h ALA 312 Cb 1.31 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.96 1r5k h ALA 312 CO 0.57 0.04 -1.06 -0.44 0.00 0.00 0.00 179.25 178.37 1r5k h ASP 313 N 0.78 0.90 0.01 0.00 3.45 -1.96 -2.01 116.42 117.59 1r5k h ASP 313 Ca 0.44 -0.73 -0.02 0.00 0.43 0.00 0.00 57.03 57.15 1r5k h ASP 313 Cb 0.59 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.08 1r5k h ASP 313 CO -0.20 1.53 -0.05 1.56 -1.57 0.00 0.00 179.24 180.51 1r5k h GLN 314 N 0.38 0.12 0.16 3.56 4.20 -1.82 -1.85 115.11 119.87 1r5k h GLN 314 Ca -0.13 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.55 1r5k h GLN 314 Cb 1.71 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.47 1r5k h GLN 314 CO 0.21 0.18 -0.08 1.98 -0.67 0.00 0.00 178.83 180.45 1r5k h MET 315 N 0.12 -0.21 -0.69 1.46 4.05 -0.46 -2.13 114.93 117.06 1r5k h MET 315 Ca 0.03 0.01 0.14 0.00 -0.28 0.00 0.00 59.70 59.60 1r5k h MET 315 Cb 0.17 0.05 -0.10 0.00 -0.80 0.00 0.00 31.60 30.92 1r5k h MET 315 CO 0.01 0.22 0.20 0.28 0.23 0.00 0.00 176.91 177.85 1r5k h VAL 316 N -0.85 0.61 0.02 -5.77 2.07 -1.29 -1.79 116.25 109.24 1r5k h VAL 316 Ca -0.02 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.41 1r5k h VAL 316 Cb 0.53 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 1r5k h VAL 316 CO 0.04 0.06 -0.14 0.28 0.02 0.00 0.00 177.57 177.82 1r5k h SER 317 N 0.32 -0.41 -0.96 0.57 0.02 -1.31 -0.42 113.55 111.36 1r5k h SER 317 Ca 0.38 0.06 0.06 0.00 -0.84 0.00 0.00 61.79 61.44 1r5k h SER 317 Cb 0.59 0.17 -0.06 0.00 0.14 0.00 0.00 62.40 63.24 1r5k h SER 317 CO -0.44 -0.20 0.62 0.00 -1.14 0.00 0.00 176.83 175.67 1r5k h ALA 318 N 0.68 1.32 -0.19 3.77 0.00 -0.65 -0.51 119.26 123.67 1r5k h ALA 318 Ca 0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1r5k h ALA 318 Cb 0.30 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1r5k h ALA 318 CO -0.13 0.42 -0.05 -0.07 0.00 0.00 0.00 179.25 179.43 1r5k h LEU 319 N 1.14 0.38 -1.37 0.00 3.38 -0.92 -2.11 115.31 115.82 1r5k h LEU 319 Ca 0.41 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1r5k h LEU 319 Cb 0.12 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1r5k h LEU 319 CO -0.16 0.66 0.32 -0.07 0.09 0.00 0.00 178.44 179.28 1r5k h LEU 320 N 0.09 0.66 -1.37 1.67 3.38 -0.53 -1.63 115.31 117.59 1r5k h LEU 320 Ca 0.05 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1r5k h LEU 320 Cb 0.50 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1r5k h LEU 320 CO 0.02 0.52 -0.32 0.44 0.09 0.00 0.00 178.44 179.19 1r5k h ASP 321 N 0.76 0.00 0.64 -0.43 5.19 -0.96 -3.11 116.42 118.51 1r5k h ASP 321 Ca 0.20 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 1r5k h ASP 321 Cb -0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.50 1r5k h ASP 321 CO -0.04 0.32 -0.47 0.00 -3.12 0.00 0.00 179.24 175.93 1r5k n ALA 322 N -2.45 3.26 -1.67 3.45 0.00 -0.62 -4.91 120.51 117.57 1r5k n ALA 322 Ca -0.02 -0.30 -0.45 0.00 0.00 0.00 0.00 53.44 52.67 1r5k n ALA 322 Cb 0.37 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 1r5k n ALA 322 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1r5k n GLU 323 N -1.64 2.00 -1.96 0.00 -0.58 -1.15 -4.71 120.64 112.60 1r5k n GLU 323 Ca 0.05 0.71 -0.29 0.00 -0.42 0.00 0.00 57.16 57.22 1r5k n GLU 323 Cb 0.36 -2.36 0.07 0.00 -0.57 0.00 0.00 31.44 28.94 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 -0.42 2.36 1.21 3.49 0.04 -1.26 -5.02 135.00 135.40 1r5k s PRO 324 Ca 0.68 0.19 -0.16 0.00 0.04 0.00 0.00 61.00 61.75 1r5k s PRO 324 Cb -0.66 -2.02 0.29 0.00 0.04 0.00 0.00 34.50 32.16 1r5k s PRO 324 CO 0.50 -1.31 1.02 -1.25 0.04 0.00 0.00 177.00 176.01 1r5k s PRO 325 N -5.43 -1.29 -0.18 0.56 0.04 -1.26 -4.98 135.00 122.46 1r5k s PRO 325 Ca 0.60 0.48 -0.11 0.00 0.04 0.00 0.00 61.00 62.00 1r5k s PRO 325 Cb -0.11 -1.54 -0.05 0.00 0.04 0.00 0.00 34.50 32.84 1r5k s PRO 325 CO 0.49 -3.87 0.19 0.42 0.04 0.00 0.00 177.00 174.27 1r5k s ILE 326 N -2.57 5.37 0.14 0.56 1.01 -1.26 -5.08 121.20 119.38 1r5k s ILE 326 Ca 0.68 0.32 -0.10 0.00 0.00 0.00 0.00 60.65 61.56 1r5k s ILE 326 Cb -0.19 -3.53 -0.06 0.00 0.01 0.00 0.00 42.46 38.68 1r5k s ILE 326 CO 0.61 0.43 0.47 -0.76 0.00 0.00 0.00 174.94 175.68 1r5k s LEU 327 N 0.36 4.28 0.09 2.97 1.43 -1.26 -5.07 118.68 121.49 1r5k s LEU 327 Ca 0.11 0.86 -0.05 0.00 -1.03 0.00 0.00 54.13 54.02 1r5k s LEU 327 Cb -0.12 -3.29 -0.05 0.00 0.03 0.00 0.00 46.19 42.76 1r5k s LEU 327 CO 0.00 0.07 0.33 -0.31 0.23 0.00 0.00 176.35 176.67 1r5k s TYR 328 N -1.57 3.52 0.48 0.29 2.02 -1.26 -4.43 117.35 116.41 1r5k s TYR 328 Ca 0.39 0.55 -0.24 0.00 -0.37 0.00 0.00 57.07 57.40 1r5k s TYR 328 Cb -0.13 -1.99 -0.07 0.00 -0.40 0.00 0.00 41.96 39.37 1r5k s TYR 328 CO 0.20 0.51 1.35 0.45 -1.57 0.00 0.00 175.55 176.50 1r5k s SER 329 N -2.18 5.74 0.35 2.29 0.15 -1.26 -4.92 113.70 113.87 1r5k s SER 329 Ca 0.36 2.76 0.19 0.00 0.70 0.00 0.00 55.95 59.95 1r5k s SER 329 Cb -0.13 -2.64 0.39 0.00 -1.71 0.00 0.00 66.02 61.93 1r5k s SER 329 CO 0.22 -1.25 1.59 -0.08 1.20 0.00 0.00 173.24 174.92 1r5k h GLU 330 N 2.02 0.00 -4.52 5.44 4.81 -1.98 -3.47 114.58 116.88 1r5k h GLU 330 Ca -0.51 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.51 1r5k h GLU 330 Cb 1.27 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.51 1r5k h GLU 330 CO 0.60 0.36 -0.65 0.71 -0.73 0.00 0.00 179.01 179.30 1r5k s TYR 331 N -3.24 0.96 -0.20 0.92 4.12 -1.26 -5.22 117.35 113.44 1r5k s TYR 331 Ca 0.03 -1.20 -0.18 0.00 0.02 0.00 0.00 57.07 55.74 1r5k s TYR 331 Cb 0.08 -0.54 0.05 0.00 -1.52 0.00 0.00 41.96 40.04 1r5k s TYR 331 CO 0.70 -0.46 0.53 -0.51 0.02 0.00 0.00 175.55 175.84 1r5k s ASP 332 N -3.09 -0.56 0.00 2.29 -0.00 -1.26 -4.99 116.67 109.07 1r5k s ASP 332 Ca 0.25 1.07 0.00 0.00 -0.00 0.00 0.00 52.55 53.87 1r5k s ASP 332 Cb 0.07 1.08 0.00 0.00 -0.00 0.00 0.00 42.92 44.08 1r5k s ASP 332 CO 0.03 -0.18 0.00 0.49 -0.00 0.00 0.00 175.17 175.50 1r5k n PHE 337 N 2.81 0.00 0.00 4.23 3.01 -1.26 -5.24 117.46 121.01 1r5k n PHE 337 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.32 1r5k n PHE 337 Cb 0.56 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.03 1r5k n PHE 337 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1r5k n SER 338 N 0.00 0.00 -0.02 4.37 2.88 -1.26 -5.02 113.62 114.57 1r5k n SER 338 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 1r5k n SER 338 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 1r5k n SER 338 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1r5k h GLU 339 N 0.00 0.36 0.00 -1.46 4.81 -1.98 -2.80 114.58 113.50 1r5k h GLU 339 Ca 0.00 -0.31 -0.16 0.00 -0.13 0.00 0.00 59.36 58.76 1r5k h GLU 339 Cb 0.00 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1r5k h GLU 339 CO 0.00 0.97 -0.76 0.00 -0.73 0.00 0.00 179.01 178.49 1r5k h ALA 340 N 0.39 0.57 -0.14 2.92 0.00 -1.97 -2.81 119.26 118.22 1r5k h ALA 340 Ca -0.03 -0.69 -0.21 0.00 0.00 0.00 0.00 54.91 53.98 1r5k h ALA 340 Cb 1.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1r5k h ALA 340 CO 0.08 0.94 -0.74 0.66 0.00 0.00 0.00 179.25 180.19 1r5k h SER 341 N 0.00 0.78 0.02 0.00 4.64 -1.96 -1.14 113.55 115.89 1r5k h SER 341 Ca -0.01 -0.50 -0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1r5k h SER 341 Cb 1.50 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1r5k h SER 341 CO 0.10 1.27 -0.01 -0.03 -0.87 0.00 0.00 176.83 177.29 1r5k h MET 342 N 0.45 -0.03 0.00 4.77 -1.53 -1.54 -2.63 114.93 114.42 1r5k h MET 342 Ca -0.04 0.00 -0.03 0.00 -3.44 0.00 0.00 59.70 56.19 1r5k h MET 342 Cb 1.35 0.01 -0.00 0.00 -0.55 0.00 0.00 31.60 32.40 1r5k h MET 342 CO 0.14 0.18 -0.17 0.52 0.14 0.00 0.00 176.91 177.73 1r5k h MET 343 N -0.23 0.00 0.28 0.39 2.86 -1.47 -2.19 114.93 114.56 1r5k h MET 343 Ca -0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1r5k h MET 343 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1r5k h MET 343 CO 0.00 0.17 -0.13 0.78 1.06 0.00 0.00 176.91 178.79 1r5k h GLY 344 N 0.66 -0.39 0.07 8.32 0.00 -1.07 0.80 103.07 111.46 1r5k h GLY 344 Ca -0.00 0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.48 1r5k h GLY 344 CO 0.02 -0.14 -0.42 1.41 0.00 0.00 0.00 176.54 177.41 1r5k h LEU 345 N -0.54 -1.27 -0.99 3.11 3.38 -1.10 -2.34 115.31 115.57 1r5k h LEU 345 Ca -0.04 0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1r5k h LEU 345 Cb 0.40 0.47 -0.05 0.00 0.09 0.00 0.00 40.66 41.57 1r5k h LEU 345 CO 0.06 -0.43 0.65 -0.07 0.09 0.00 0.00 178.44 178.74 1r5k h LEU 346 N -0.58 1.12 -0.33 1.67 3.38 -1.37 -0.36 115.31 118.84 1r5k h LEU 346 Ca -0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1r5k h LEU 346 Cb 0.59 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1r5k h LEU 346 CO -0.24 0.80 0.10 0.74 0.09 0.00 0.00 178.44 179.93 1r5k h THR 347 N 1.32 1.21 -0.42 0.22 2.02 -0.66 0.12 112.91 116.72 1r5k h THR 347 Ca 0.37 -0.69 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 1r5k h THR 347 Cb -0.12 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1r5k h THR 347 CO -0.09 0.23 0.12 -1.13 0.37 0.00 0.00 175.52 175.02 1r5k h ASN 348 N 0.38 0.62 -0.59 4.18 -1.24 -1.01 -0.82 115.58 117.11 1r5k h ASN 348 Ca 0.11 -0.22 0.06 0.00 0.71 0.00 0.00 56.30 56.96 1r5k h ASN 348 Cb 0.26 -0.16 -0.05 0.00 0.73 0.00 0.00 38.32 39.10 1r5k h ASN 348 CO -0.00 0.67 0.30 0.25 -1.29 0.00 0.00 177.43 177.36 1r5k h LEU 349 N 0.54 0.43 -0.73 0.34 5.85 -0.81 -0.80 115.31 120.13 1r5k h LEU 349 Ca 0.13 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.78 1r5k h LEU 349 Cb 0.29 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1r5k h LEU 349 CO -0.00 0.28 -0.19 0.00 -0.34 0.00 0.00 178.44 178.19 1r5k h ALA 350 N 1.32 0.91 -0.36 1.25 0.00 -0.58 0.23 119.26 122.04 1r5k h ALA 350 Ca 0.27 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1r5k h ALA 350 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1r5k h ALA 350 CO -0.19 0.62 -0.35 -0.44 0.00 0.00 0.00 179.25 178.89 1r5k h ASP 351 N 0.69 0.86 0.13 0.00 3.45 -0.68 0.13 116.42 120.99 1r5k h ASP 351 Ca 0.10 -0.37 -0.14 0.00 0.43 0.00 0.00 57.03 57.05 1r5k h ASP 351 Cb 0.69 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 1r5k h ASP 351 CO 0.05 1.13 -0.51 0.03 -1.57 0.00 0.00 179.24 178.37 1r5k h ARG 352 N 0.68 0.43 -0.32 3.56 3.08 -0.95 -2.30 114.38 118.56 1r5k h ARG 352 Ca 0.07 -0.25 -0.13 0.00 0.07 0.00 0.00 59.98 59.73 1r5k h ARG 352 Cb 0.91 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1r5k h ARG 352 CO 0.08 0.84 -0.33 0.93 -1.07 0.00 0.00 179.97 180.42 1r5k h GLU 353 N 0.34 0.69 -0.86 0.04 5.08 -0.45 -2.81 114.58 116.61 1r5k h GLU 353 Ca 0.01 -0.32 0.05 0.00 -1.00 0.00 0.00 59.36 58.09 1r5k h GLU 353 Cb 1.01 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.20 1r5k h GLU 353 CO 0.09 0.93 0.54 1.25 -1.00 0.00 0.00 179.01 180.82 1r5k h LEU 354 N 0.59 0.88 -0.28 1.33 5.85 -0.54 0.21 115.31 123.34 1r5k h LEU 354 Ca 0.06 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1r5k h LEU 354 Cb 0.85 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1r5k h LEU 354 CO 0.07 0.59 0.12 0.58 -0.34 0.00 0.00 178.44 179.46 1r5k h VAL 355 N 1.03 1.17 -0.57 1.05 2.07 -1.18 -1.88 116.25 117.94 1r5k h VAL 355 Ca 0.36 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.32 1r5k h VAL 355 Cb 0.08 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1r5k h VAL 355 CO -0.14 0.17 0.17 0.45 0.02 0.00 0.00 177.57 178.24 1r5k h HIS 356 N 0.31 0.87 -0.47 1.57 3.86 -1.24 -1.96 115.15 118.09 1r5k h HIS 356 Ca 0.10 -0.07 0.14 0.00 -1.16 0.00 0.00 60.37 59.37 1r5k h HIS 356 Cb 0.16 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.35 1r5k h HIS 356 CO -0.01 0.71 0.37 1.98 0.86 0.00 0.00 177.93 181.84 1r5k h MET 357 N 0.83 0.00 -0.08 2.45 -1.53 0.19 -1.93 114.93 114.86 1r5k h MET 357 Ca 0.19 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.43 1r5k h MET 357 Cb 0.25 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.30 1r5k h MET 357 CO -0.01 0.00 -0.02 0.82 0.14 0.00 0.00 176.91 177.84 1r5k h ILE 358 N 0.00 1.30 0.00 1.77 2.04 -0.86 -0.47 117.51 121.28 1r5k h ILE 358 Ca 0.23 -0.96 -0.07 0.00 1.00 0.00 0.00 64.86 65.05 1r5k h ILE 358 Cb 0.96 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 1r5k h ILE 358 CO -0.00 0.27 -0.35 0.78 0.00 0.00 0.00 178.15 178.85 1r5k h ASN 359 N -0.18 0.00 -0.06 1.72 -0.26 -1.56 -2.75 115.58 112.50 1r5k h ASN 359 Ca 0.02 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.75 1r5k h ASN 359 Cb 0.43 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.69 1r5k h ASN 359 CO 0.01 0.35 -0.00 -0.25 -1.06 0.00 0.00 177.43 176.48 1r5k h TRP 360 N 0.00 0.11 -0.54 1.19 7.01 -1.19 -3.12 115.95 119.40 1r5k h TRP 360 Ca -0.00 -0.02 0.01 0.00 2.11 0.00 0.00 58.89 60.99 1r5k h TRP 360 Cb 0.81 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.81 1r5k h TRP 360 CO 0.00 0.38 0.36 0.00 -2.79 0.00 0.00 178.44 176.39 1r5k h ALA 361 N 0.71 1.62 0.00 2.65 0.00 -0.83 0.29 119.26 123.71 1r5k h ALA 361 Ca 0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1r5k h ALA 361 Cb 0.34 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1r5k h ALA 361 CO 0.00 0.35 -0.03 0.87 0.00 0.00 0.00 179.25 180.45 1r5k h LYS 362 N 0.73 0.00 0.00 0.00 1.57 -1.44 -2.34 116.57 115.09 1r5k h LYS 362 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1r5k h LYS 362 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1r5k h LYS 362 CO -0.04 0.03 -0.81 0.54 -0.57 0.00 0.00 179.45 178.59 1r5k n ARG 363 N -3.28 0.25 -1.86 3.15 1.74 0.08 -4.51 116.66 112.22 1r5k n ARG 363 Ca -0.02 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.67 1r5k n ARG 363 Cb 0.16 -1.61 -0.03 0.00 -1.02 0.00 0.00 32.46 29.95 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 -3.16 3.05 0.01 1.55 1.01 -0.88 -4.87 120.40 117.11 1r5k s VAL 364 Ca 0.06 0.37 -0.33 0.00 0.00 0.00 0.00 61.98 62.07 1r5k s VAL 364 Cb 0.14 -3.24 -0.12 0.00 0.00 0.00 0.00 36.38 33.17 1r5k s VAL 364 CO 0.76 -0.01 1.82 -2.65 0.00 0.00 0.00 175.10 175.02 1r5k n PRO 365 N 6.24 2.34 0.00 2.72 -0.02 -1.26 -2.01 135.00 143.01 1r5k n PRO 365 Ca 0.17 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 1r5k n PRO 365 Cb 0.41 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.18 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 4.18 3.18 0.25 -1.23 0.00 -1.26 -4.95 105.19 105.36 1r5k n GLY 366 Ca 0.20 -0.94 0.03 0.00 0.00 0.00 0.00 46.02 45.31 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 0.35 0.00 1.61 3.57 -1.68 -0.28 116.94 120.51 1r5k h PHE 367 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1r5k h PHE 367 Cb 0.00 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1r5k h PHE 367 CO 0.00 0.02 0.00 0.28 -2.23 0.00 0.00 178.31 176.38 1r5k n VAL 368 N -5.06 0.83 0.33 1.41 0.31 -1.26 -2.23 118.33 112.65 1r5k n VAL 368 Ca 0.11 0.22 0.13 0.00 -0.01 0.00 0.00 64.34 64.79 1r5k n VAL 368 Cb 0.36 -1.14 0.34 0.00 -0.91 0.00 0.00 33.84 32.49 1r5k n VAL 368 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1r5k h ASP 369 N 0.00 0.00 -4.16 4.52 3.45 -1.43 -3.45 116.42 115.35 1r5k h ASP 369 Ca 0.00 0.00 -0.48 0.00 0.43 0.00 0.00 57.03 56.98 1r5k h ASP 369 Cb 0.37 0.00 0.04 0.00 -0.56 0.00 0.00 39.33 39.18 1r5k h ASP 369 CO 0.00 0.00 0.38 -0.76 -1.57 0.00 0.00 179.24 177.29 1r5k s LEU 370 N -5.72 3.62 0.87 1.55 1.02 -0.95 -5.03 118.68 114.06 1r5k s LEU 370 Ca 0.06 1.81 -0.12 0.00 0.02 0.00 0.00 54.13 55.90 1r5k s LEU 370 Cb 0.08 -4.54 0.10 0.00 0.02 0.00 0.00 46.19 41.84 1r5k s LEU 370 CO 0.61 -0.95 1.01 0.35 0.02 0.00 0.00 176.35 177.39 1r5k n THR 371 N -1.63 0.88 0.02 5.49 -2.24 -1.26 -4.76 114.28 110.77 1r5k n THR 371 Ca 0.09 -0.13 -0.12 0.00 -2.27 0.00 0.00 64.05 61.62 1r5k n THR 371 Cb 0.53 -1.00 -0.07 0.00 -2.10 0.00 0.00 70.33 67.69 1r5k n THR 371 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1r5k h LEU 372 N -1.38 0.05 -1.44 3.22 5.85 -1.95 -1.38 115.31 118.28 1r5k h LEU 372 Ca -0.44 -0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.32 1r5k h LEU 372 Cb 1.29 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.25 1r5k h LEU 372 CO 0.42 0.11 0.51 -0.74 -0.34 0.00 0.00 178.44 178.39 1r5k h HIS 373 N -0.01 0.66 -0.11 1.25 2.76 -1.95 0.66 115.15 118.41 1r5k h HIS 373 Ca 0.01 0.02 -0.17 0.00 -2.20 0.00 0.00 60.37 58.03 1r5k h HIS 373 Cb 0.07 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 1r5k h HIS 373 CO -0.05 0.28 -0.65 -0.44 -1.30 0.00 0.00 177.93 175.77 1r5k h ASP 374 N 0.59 0.49 -0.02 3.26 3.45 -1.72 -2.08 116.42 120.40 1r5k h ASP 374 Ca 0.37 -0.30 -0.00 0.00 0.43 0.00 0.00 57.03 57.53 1r5k h ASP 374 Cb 0.62 -0.14 -0.00 0.00 -0.56 0.00 0.00 39.33 39.24 1r5k h ASP 374 CO -0.14 1.01 0.01 1.56 -1.57 0.00 0.00 179.24 180.12 1r5k h GLN 375 N 0.31 0.03 -1.00 3.56 4.20 0.12 -1.76 115.11 120.57 1r5k h GLN 375 Ca -0.01 -0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.70 1r5k h GLN 375 Cb 1.20 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.93 1r5k h GLN 375 CO 0.11 0.11 0.66 0.28 -0.67 0.00 0.00 178.83 179.32 1r5k h VAL 376 N -0.06 1.26 -0.15 -0.54 2.07 -1.11 -2.16 116.25 115.56 1r5k h VAL 376 Ca 0.01 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1r5k h VAL 376 Cb 0.09 -0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 29.64 1r5k h VAL 376 CO -0.00 0.25 0.10 -0.74 0.02 0.00 0.00 177.57 177.20 1r5k h HIS 377 N 1.36 0.18 -0.59 1.57 -0.00 -1.16 -0.52 115.15 116.00 1r5k h HIS 377 Ca 0.37 0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.83 1r5k h HIS 377 Cb -0.15 -0.06 -0.07 0.00 -0.00 0.00 0.00 27.41 27.13 1r5k h HIS 377 CO 0.00 0.12 0.21 -0.07 -0.00 0.00 0.00 177.93 178.19 1r5k h LEU 378 N 0.20 0.21 -0.60 0.26 3.38 -1.03 -1.42 115.31 116.31 1r5k h LEU 378 Ca 0.05 0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 1r5k h LEU 378 Cb -0.02 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1r5k h LEU 378 CO -0.01 0.13 -0.18 -0.07 0.09 0.00 0.00 178.44 178.39 1r5k h LEU 379 N 0.39 0.94 -0.39 1.67 3.38 -1.13 -1.59 115.31 118.58 1r5k h LEU 379 Ca 0.30 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1r5k h LEU 379 Cb 0.36 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1r5k h LEU 379 CO -0.30 1.10 0.25 -0.08 0.09 0.00 0.00 178.44 179.50 1r5k h GLU 380 N 0.81 0.51 0.00 1.13 4.81 -0.54 -1.48 114.58 119.82 1r5k h GLU 380 Ca 0.11 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1r5k h GLU 380 Cb 0.73 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.00 1r5k h GLU 380 CO 0.06 0.33 -0.05 0.00 -0.73 0.00 0.00 179.01 178.62 1r5k n ALA 382 N -2.12 3.21 -0.13 0.00 0.00 -0.62 -4.78 120.51 116.07 1r5k n ALA 382 Ca 0.02 -0.32 -0.09 0.00 0.00 0.00 0.00 53.44 53.05 1r5k n ALA 382 Cb 0.41 -0.42 -0.01 0.00 0.00 0.00 0.00 19.45 19.43 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 0.58 -0.68 0.00 5.08 -1.45 -0.19 115.95 119.29 1r5k h TRP 383 Ca 0.00 -0.05 -0.05 0.00 1.08 0.00 0.00 58.89 59.88 1r5k h TRP 383 Cb 0.35 -0.17 -0.03 0.00 -3.00 0.00 0.00 29.16 26.31 1r5k h TRP 383 CO 0.00 0.53 0.24 1.25 -1.28 0.00 0.00 178.44 179.18 1r5k h LEU 384 N 0.46 0.95 -0.50 0.11 5.85 -1.87 -1.33 115.31 118.98 1r5k h LEU 384 Ca 0.12 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1r5k h LEU 384 Cb 0.20 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1r5k h LEU 384 CO -0.01 0.87 0.30 -0.33 -0.34 0.00 0.00 178.44 178.93 1r5k h GLU 385 N 1.00 0.68 -0.71 1.25 5.08 -1.71 -0.91 114.58 119.25 1r5k h GLU 385 Ca 0.23 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1r5k h GLU 385 Cb 0.24 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1r5k h GLU 385 CO -0.01 0.49 0.18 0.82 -1.00 0.00 0.00 179.01 179.49 1r5k h ILE 386 N 0.67 1.26 -0.39 3.13 2.04 -0.78 0.89 117.51 124.33 1r5k h ILE 386 Ca 0.18 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1r5k h ILE 386 Cb -0.01 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1r5k h ILE 386 CO -0.03 0.37 0.21 -0.07 0.00 0.00 0.00 178.15 178.62 1r5k h LEU 387 N 1.07 0.49 -0.86 1.44 3.38 -1.14 -2.85 115.31 116.84 1r5k h LEU 387 Ca 0.22 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 1r5k h LEU 387 Cb 0.36 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1r5k h LEU 387 CO 0.00 0.45 0.01 0.24 0.09 0.00 0.00 178.44 179.23 1r5k h MET 388 N 0.50 0.86 0.00 1.13 2.86 -0.61 -1.28 114.93 118.39 1r5k h MET 388 Ca 0.14 -0.24 -0.11 0.00 -2.06 0.00 0.00 59.70 57.43 1r5k h MET 388 Cb 0.08 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1r5k h MET 388 CO -0.02 0.85 -0.50 0.97 1.06 0.00 0.00 176.91 179.27 1r5k h ILE 389 N 0.80 1.30 -0.39 -1.22 2.10 -0.81 -1.07 117.51 118.22 1r5k h ILE 389 Ca 0.15 -1.76 -0.16 0.00 1.08 0.00 0.00 64.86 64.18 1r5k h ILE 389 Cb 0.47 1.96 -0.01 0.00 -1.09 0.00 0.00 36.82 38.15 1r5k h ILE 389 CO 0.02 0.49 -0.37 1.23 -1.08 0.00 0.00 178.15 178.44 1r5k h GLY 390 N 1.65 1.03 0.84 8.18 0.00 -1.12 0.62 103.07 114.26 1r5k h GLY 390 Ca -0.01 -1.04 -0.02 0.00 0.00 0.00 0.00 47.33 46.26 1r5k h GLY 390 CO 0.07 0.94 0.03 -2.00 0.00 0.00 0.00 176.54 175.58 1r5k h LEU 391 N 0.77 0.31 -0.95 3.11 5.85 -1.02 -0.58 115.31 122.81 1r5k h LEU 391 Ca 0.07 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.55 1r5k h LEU 391 Cb 0.97 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.86 1r5k h LEU 391 CO 0.09 0.49 0.62 0.58 -0.34 0.00 0.00 178.44 179.89 1r5k h VAL 392 N 0.12 1.21 -0.15 1.05 2.07 -1.08 -0.59 116.25 118.88 1r5k h VAL 392 Ca 0.06 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1r5k h VAL 392 Cb 0.31 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 1r5k h VAL 392 CO 0.00 0.23 -0.00 -0.25 0.02 0.00 0.00 177.57 177.57 1r5k h TRP 393 N 1.25 0.28 0.00 1.57 2.91 -0.52 -2.73 115.95 118.71 1r5k h TRP 393 Ca 0.36 -0.05 -0.02 0.00 1.13 0.00 0.00 58.89 60.32 1r5k h TRP 393 Cb -0.08 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 28.49 1r5k h TRP 393 CO -0.01 0.49 -0.08 0.00 -1.03 0.00 0.00 178.44 177.81 1r5k h ARG 394 N 0.00 0.00 -0.01 2.65 3.08 -0.85 -2.97 114.38 116.28 1r5k h ARG 394 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1r5k h ARG 394 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1r5k h ARG 394 CO 0.01 0.08 -0.27 0.43 -1.07 0.00 0.00 179.97 179.14 1r5k n SER 395 N -3.31 1.09 -0.24 7.04 7.64 -0.25 -4.40 113.62 121.19 1r5k n SER 395 Ca -0.01 -0.93 -0.10 0.00 1.01 0.00 0.00 58.87 58.84 1r5k n SER 395 Cb 0.27 0.16 -0.06 0.00 -1.01 0.00 0.00 64.21 63.56 1r5k n SER 395 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1r5k h MET 396 N 1.28 -0.21 -1.52 1.43 2.86 -1.33 -0.72 114.93 116.72 1r5k h MET 396 Ca 0.00 0.01 -0.23 0.00 -2.06 0.00 0.00 59.70 57.43 1r5k h MET 396 Cb 0.52 0.05 -0.10 0.00 0.06 0.00 0.00 31.60 32.13 1r5k h MET 396 CO 0.00 -0.14 0.29 0.39 1.06 0.00 0.00 176.91 178.51 1r5k n GLU 397 N -5.37 1.56 -3.01 1.72 -0.58 -1.26 -4.20 120.64 109.49 1r5k n GLU 397 Ca 0.01 -1.14 -0.15 0.00 -0.42 0.00 0.00 57.16 55.46 1r5k n GLU 397 Cb 0.33 -1.45 0.01 0.00 -0.57 0.00 0.00 31.44 29.77 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 0.50 -1.10 -1.49 -0.32 8.25 -0.28 -5.13 115.22 115.66 1r5k n HIS 398 Ca 0.22 -3.11 -0.50 0.00 -0.26 0.00 0.00 57.72 54.07 1r5k n HIS 398 Cb 0.63 0.38 -0.04 0.00 1.12 0.00 0.00 29.99 32.08 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 0.52 0.47 -0.93 -0.41 -0.02 -1.26 -1.22 135.00 132.16 1r5k n PRO 399 Ca 0.17 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 1r5k n PRO 399 Cb 0.66 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 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 1.80 0.36 3.17 -1.23 0.00 -1.26 -4.96 105.19 103.06 1r5k n GLY 400 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.75 0.83 -0.17 1.61 1.02 -0.35 -2.21 119.74 119.71 1r5k s LYS 401 Ca 0.00 -1.29 0.01 0.00 0.02 0.00 0.00 55.97 54.72 1r5k s LYS 401 Cb 0.00 -0.26 0.02 0.00 -0.52 0.00 0.00 37.83 37.07 1r5k s LYS 401 CO 0.00 0.00 -0.20 -0.51 -0.92 0.00 0.00 175.35 173.72 1r5k s LEU 402 N -2.90 2.09 -1.18 3.17 1.43 -0.39 -4.84 118.68 116.07 1r5k s LEU 402 Ca 0.10 -0.62 -0.16 0.00 -1.03 0.00 0.00 54.13 52.41 1r5k s LEU 402 Cb 0.03 -1.45 0.13 0.00 0.03 0.00 0.00 46.19 44.93 1r5k s LEU 402 CO -0.04 0.02 1.48 -0.22 0.23 0.00 0.00 176.35 177.82 1r5k s LEU 403 N 1.17 4.59 0.45 1.79 0.20 -1.26 -1.54 118.68 124.06 1r5k s LEU 403 Ca 0.02 -2.58 0.17 0.00 0.69 0.00 0.00 54.13 52.42 1r5k s LEU 403 Cb -0.14 -2.46 1.03 0.00 -0.43 0.00 0.00 46.19 44.19 1r5k s LEU 403 CO -0.10 -0.97 1.97 -0.26 -0.29 0.00 0.00 176.35 176.70 1r5k h PHE 404 N 7.72 0.00 -2.27 5.38 0.04 -1.57 -3.44 116.94 122.80 1r5k h PHE 404 Ca 0.32 0.00 0.17 0.00 2.80 0.00 0.00 57.97 61.27 1r5k h PHE 404 Cb 0.90 0.00 -0.10 0.00 2.20 0.00 0.00 35.95 38.96 1r5k h PHE 404 CO 1.22 0.21 0.51 0.00 -0.60 0.00 0.00 178.31 179.65 1r5k s ALA 405 N -4.43 -1.73 0.48 2.45 0.00 -1.07 -4.91 121.76 112.56 1r5k s ALA 405 Ca -0.03 0.35 0.23 0.00 0.00 0.00 0.00 51.96 52.50 1r5k s ALA 405 Cb 0.15 0.57 1.27 0.00 0.00 0.00 0.00 23.12 25.11 1r5k s ALA 405 CO 0.68 -0.97 1.92 -1.35 0.00 0.00 0.00 175.76 176.04 1r5k h PRO 406 N 2.00 0.18 -0.34 0.00 0.11 -1.88 -1.22 132.00 130.86 1r5k h PRO 406 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1r5k h PRO 406 Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1r5k h PRO 406 CO 0.27 0.12 0.00 0.27 -0.21 0.00 0.00 178.00 178.45 1r5k n ASN 407 N -4.40 4.18 -3.20 -2.05 6.94 -1.26 -4.72 115.26 110.75 1r5k n ASN 407 Ca 0.15 -2.91 -0.18 0.00 -0.02 0.00 0.00 54.58 51.63 1r5k n ASN 407 Cb 0.70 -0.55 -0.06 0.00 -2.36 0.00 0.00 39.78 37.50 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 -2.65 0.20 -0.41 -4.53 2.96 -0.46 -4.88 118.68 108.90 1r5k s LEU 408 Ca 0.43 -2.30 -0.09 0.00 -0.22 0.00 0.00 54.13 51.96 1r5k s LEU 408 Cb 0.34 0.50 0.08 0.00 0.50 0.00 0.00 46.19 47.61 1r5k s LEU 408 CO 0.11 -0.16 0.25 -0.22 -1.32 0.00 0.00 176.35 175.01 1r5k s LEU 409 N 0.65 5.12 0.27 -0.68 2.96 -1.26 -1.35 118.68 124.39 1r5k s LEU 409 Ca 0.28 -1.53 0.00 0.00 -0.22 0.00 0.00 54.13 52.66 1r5k s LEU 409 Cb -0.02 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1r5k s LEU 409 CO -0.11 -0.53 0.46 -0.76 -1.32 0.00 0.00 176.35 174.09 1r5k s LEU 410 N 1.40 4.15 -0.01 -0.68 1.43 -0.59 -4.92 118.68 119.46 1r5k s LEU 410 Ca 0.03 0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.54 1r5k s LEU 410 Cb -0.23 -3.22 -0.04 0.00 0.03 0.00 0.00 46.19 42.74 1r5k s LEU 410 CO 0.02 -0.15 0.04 -0.62 0.23 0.00 0.00 176.35 175.86 1r5k s ASP 411 N -3.58 5.38 0.31 2.29 -1.08 -1.26 -1.26 116.67 117.47 1r5k s ASP 411 Ca 0.39 0.08 0.03 0.00 -0.52 0.00 0.00 52.55 52.53 1r5k s ASP 411 Cb -0.10 -1.48 0.80 0.00 -1.46 0.00 0.00 42.92 40.68 1r5k s ASP 411 CO 0.32 0.29 1.58 -0.09 0.52 0.00 0.00 175.17 177.78 1r5k h ARG 412 N 4.33 0.02 0.00 4.34 1.12 -1.83 0.41 114.38 122.77 1r5k h ARG 412 Ca -0.49 -0.00 -0.05 0.00 -1.11 0.00 0.00 59.98 58.33 1r5k h ARG 412 Cb 1.18 -0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 31.13 1r5k h ARG 412 CO 0.59 0.01 -0.23 -0.91 -3.11 0.00 0.00 179.97 176.32 1r5k h ASN 413 N 0.02 0.00 0.63 -3.80 4.21 -1.94 -2.30 115.58 112.40 1r5k h ASN 413 Ca 0.62 0.00 0.00 0.00 1.21 0.00 0.00 56.30 58.13 1r5k h ASN 413 Cb 1.32 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.52 1r5k h ASN 413 CO -0.89 0.23 0.00 0.00 -1.29 0.00 0.00 177.43 175.48 1r5k n GLN 414 N -3.72 0.06 0.16 0.81 6.02 0.14 -2.86 117.38 117.99 1r5k n GLN 414 Ca -0.01 0.14 0.02 0.00 -0.01 0.00 0.00 57.00 57.14 1r5k n GLN 414 Cb 0.34 -1.50 0.37 0.00 1.02 0.00 0.00 30.24 30.47 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 3.49 0.10 1.77 1.08 0.00 -1.35 -1.95 103.07 106.22 1r5k h GLY 415 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1r5k h GLY 415 CO 0.00 0.07 0.00 0.28 0.00 0.00 0.00 176.54 176.89 1r5k n LYS 416 N -4.17 0.14 -0.05 4.80 5.02 -1.14 -2.67 118.16 120.10 1r5k n LYS 416 Ca -0.02 0.15 0.18 0.00 -2.02 0.00 0.00 58.31 56.60 1r5k n LYS 416 Cb 0.36 -1.50 0.63 0.00 -0.02 0.00 0.00 35.03 34.50 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 -5.15 1.81 0.08 0.00 0.11 -1.09 -3.74 120.40 112.43 1r5k s VAL 418 Ca -0.06 -1.13 -0.31 0.00 -2.93 0.00 0.00 61.98 57.55 1r5k s VAL 418 Cb 0.20 -1.53 -0.06 0.00 -1.53 0.00 0.00 36.38 33.45 1r5k s VAL 418 CO 0.74 0.37 1.25 -0.70 -3.33 0.00 0.00 175.10 173.42 1r5k s GLU 419 N -0.90 4.41 0.00 1.54 2.12 -1.26 -2.69 118.70 121.91 1r5k s GLU 419 Ca 0.09 1.85 0.00 0.00 0.36 0.00 0.00 54.97 57.27 1r5k s GLU 419 Cb -0.09 -3.31 0.00 0.00 0.26 0.00 0.00 34.13 30.99 1r5k s GLU 419 CO 0.01 -0.29 0.00 0.41 -0.54 0.00 0.00 175.26 174.85 1r5k n GLY 420 N 3.22 3.15 0.24 -1.50 0.00 -1.26 -4.91 105.19 104.13 1r5k n GLY 420 Ca 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 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 1.60 0.78 -1.03 1.61 -1.53 -1.70 -2.93 114.93 111.73 1r5k h MET 421 Ca 0.00 -0.09 0.28 0.00 -3.44 0.00 0.00 59.70 56.45 1r5k h MET 421 Cb 0.00 -0.15 -0.06 0.00 -0.55 0.00 0.00 31.60 30.84 1r5k h MET 421 CO 0.00 0.59 0.71 -0.24 0.14 0.00 0.00 176.91 178.12 1r5k h VAL 422 N 0.75 0.51 -0.37 -5.77 3.04 -1.75 0.61 116.25 113.27 1r5k h VAL 422 Ca 0.20 -0.05 0.01 0.00 -1.01 0.00 0.00 66.70 65.85 1r5k h VAL 422 Cb 0.04 0.35 -0.02 0.00 -2.01 0.00 0.00 31.29 29.64 1r5k h VAL 422 CO -0.03 0.03 0.23 -0.33 -1.01 0.00 0.00 177.57 176.45 1r5k h GLU 423 N 0.15 0.45 -0.15 4.17 3.07 -1.88 -0.60 114.58 119.79 1r5k h GLU 423 Ca 0.52 -0.03 -0.20 0.00 -0.50 0.00 0.00 59.36 59.15 1r5k h GLU 423 Cb 1.78 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 29.59 1r5k h GLU 423 CO -0.10 0.30 -0.73 0.82 -1.40 0.00 0.00 179.01 177.90 1r5k h ILE 424 N 0.46 1.31 -0.90 3.13 2.04 -0.01 -2.67 117.51 120.87 1r5k h ILE 424 Ca 0.14 -1.98 0.01 0.00 1.00 0.00 0.00 64.86 64.03 1r5k h ILE 424 Cb -0.01 1.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 1r5k h ILE 424 CO -0.06 0.62 0.59 -0.26 0.00 0.00 0.00 178.15 179.05 1r5k h PHE 425 N 0.47 1.13 -0.54 1.37 -1.00 -0.69 -1.10 116.94 116.58 1r5k h PHE 425 Ca -0.04 0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.69 1r5k h PHE 425 Cb 1.33 -0.38 -0.02 0.00 3.61 0.00 0.00 35.95 40.49 1r5k h PHE 425 CO 0.07 0.71 0.02 -0.44 -1.61 0.00 0.00 178.31 177.06 1r5k h ASP 426 N 1.21 0.87 -0.53 2.17 3.45 -0.97 0.18 116.42 122.80 1r5k h ASP 426 Ca 0.33 -0.21 -0.11 0.00 0.43 0.00 0.00 57.03 57.47 1r5k h ASP 426 Cb -0.13 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 38.39 1r5k h ASP 426 CO -0.07 0.92 -0.09 0.24 -1.57 0.00 0.00 179.24 178.66 1r5k h MET 427 N 0.84 1.00 0.05 3.56 2.86 -1.19 -1.57 114.93 120.49 1r5k h MET 427 Ca 0.16 -0.37 -0.00 0.00 -2.06 0.00 0.00 59.70 57.43 1r5k h MET 427 Cb 0.47 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1r5k h MET 427 CO 0.02 1.05 -0.03 -0.07 1.06 0.00 0.00 176.91 178.94 1r5k h LEU 428 N 0.88 -0.06 -1.30 1.22 3.38 -0.59 -0.68 115.31 118.16 1r5k h LEU 428 Ca 0.14 -0.24 0.12 0.00 0.09 0.00 0.00 57.88 57.99 1r5k h LEU 428 Cb 0.65 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.36 1r5k h LEU 428 CO 0.05 0.20 0.55 -0.07 0.09 0.00 0.00 178.44 179.26 1r5k h LEU 429 N -0.33 0.68 -0.14 1.67 3.38 -0.63 0.11 115.31 120.05 1r5k h LEU 429 Ca -0.01 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1r5k h LEU 429 Cb 0.29 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1r5k h LEU 429 CO 0.01 0.38 -0.11 0.00 0.09 0.00 0.00 178.44 178.81 1r5k h ALA 430 N 1.59 0.21 -0.39 1.53 0.00 -1.04 0.22 119.26 121.37 1r5k h ALA 430 Ca 0.41 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1r5k h ALA 430 Cb 0.56 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1r5k h ALA 430 CO -0.17 0.05 0.21 1.15 0.00 0.00 0.00 179.25 180.49 1r5k h THR 431 N -0.03 1.00 -0.22 0.00 2.02 -0.11 0.16 112.91 115.72 1r5k h THR 431 Ca 0.03 -0.15 -0.12 0.00 0.77 0.00 0.00 66.41 66.94 1r5k h THR 431 Cb 0.61 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1r5k h THR 431 CO 0.03 0.08 -0.36 0.77 0.37 0.00 0.00 175.52 176.40 1r5k h SER 432 N 0.42 0.50 -0.79 4.18 4.64 -0.66 -1.39 113.55 120.46 1r5k h SER 432 Ca 0.16 -0.21 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 1r5k h SER 432 Cb 0.05 -0.14 -0.04 0.00 -0.31 0.00 0.00 62.40 61.96 1r5k h SER 432 CO -0.10 0.83 0.43 -1.28 -0.87 0.00 0.00 176.83 175.83 1r5k h SER 433 N 0.41 0.99 -0.22 4.97 0.87 -0.03 -1.87 113.55 118.67 1r5k h SER 433 Ca 0.04 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 1r5k h SER 433 Cb 0.83 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 1r5k h SER 433 CO 0.07 0.81 0.01 -0.09 -0.53 0.00 0.00 176.83 177.10 1r5k h ARG 434 N 1.10 0.39 -0.94 2.24 2.43 -0.13 -2.64 114.38 116.83 1r5k h ARG 434 Ca 0.28 -0.12 0.23 0.00 -0.81 0.00 0.00 59.98 59.56 1r5k h ARG 434 Cb 0.04 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.49 1r5k h ARG 434 CO -0.04 0.57 0.63 0.74 -1.51 0.00 0.00 179.97 180.35 1r5k h PHE 435 N 0.16 0.45 -0.22 2.20 0.05 -1.05 -1.17 116.94 117.36 1r5k h PHE 435 Ca 0.06 0.01 -0.14 0.00 3.82 0.00 0.00 57.97 61.73 1r5k h PHE 435 Cb 0.39 -0.14 -0.01 0.00 2.00 0.00 0.00 35.95 38.19 1r5k h PHE 435 CO 0.03 0.10 -0.46 -0.09 -0.18 0.00 0.00 178.31 177.71 1r5k h ARG 436 N 0.32 0.56 -0.29 1.51 2.43 -0.98 -0.26 114.38 117.67 1r5k h ARG 436 Ca 0.49 -0.31 -0.18 0.00 -0.81 0.00 0.00 59.98 59.17 1r5k h ARG 436 Cb 1.37 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.93 1r5k h ARG 436 CO -0.17 0.90 -0.53 0.52 -1.51 0.00 0.00 179.97 179.18 1r5k h MET 437 N 0.45 0.86 0.00 0.20 2.86 -1.03 -2.79 114.93 115.48 1r5k h MET 437 Ca 0.03 -0.54 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1r5k h MET 437 Cb 0.97 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.69 1r5k h MET 437 CO 0.09 1.17 0.00 -1.33 1.06 0.00 0.00 176.91 177.90 1r5k n MET 438 N -4.01 0.19 -3.53 1.72 2.81 -0.80 -4.91 117.12 108.59 1r5k n MET 438 Ca -0.04 0.26 -0.20 0.00 -1.81 0.00 0.00 57.70 55.91 1r5k n MET 438 Cb 0.62 -1.77 0.08 0.00 -0.71 0.00 0.00 33.22 31.44 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 -2.10 -2.85 -4.57 7.83 5.15 -0.19 -4.87 115.26 113.66 1r5k n ASN 439 Ca 0.04 -0.65 -0.49 0.00 -0.60 0.00 0.00 54.58 52.88 1r5k n ASN 439 Cb 0.34 -4.88 -0.04 0.00 -0.53 0.00 0.00 39.78 34.66 1r5k n ASN 439 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1r5k n LEU 440 N -4.35 1.31 -4.93 1.20 7.94 -0.68 -4.98 117.00 112.51 1r5k n LEU 440 Ca -0.22 1.14 -0.26 0.00 -1.11 0.00 0.00 56.01 55.56 1r5k n LEU 440 Cb 0.64 -1.18 -0.03 0.00 0.53 0.00 0.00 43.42 43.38 1r5k n LEU 440 CO 0.64 -1.41 -0.11 -1.10 -1.11 0.00 0.00 177.39 174.30 1r5k s GLN 441 N -0.36 3.39 0.39 1.96 -1.52 -1.26 -4.99 119.66 117.27 1r5k s GLN 441 Ca 0.74 -0.62 0.07 0.00 -1.95 0.00 0.00 55.36 53.60 1r5k s GLN 441 Cb -0.88 -2.94 0.82 0.00 -0.22 0.00 0.00 33.01 29.79 1r5k s GLN 441 CO 0.53 0.52 2.02 0.78 -0.25 0.00 0.00 175.29 178.88 1r5k h GLY 442 N 2.18 0.72 1.55 3.09 0.00 -1.98 0.27 103.07 108.91 1r5k h GLY 442 Ca -0.48 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 46.57 1r5k h GLY 442 CO 0.68 0.22 0.11 0.83 0.00 0.00 0.00 176.54 178.38 1r5k h GLU 443 N 0.63 0.57 -0.11 4.80 3.07 -1.98 -1.26 114.58 120.31 1r5k h GLU 443 Ca 0.22 -0.09 -0.17 0.00 -0.50 0.00 0.00 59.36 58.82 1r5k h GLU 443 Cb 0.10 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 27.92 1r5k h GLU 443 CO -0.06 0.52 -0.58 0.93 -1.40 0.00 0.00 179.01 178.42 1r5k h GLU 444 N 0.56 0.59 -0.57 2.33 5.08 -1.00 -3.01 114.58 118.56 1r5k h GLU 444 Ca 0.13 -0.49 0.04 0.00 -1.00 0.00 0.00 59.36 58.04 1r5k h GLU 444 Cb 0.20 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 1r5k h GLU 444 CO -0.01 1.11 0.32 0.35 -1.00 0.00 0.00 179.01 179.79 1r5k h PHE 445 N 0.23 0.60 0.00 4.33 3.57 -0.37 -1.26 116.94 124.04 1r5k h PHE 445 Ca -0.04 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.36 1r5k h PHE 445 Cb 1.22 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.76 1r5k h PHE 445 CO 0.11 0.32 -0.56 0.28 -2.23 0.00 0.00 178.31 176.23 1r5k h VAL 446 N 0.63 1.37 -0.20 1.41 2.07 -1.27 -0.65 116.25 119.61 1r5k h VAL 446 Ca 0.24 -1.93 -0.03 0.00 0.82 0.00 0.00 66.70 65.80 1r5k h VAL 446 Cb 0.09 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1r5k h VAL 446 CO -0.14 0.55 -0.01 0.00 0.02 0.00 0.00 177.57 178.00 1r5k h LEU 448 N 0.11 1.01 -0.58 0.00 3.38 -0.60 -0.68 115.31 117.95 1r5k h LEU 448 Ca 0.06 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.94 1r5k h LEU 448 Cb 0.41 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1r5k h LEU 448 CO 0.01 0.84 0.35 0.50 0.09 0.00 0.00 178.44 180.23 1r5k h LYS 449 N 1.11 0.67 -0.06 1.13 3.64 -1.14 -0.89 116.57 121.03 1r5k h LYS 449 Ca 0.28 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.51 1r5k h LYS 449 Cb 0.07 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1r5k h LYS 449 CO -0.04 0.44 -0.45 0.77 -2.27 0.00 0.00 179.45 177.90 1r5k h SER 450 N 0.69 0.15 -0.59 4.20 0.02 -1.12 -2.62 113.55 114.28 1r5k h SER 450 Ca 0.23 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 61.05 1r5k h SER 450 Cb 0.03 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1r5k h SER 450 CO -0.10 0.59 0.10 0.40 -1.14 0.00 0.00 176.83 176.67 1r5k h ILE 451 N 0.12 1.26 -0.38 3.27 2.04 -0.24 -2.68 117.51 120.89 1r5k h ILE 451 Ca 0.01 -0.98 0.00 0.00 1.00 0.00 0.00 64.86 64.89 1r5k h ILE 451 Cb 0.85 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 1r5k h ILE 451 CO 0.07 0.36 0.25 0.40 0.00 0.00 0.00 178.15 179.23 1r5k h ILE 452 N 0.87 1.10 -0.74 -0.67 2.04 -0.87 -0.33 117.51 118.90 1r5k h ILE 452 Ca 0.18 -0.19 0.10 0.00 1.00 0.00 0.00 64.86 65.95 1r5k h ILE 452 Cb 0.42 0.55 -0.07 0.00 -0.74 0.00 0.00 36.82 36.97 1r5k h ILE 452 CO 0.01 0.10 0.39 0.25 0.00 0.00 0.00 178.15 178.89 1r5k h LEU 453 N 0.51 0.52 0.00 1.44 5.85 -1.30 -2.04 115.31 120.29 1r5k h LEU 453 Ca 0.14 0.06 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 1r5k h LEU 453 Cb -0.05 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1r5k h LEU 453 CO -0.03 0.29 -1.39 0.18 -0.34 0.00 0.00 178.44 177.15 1r5k n LEU 454 N -4.83 0.73 -0.06 2.25 4.77 -1.03 -4.37 117.00 114.46 1r5k n LEU 454 Ca 0.12 0.30 -0.15 0.00 -0.03 0.00 0.00 56.01 56.25 1r5k n LEU 454 Cb 0.28 0.04 -0.14 0.00 -2.33 0.00 0.00 43.42 41.28 1r5k n LEU 454 CO 0.25 0.04 -0.94 -3.20 -1.33 0.00 0.00 177.39 172.21 1r5k n ASN 455 N -2.75 1.36 0.31 -1.43 2.85 -0.15 -4.15 115.26 111.30 1r5k n ASN 455 Ca -0.07 0.13 0.20 0.00 -0.11 0.00 0.00 54.58 54.73 1r5k n ASN 455 Cb 0.73 -0.19 1.00 0.00 1.24 0.00 0.00 39.78 42.57 1r5k n ASN 455 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1r5k h SER 456 N 0.02 0.00 -0.04 1.20 0.02 -1.56 -2.79 113.55 110.40 1r5k h SER 456 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1r5k h SER 456 Cb 2.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.58 1r5k h SER 456 CO 0.03 0.02 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 1r5k n GLY 457 N -0.76 0.04 0.16 -3.77 0.00 -1.26 -4.72 105.19 94.89 1r5k n GLY 457 Ca -0.02 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 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 0.86 1.41 -0.17 1.61 3.04 -1.65 -3.05 116.25 118.30 1r5k h VAL 458 Ca 0.00 -2.20 0.00 0.00 -1.01 0.00 0.00 66.70 63.49 1r5k h VAL 458 Cb 0.30 2.16 0.00 0.00 -2.01 0.00 0.00 31.29 31.74 1r5k h VAL 458 CO 0.00 0.65 0.00 -1.22 -1.01 0.00 0.00 177.57 175.99 1r5k n TYR 459 N -3.80 0.23 -2.60 3.17 4.01 -1.26 -3.87 117.16 113.03 1r5k n TYR 459 Ca -0.03 -0.11 0.01 0.00 -0.16 0.00 0.00 57.90 57.60 1r5k n TYR 459 Cb 0.70 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.77 1r5k n TYR 459 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 1r5k n THR 460 N 0.00 0.80 -2.86 -0.72 5.66 -1.15 -5.06 114.28 110.96 1r5k n THR 460 Ca 0.08 -2.14 -0.41 0.00 -3.05 0.00 0.00 64.05 58.53 1r5k n THR 460 Cb 0.16 1.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.90 1r5k n THR 460 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1r5k s PHE 461 N -2.08 3.66 0.05 1.09 0.08 -1.25 -5.01 117.98 114.53 1r5k s PHE 461 Ca 0.32 1.53 -0.21 0.00 0.12 0.00 0.00 56.93 58.70 1r5k s PHE 461 Cb 0.36 -2.97 -0.09 0.00 -0.57 0.00 0.00 43.02 39.75 1r5k s PHE 461 CO -0.10 0.09 1.32 -0.07 -0.10 0.00 0.00 175.22 176.37 1r5k h LEU 462 N 6.46 -0.87-10.22 -0.37 3.38 -1.97 -3.46 115.31 108.27 1r5k h LEU 462 Ca -0.42 0.08 -0.51 0.00 0.09 0.00 0.00 57.88 57.13 1r5k h LEU 462 Cb 1.21 0.30 0.10 0.00 0.09 0.00 0.00 40.66 42.36 1r5k h LEU 462 CO 0.74 -0.36 0.37 -0.94 0.09 0.00 0.00 178.44 178.34 1r5k s SER 463 N -3.59 5.22 -0.07 -0.43 1.04 -1.26 -4.98 113.70 109.63 1r5k s SER 463 Ca -0.10 1.91 0.12 0.00 0.48 0.00 0.00 55.95 58.36 1r5k s SER 463 Cb 0.03 -2.54 0.35 0.00 0.10 0.00 0.00 66.02 63.96 1r5k s SER 463 CO 0.35 -1.55 1.28 -1.54 0.98 0.00 0.00 173.24 172.76 1r5k n SER 464 N -2.49 3.13 -4.48 7.02 3.41 -1.26 -4.87 113.62 114.07 1r5k n SER 464 Ca 0.10 -2.45 -0.29 0.00 -0.26 0.00 0.00 58.87 55.97 1r5k n SER 464 Cb 0.52 -0.33 0.23 0.00 -0.26 0.00 0.00 64.21 64.37 1r5k n SER 464 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1r5k n THR 465 N -0.11 0.00 -0.08 6.66 -2.24 -1.26 -4.89 114.28 112.36 1r5k n THR 465 Ca 0.14 -0.35 -0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1r5k n THR 465 Cb 0.59 -0.95 0.28 0.00 -2.10 0.00 0.00 70.33 68.16 1r5k n THR 465 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1r5k h LEU 466 N -2.48 0.64 -0.25 3.22 6.46 -2.01 -3.05 115.31 117.85 1r5k h LEU 466 Ca -0.57 -0.08 -0.21 0.00 -0.12 0.00 0.00 57.88 56.90 1r5k h LEU 466 Cb 1.32 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 1r5k h LEU 466 CO 0.46 0.59 -0.78 0.50 -0.62 0.00 0.00 178.44 178.59 1r5k h LYS 467 N 0.69 0.62 -0.60 1.25 3.64 -1.99 -2.95 116.57 117.23 1r5k h LYS 467 Ca 0.17 -0.52 0.02 0.00 -1.27 0.00 0.00 60.65 59.04 1r5k h LYS 467 Cb 0.17 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1r5k h LYS 467 CO -0.01 1.14 0.40 1.03 -2.27 0.00 0.00 179.45 179.74 1r5k h SER 468 N 0.42 0.64 -0.19 4.20 0.87 -1.88 0.81 113.55 118.43 1r5k h SER 468 Ca -0.05 -0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.39 1r5k h SER 468 Cb 1.39 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1r5k h SER 468 CO 0.15 0.45 -0.30 -0.07 -0.53 0.00 0.00 176.83 176.53 1r5k h LEU 469 N 0.75 0.59 0.00 2.23 3.38 -1.43 -2.04 115.31 118.79 1r5k h LEU 469 Ca 0.23 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1r5k h LEU 469 Cb 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1r5k h LEU 469 CO -0.06 1.01 -0.01 -1.84 0.09 0.00 0.00 178.44 177.63 1r5k n GLU 470 N -4.35 0.03 0.03 1.13 0.28 -1.05 -0.64 120.64 116.08 1r5k n GLU 470 Ca -0.06 0.03 -0.19 0.00 -0.16 0.00 0.00 57.16 56.78 1r5k n GLU 470 Cb 0.47 -1.54 -0.13 0.00 1.43 0.00 0.00 31.44 31.68 1r5k n GLU 470 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1r5k h GLU 471 N 0.00 0.35 0.00 3.44 4.57 -0.70 -2.58 114.58 119.67 1r5k h GLU 471 Ca 0.00 -0.47 -0.08 0.00 -1.18 0.00 0.00 59.36 57.63 1r5k h GLU 471 Cb 0.53 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 1r5k h GLU 471 CO 0.00 1.17 -0.44 1.57 -1.18 0.00 0.00 179.01 180.13 1r5k h LYS 472 N -0.24 0.00 -0.52 1.92 2.10 -1.23 -2.58 116.57 116.02 1r5k h LYS 472 Ca -0.11 0.00 0.07 0.00 -2.00 0.00 0.00 60.65 58.61 1r5k h LYS 472 Cb 1.47 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.75 1r5k h LYS 472 CO 0.14 0.34 0.20 0.22 -2.00 0.00 0.00 179.45 178.35 1r5k h ASP 473 N 0.00 0.23 -0.55 7.07 1.82 -0.97 -1.03 116.42 122.99 1r5k h ASP 473 Ca -0.01 0.06 -0.03 0.00 -0.39 0.00 0.00 57.03 56.65 1r5k h ASP 473 Cb 1.28 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 41.30 1r5k h ASP 473 CO 0.04 0.16 0.22 -0.74 -1.61 0.00 0.00 179.24 177.31 1r5k h HIS 474 N 0.40 0.84 -0.76 0.28 2.76 -1.29 -1.59 115.15 115.79 1r5k h HIS 474 Ca 0.25 -0.06 -0.03 0.00 -2.20 0.00 0.00 60.37 58.33 1r5k h HIS 474 Cb 0.26 -0.25 -0.04 0.00 1.55 0.00 0.00 27.41 28.93 1r5k h HIS 474 CO -0.15 0.68 0.36 0.82 -1.30 0.00 0.00 177.93 178.34 1r5k h ILE 475 N 0.75 1.24 -0.11 6.26 2.04 -1.06 -2.30 117.51 124.34 1r5k h ILE 475 Ca 0.18 -0.68 -0.17 0.00 1.00 0.00 0.00 64.86 65.20 1r5k h ILE 475 Cb 0.20 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1r5k h ILE 475 CO -0.01 0.29 -0.64 0.45 0.00 0.00 0.00 178.15 178.23 1r5k h HIS 476 N 1.07 0.53 -0.16 1.37 3.86 -0.80 -0.49 115.15 120.53 1r5k h HIS 476 Ca 0.26 -0.21 0.03 0.00 -1.16 0.00 0.00 60.37 59.29 1r5k h HIS 476 Cb 0.11 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 1r5k h HIS 476 CO 0.01 0.93 -0.00 0.00 0.86 0.00 0.00 177.93 179.73 1r5k h ARG 477 N 0.30 0.05 -0.73 2.45 3.08 -1.02 0.60 114.38 119.10 1r5k h ARG 477 Ca -0.01 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1r5k h ARG 477 Cb 1.18 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 1r5k h ARG 477 CO 0.11 0.03 0.25 0.28 -1.07 0.00 0.00 179.97 179.57 1r5k h VAL 478 N 0.05 1.26 -0.79 2.04 2.07 -1.16 -1.67 116.25 118.05 1r5k h VAL 478 Ca 0.08 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.76 1r5k h VAL 478 Cb 0.10 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 1r5k h VAL 478 CO -0.13 0.35 0.50 -0.07 0.02 0.00 0.00 177.57 178.24 1r5k h LEU 479 N 1.08 0.82 -1.60 2.57 3.38 -0.87 -1.39 115.31 119.30 1r5k h LEU 479 Ca 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 1r5k h LEU 479 Cb 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1r5k h LEU 479 CO -0.01 0.56 0.09 0.44 0.09 0.00 0.00 178.44 179.60 1r5k h ASP 480 N 0.97 0.31 0.18 -0.43 3.45 -0.20 -0.71 116.42 119.98 1r5k h ASP 480 Ca 0.32 -0.03 -0.18 0.00 0.43 0.00 0.00 57.03 57.58 1r5k h ASP 480 Cb 0.04 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 38.72 1r5k h ASP 480 CO -0.12 0.30 -0.67 0.50 -1.57 0.00 0.00 179.24 177.68 1r5k h LYS 481 N 0.35 0.45 0.00 3.56 1.63 -0.48 -1.74 116.57 120.34 1r5k h LYS 481 Ca 0.09 -0.34 -0.13 0.00 -0.85 0.00 0.00 60.65 59.42 1r5k h LYS 481 Cb 0.10 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.77 1r5k h LYS 481 CO -0.01 0.96 -0.61 0.82 -3.45 0.00 0.00 179.45 177.17 1r5k h ILE 482 N 0.32 1.33 -0.55 2.00 2.04 -0.66 -0.42 117.51 121.57 1r5k h ILE 482 Ca -0.02 -2.16 -0.06 0.00 1.00 0.00 0.00 64.86 63.62 1r5k h ILE 482 Cb 1.23 2.20 -0.02 0.00 -0.74 0.00 0.00 36.82 39.49 1r5k h ILE 482 CO 0.12 0.60 0.11 0.74 0.00 0.00 0.00 178.15 179.71 1r5k h THR 483 N 0.00 1.25 -0.66 -0.27 2.02 -0.97 -1.24 112.91 113.04 1r5k h THR 483 Ca -0.01 -0.92 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 1r5k h THR 483 Cb 1.15 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 1r5k h THR 483 CO 0.08 0.34 0.38 0.44 0.37 0.00 0.00 175.52 177.12 1r5k h ASP 484 N 0.79 0.81 -0.54 4.18 3.45 -0.77 -2.10 116.42 122.24 1r5k h ASP 484 Ca 0.17 -0.08 -0.09 0.00 0.43 0.00 0.00 57.03 57.46 1r5k h ASP 484 Cb 0.38 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.92 1r5k h ASP 484 CO 0.01 0.66 -0.01 0.74 -1.57 0.00 0.00 179.24 179.07 1r5k h THR 485 N 0.90 1.26 -0.39 0.35 2.02 -0.92 -0.11 112.91 116.03 1r5k h THR 485 Ca 0.23 -1.12 0.03 0.00 0.77 0.00 0.00 66.41 66.32 1r5k h THR 485 Cb 0.02 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 1r5k h THR 485 CO -0.04 0.40 0.20 -0.07 0.37 0.00 0.00 175.52 176.38 1r5k h LEU 486 N 0.84 0.29 -0.21 2.58 3.38 -0.89 -0.77 115.31 120.54 1r5k h LEU 486 Ca 0.15 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1r5k h LEU 486 Cb 0.55 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1r5k h LEU 486 CO 0.03 0.21 0.01 0.40 0.09 0.00 0.00 178.44 179.18 1r5k h ILE 487 N 0.40 1.25 -0.90 1.22 1.08 -1.14 -2.22 117.51 117.21 1r5k h ILE 487 Ca 0.16 -0.84 0.16 0.00 -0.39 0.00 0.00 64.86 63.95 1r5k h ILE 487 Cb 0.06 1.39 -0.10 0.00 -3.07 0.00 0.00 36.82 35.10 1r5k h ILE 487 CO -0.11 0.26 0.48 -0.74 -0.69 0.00 0.00 178.15 177.35 1r5k h HIS 488 N 0.14 0.84 -0.22 1.37 2.76 -0.72 0.30 115.15 119.62 1r5k h HIS 488 Ca 0.06 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 1r5k h HIS 488 Cb 0.38 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.09 1r5k h HIS 488 CO 0.03 0.18 0.10 -0.07 -1.30 0.00 0.00 177.93 176.87 1r5k h LEU 489 N 0.65 0.30 -0.87 0.26 3.38 -0.77 -1.06 115.31 117.19 1r5k h LEU 489 Ca 0.50 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.29 1r5k h LEU 489 Cb 0.75 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 1r5k h LEU 489 CO -0.38 0.36 0.37 0.24 0.09 0.00 0.00 178.44 179.12 1r5k h MET 490 N 0.21 1.19 -0.34 1.13 2.86 -0.24 -1.68 114.93 118.07 1r5k h MET 490 Ca 0.07 -0.19 -0.13 0.00 -2.06 0.00 0.00 59.70 57.40 1r5k h MET 490 Cb 0.15 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1r5k h MET 490 CO -0.01 0.93 -0.31 0.00 1.06 0.00 0.00 176.91 178.58 1r5k h ALA 491 N 1.23 0.81 -0.09 6.32 0.00 -0.28 -2.37 119.26 124.88 1r5k h ALA 491 Ca 0.28 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1r5k h ALA 491 Cb 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1r5k h ALA 491 CO -0.03 0.64 -0.23 0.87 0.00 0.00 0.00 179.25 180.50 1r5k h LYS 492 N 0.62 0.15 0.00 0.00 1.79 -0.80 -0.67 116.57 117.66 1r5k h LYS 492 Ca 0.07 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1r5k h LYS 492 Cb 0.84 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 1r5k h LYS 492 CO 0.07 0.39 0.00 0.00 -1.08 0.00 0.00 179.45 178.83 1r5k n ALA 493 N -2.48 2.30 -0.80 3.86 0.00 -0.67 -4.89 120.51 117.83 1r5k n ALA 493 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1r5k n ALA 493 Cb 0.33 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.37 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 0.75 0.67 3.82 0.00 0.00 -0.26 -5.06 105.19 105.11 1r5k n GLY 494 Ca 0.14 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 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 3.26 0.88 0.99 1.43 -0.96 -5.03 118.68 119.25 1r5k s LEU 495 Ca 0.00 1.66 -0.12 0.00 -1.03 0.00 0.00 54.13 54.64 1r5k s LEU 495 Cb 0.00 -4.50 0.12 0.00 0.03 0.00 0.00 46.19 41.84 1r5k s LEU 495 CO 0.00 -1.30 1.12 0.42 0.23 0.00 0.00 176.35 176.82 1r5k s THR 496 N -2.87 2.40 0.23 5.49 -4.23 -1.26 -4.75 115.64 110.64 1r5k s THR 496 Ca 0.59 0.13 -0.08 0.00 -1.18 0.00 0.00 61.69 61.15 1r5k s THR 496 Cb -0.14 -2.83 0.19 0.00 1.34 0.00 0.00 72.50 71.06 1r5k s THR 496 CO 0.49 -0.17 1.89 -0.07 -0.54 0.00 0.00 174.62 176.22 1r5k h LEU 497 N -1.41 0.93 -0.15 4.79 3.38 -1.98 0.25 115.31 121.11 1r5k h LEU 497 Ca -0.50 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 1r5k h LEU 497 Cb 1.31 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1r5k h LEU 497 CO 0.60 0.65 0.04 -0.61 0.09 0.00 0.00 178.44 179.21 1r5k h GLN 498 N 1.09 0.25 -0.22 1.13 4.15 -2.00 -1.48 115.11 118.03 1r5k h GLN 498 Ca 0.32 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.65 1r5k h GLN 498 Cb -0.06 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 1r5k h GLN 498 CO -0.09 0.40 -0.02 1.96 -1.93 0.00 0.00 178.83 179.16 1r5k h GLN 499 N 0.05 0.32 0.59 1.69 4.20 -1.78 -0.53 115.11 119.66 1r5k h GLN 499 Ca 0.05 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1r5k h GLN 499 Cb 0.27 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 28.00 1r5k h GLN 499 CO 0.00 0.36 -0.28 1.96 -0.67 0.00 0.00 178.83 180.20 1r5k h GLN 500 N 0.31 -0.76 0.00 1.46 4.20 -0.13 -1.46 115.11 118.73 1r5k h GLN 500 Ca 0.07 0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 1r5k h GLN 500 Cb 0.24 0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 1r5k h GLN 500 CO 0.01 -0.51 -0.15 1.12 -0.67 0.00 0.00 178.83 178.63 1r5k h HIS 501 N -0.91 0.00 -0.28 2.96 2.07 -1.12 -1.59 115.15 116.28 1r5k h HIS 501 Ca -0.08 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.35 1r5k h HIS 501 Cb 0.61 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.57 1r5k h HIS 501 CO 0.06 0.15 -0.22 1.96 -3.07 0.00 0.00 177.93 176.81 1r5k h GLN 502 N 0.00 0.52 0.07 5.12 4.20 -1.00 -1.97 115.11 122.05 1r5k h GLN 502 Ca -0.00 -0.19 -0.14 0.00 0.06 0.00 0.00 58.65 58.38 1r5k h GLN 502 Cb 0.34 -0.04 0.01 0.00 0.30 0.00 0.00 27.48 28.10 1r5k h GLN 502 CO 0.02 0.71 -0.59 -0.09 -0.67 0.00 0.00 178.83 178.21 1r5k h ARG 503 N 0.46 0.27 -0.41 1.46 2.43 -0.44 -1.48 114.38 116.68 1r5k h ARG 503 Ca 0.07 -0.39 0.09 0.00 -0.81 0.00 0.00 59.98 58.94 1r5k h ARG 503 Cb 0.64 0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 30.23 1r5k h ARG 503 CO 0.05 1.14 -0.21 1.25 -1.51 0.00 0.00 179.97 180.68 1r5k h LEU 504 N -0.41 -0.72 -0.60 3.80 5.85 -1.32 0.34 115.31 122.25 1r5k h LEU 504 Ca -0.09 0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1r5k h LEU 504 Cb 1.41 0.38 -0.03 0.00 0.37 0.00 0.00 40.66 42.78 1r5k h LEU 504 CO 0.11 -0.24 0.38 0.00 -0.34 0.00 0.00 178.44 178.35 1r5k h ALA 505 N 1.11 0.77 -0.52 1.25 0.00 -1.37 -1.60 119.26 118.90 1r5k h ALA 505 Ca 0.20 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.12 1r5k h ALA 505 Cb 0.44 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1r5k h ALA 505 CO -0.49 0.15 0.27 1.96 0.00 0.00 0.00 179.25 181.14 1r5k h GLN 506 N 0.77 0.51 -0.11 0.00 4.20 -0.21 0.38 115.11 120.65 1r5k h GLN 506 Ca 0.23 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.86 1r5k h GLN 506 Cb -0.04 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.62 1r5k h GLN 506 CO -0.07 0.34 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.24 1r5k h LEU 507 N 0.53 0.29 -1.41 1.46 3.38 -0.54 -2.68 115.31 116.33 1r5k h LEU 507 Ca 0.23 -0.48 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 1r5k h LEU 507 Cb 0.13 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1r5k h LEU 507 CO -0.15 0.72 -0.30 -0.07 0.09 0.00 0.00 178.44 178.73 1r5k h LEU 508 N -0.13 0.00 -1.00 1.67 3.38 -1.14 -1.37 115.31 116.72 1r5k h LEU 508 Ca 0.02 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1r5k h LEU 508 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1r5k h LEU 508 CO 0.03 0.30 -0.36 -0.07 0.09 0.00 0.00 178.44 178.42 1r5k h LEU 509 N 0.00 0.26 -1.35 1.67 3.38 -0.82 -2.38 115.31 116.06 1r5k h LEU 509 Ca -0.00 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1r5k h LEU 509 Cb 0.54 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1r5k h LEU 509 CO 0.04 0.61 0.10 0.40 0.09 0.00 0.00 178.44 179.68 1r5k h ILE 510 N 0.22 1.17 -0.12 1.22 2.04 -0.91 -1.81 117.51 119.31 1r5k h ILE 510 Ca 0.02 -0.58 0.03 0.00 1.00 0.00 0.00 64.86 65.34 1r5k h ILE 510 Cb 0.75 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1r5k h ILE 510 CO 0.06 0.21 0.10 -0.07 0.00 0.00 0.00 178.15 178.45 1r5k h LEU 511 N 0.53 0.00 -0.64 1.44 4.07 -1.08 0.22 115.31 119.84 1r5k h LEU 511 Ca 0.13 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 58.02 1r5k h LEU 511 Cb 0.19 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.90 1r5k h LEU 511 CO -0.01 0.00 0.15 0.28 -1.08 0.00 0.00 178.44 177.78 1r5k h SER 512 N 0.00 0.99 0.02 -0.43 0.02 -1.30 -1.54 113.55 111.30 1r5k h SER 512 Ca 0.06 -0.24 -0.15 0.00 -0.84 0.00 0.00 61.79 60.62 1r5k h SER 512 Cb 0.25 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1r5k h SER 512 CO -0.00 0.97 -0.49 -0.74 -1.14 0.00 0.00 176.83 175.43 1r5k h HIS 513 N 0.96 0.65 -0.52 3.45 -0.00 -0.62 -2.20 115.15 116.88 1r5k h HIS 513 Ca 0.20 -0.21 -0.07 0.00 -0.00 0.00 0.00 60.37 60.29 1r5k h HIS 513 Cb 0.37 -0.13 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 1r5k h HIS 513 CO 0.03 0.92 0.05 0.82 -0.00 0.00 0.00 177.93 179.74 1r5k h ILE 514 N 0.42 1.26 -0.75 6.26 2.04 -1.01 0.06 117.51 125.79 1r5k h ILE 514 Ca 0.02 -1.01 0.06 0.00 1.00 0.00 0.00 64.86 64.93 1r5k h ILE 514 Cb 1.00 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 37.93 1r5k h ILE 514 CO 0.09 0.36 0.44 -0.09 0.00 0.00 0.00 178.15 178.95 1r5k h ARG 515 N 0.75 0.78 -0.27 2.37 9.65 -1.15 -1.51 114.38 125.01 1r5k h ARG 515 Ca 0.15 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.98 1r5k h ARG 515 Cb 0.45 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.85 1r5k h ARG 515 CO 0.02 0.51 0.14 1.25 2.80 0.00 0.00 179.97 184.69 1r5k h HIS 516 N 0.80 0.37 -0.50 2.20 2.76 -0.82 -0.69 115.15 119.26 1r5k h HIS 516 Ca 0.33 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.53 1r5k h HIS 516 Cb 0.18 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.00 1r5k h HIS 516 CO -0.06 0.32 0.33 0.52 -1.30 0.00 0.00 177.93 177.75 1r5k h MET 517 N 0.31 0.53 -0.22 5.26 2.86 -0.50 -1.50 114.93 121.66 1r5k h MET 517 Ca 0.09 -0.03 -0.11 0.00 -2.06 0.00 0.00 59.70 57.59 1r5k h MET 517 Cb 0.08 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.62 1r5k h MET 517 CO -0.01 0.35 -0.30 1.03 1.06 0.00 0.00 176.91 179.03 1r5k h SER 518 N 0.54 0.65 -0.38 1.22 0.87 -0.88 -0.54 113.55 115.03 1r5k h SER 518 Ca 0.21 -0.51 -0.05 0.00 -1.23 0.00 0.00 61.79 60.21 1r5k h SER 518 Cb 0.14 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 1r5k h SER 518 CO -0.05 1.03 0.08 0.78 -0.53 0.00 0.00 176.83 178.14 1r5k h ASN 519 N 0.29 0.65 -0.13 6.23 -0.26 -0.52 -0.04 115.58 121.80 1r5k h ASN 519 Ca 0.03 -0.11 -0.15 0.00 -0.56 0.00 0.00 56.30 55.50 1r5k h ASN 519 Cb 0.87 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.96 1r5k h ASN 519 CO 0.07 0.66 -0.47 0.11 -1.06 0.00 0.00 177.43 176.75 1r5k h LYS 520 N 0.67 0.68 -0.48 0.81 1.57 -1.22 -2.70 116.57 115.90 1r5k h LYS 520 Ca 0.15 -0.39 -0.08 0.00 -1.87 0.00 0.00 60.65 58.46 1r5k h LYS 520 Cb 0.29 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 1r5k h LYS 520 CO 0.00 1.00 -0.01 0.78 -0.57 0.00 0.00 179.45 180.65 1r5k h GLY 521 N 0.95 0.93 1.59 3.86 0.00 0.32 -1.81 103.07 108.91 1r5k h GLY 521 Ca 0.03 -0.69 -0.09 0.00 0.00 0.00 0.00 47.33 46.58 1r5k h GLY 521 CO 0.10 0.64 -0.22 -0.33 0.00 0.00 0.00 176.54 176.72 1r5k h MET 522 N 0.72 0.48 -0.38 4.80 2.86 -1.03 -1.54 114.93 120.84 1r5k h MET 522 Ca 0.14 -0.17 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 1r5k h MET 522 Cb 0.52 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1r5k h MET 522 CO 0.03 0.68 -0.03 0.93 1.06 0.00 0.00 176.91 179.57 1r5k h GLU 523 N 0.43 0.69 -0.52 1.72 5.08 -1.18 0.64 114.58 121.44 1r5k h GLU 523 Ca 0.07 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 58.07 1r5k h GLU 523 Cb 0.63 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 1r5k h GLU 523 CO 0.04 0.80 -0.15 0.45 -1.00 0.00 0.00 179.01 179.16 1r5k h HIS 524 N 0.50 1.13 -0.17 4.33 3.86 -1.15 -1.79 115.15 121.85 1r5k h HIS 524 Ca 0.10 -0.25 0.01 0.00 -1.16 0.00 0.00 60.37 59.08 1r5k h HIS 524 Cb 0.51 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 1r5k h HIS 524 CO 0.04 1.06 0.09 1.25 0.86 0.00 0.00 177.93 181.24 1r5k h LEU 525 N 0.88 0.14 -1.01 2.43 5.85 -1.19 -1.90 115.31 120.51 1r5k h LEU 525 Ca 0.13 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 1r5k h LEU 525 Cb 0.72 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1r5k h LEU 525 CO 0.05 0.11 -0.34 0.22 -0.34 0.00 0.00 178.44 178.14 1r5k h TYR 526 N 0.19 0.32 0.00 1.25 5.03 -0.67 -2.99 116.97 120.10 1r5k h TYR 526 Ca 0.07 -0.07 -0.11 0.00 2.58 0.00 0.00 58.73 61.19 1r5k h TYR 526 Cb 0.01 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.20 1r5k h TYR 526 CO -0.09 0.59 -0.73 0.66 -1.32 0.00 0.00 178.16 177.27 1r5k h SER 527 N 0.24 0.00 1.28 -2.11 4.64 -1.11 -3.26 113.55 113.23 1r5k h SER 527 Ca 0.03 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.22 1r5k h SER 527 Cb 0.72 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.79 1r5k h SER 527 CO 0.05 0.48 -0.60 0.24 -0.87 0.00 0.00 176.83 176.14 1r5k h MET 528 N 0.00 0.00 -5.89 4.77 2.86 -1.21 -3.46 114.93 112.00 1r5k h MET 528 Ca -0.04 0.00 -0.66 0.00 -2.06 0.00 0.00 59.70 56.93 1r5k h MET 528 Cb 1.40 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.96 1r5k h MET 528 CO 0.05 0.60 -0.56 -1.59 1.06 0.00 0.00 176.91 176.47 1r5k s LYS 529 N -3.01 3.17 0.65 1.72 0.00 -1.14 -5.08 119.74 116.05 1r5k s LYS 529 Ca 0.03 -0.37 -0.14 0.00 0.00 0.00 0.00 55.97 55.49 1r5k s LYS 529 Cb 0.09 -2.94 -0.01 0.00 0.00 0.00 0.00 37.83 34.97 1r5k s LYS 529 CO 0.75 0.70 1.08 0.00 0.00 0.00 0.00 175.35 177.87 1r5k n LYS 531 N -2.50 0.25 0.03 0.00 0.00 -1.26 -2.49 118.16 112.18 1r5k n LYS 531 Ca 0.09 0.24 0.02 0.00 0.00 0.00 0.00 58.31 58.66 1r5k n LYS 531 Cb 0.53 -1.81 0.10 0.00 0.00 0.00 0.00 35.03 33.85 1r5k n LYS 531 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1r5k n ASN 532 N -2.25 0.10 -4.26 3.14 3.02 -1.26 -4.67 115.26 109.09 1r5k n ASN 532 Ca 0.05 0.47 -0.34 0.00 -0.03 0.00 0.00 54.58 54.73 1r5k n ASN 532 Cb 0.40 -0.48 -0.15 0.00 -0.61 0.00 0.00 39.78 38.95 1r5k n ASN 532 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1r5k s VAL 533 N -2.97 3.01 -0.31 2.41 1.01 -1.04 -5.07 120.40 117.45 1r5k s VAL 533 Ca -0.00 -0.62 -0.29 0.00 0.00 0.00 0.00 61.98 61.06 1r5k s VAL 533 Cb 0.01 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1r5k s VAL 533 CO 0.03 0.45 1.20 -0.69 0.00 0.00 0.00 175.10 176.09 1r5k s VAL 534 N 1.43 4.30 0.74 2.92 1.01 -1.26 -4.98 120.40 124.56 1r5k s VAL 534 Ca 0.05 1.48 -0.12 0.00 0.00 0.00 0.00 61.98 63.39 1r5k s VAL 534 Cb -0.14 -4.28 0.04 0.00 0.00 0.00 0.00 36.38 32.01 1r5k s VAL 534 CO -0.06 -0.49 1.11 -2.16 0.00 0.00 0.00 175.10 173.50 1r5k s PRO 535 N 3.94 2.35 0.32 2.72 0.04 -1.26 -4.79 135.00 138.31 1r5k s PRO 535 Ca 0.51 1.30 0.01 0.00 0.04 0.00 0.00 61.00 62.86 1r5k s PRO 535 Cb -0.15 -1.90 0.57 0.00 0.04 0.00 0.00 34.50 33.06 1r5k s PRO 535 CO 0.20 -1.59 1.93 1.25 0.04 0.00 0.00 177.00 178.83 1r5k h LEU 536 N -0.76 0.85 -0.24 -3.56 6.46 -1.99 -1.70 115.31 114.38 1r5k h LEU 536 Ca -0.45 -0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.32 1r5k h LEU 536 Cb 1.24 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.97 1r5k h LEU 536 CO 0.51 0.56 0.14 0.10 -0.62 0.00 0.00 178.44 179.14 1r5k h TYR 537 N 0.98 0.26 -0.12 1.25 -0.00 -1.98 0.24 116.97 117.59 1r5k h TYR 537 Ca 0.35 0.01 0.05 0.00 0.00 0.00 0.00 58.73 59.14 1r5k h TYR 537 Cb 0.15 -0.08 -0.06 0.00 0.00 0.00 0.00 36.73 36.73 1r5k h TYR 537 CO -0.00 0.16 -0.32 -0.44 -0.00 0.00 0.00 178.16 177.55 1r5k h ASP 538 N 0.29 -1.00 -0.98 0.10 3.32 -1.75 -0.75 116.42 115.64 1r5k h ASP 538 Ca 0.09 0.15 0.18 0.00 0.02 0.00 0.00 57.03 57.47 1r5k h ASP 538 Cb -0.01 0.42 -0.09 0.00 0.22 0.00 0.00 39.33 39.87 1r5k h ASP 538 CO -0.04 -0.36 0.61 -0.07 -1.72 0.00 0.00 179.24 177.66 1r5k h LEU 539 N -0.40 0.72 -0.08 1.55 3.38 -0.84 -0.86 115.31 118.79 1r5k h LEU 539 Ca 0.09 0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.93 1r5k h LEU 539 Cb 0.55 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.26 1r5k h LEU 539 CO -0.35 0.28 -0.77 0.25 0.09 0.00 0.00 178.44 177.94 1r5k h LEU 540 N 0.71 0.81 -0.07 1.67 5.85 -0.18 -2.84 115.31 121.26 1r5k h LEU 540 Ca 0.55 -0.68 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1r5k h LEU 540 Cb 0.91 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 1r5k h LEU 540 CO -0.32 1.37 -0.04 -0.07 -0.34 0.00 0.00 178.44 179.04 1r5k h LEU 541 N 0.31 0.15 -1.11 2.25 4.07 -0.51 -1.51 115.31 118.96 1r5k h LEU 541 Ca -0.07 -0.43 0.29 0.00 0.08 0.00 0.00 57.88 57.75 1r5k h LEU 541 Cb 1.42 -0.04 -0.12 0.00 1.08 0.00 0.00 40.66 42.99 1r5k h LEU 541 CO 0.16 0.54 0.62 -0.33 -1.08 0.00 0.00 178.44 178.35 1r5k h GLU 542 N -0.24 0.42 0.00 1.13 5.08 -1.22 -1.56 114.58 118.19 1r5k h GLU 542 Ca 0.01 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.19 1r5k h GLU 542 Cb 0.49 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.66 1r5k h GLU 542 CO 0.01 0.28 -0.61 1.98 -1.00 0.00 0.00 179.01 179.66 1r5k h MET 543 N 0.43 0.41 -0.07 2.33 4.05 -1.24 -2.88 114.93 117.96 1r5k h MET 543 Ca 0.67 -0.45 0.02 0.00 -0.28 0.00 0.00 59.70 59.67 1r5k h MET 543 Cb 1.52 0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 32.44 1r5k h MET 543 CO -0.47 1.11 0.29 1.25 0.23 0.00 0.00 176.91 179.33 1r5k h LEU 544 N -0.10 0.00 -0.98 3.39 5.85 -0.29 -3.52 115.31 119.66 1r5k h LEU 544 Ca -0.08 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1r5k h LEU 544 Cb 1.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.36 1r5k h LEU 544 CO 0.12 0.00 0.00 -0.67 -0.34 0.00 0.00 178.44 177.55