#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l2i h LEU 306 N 0.00 0.00 -1.96 2.46 5.85 -2.00 -3.28 115.31 116.38 1l2i h LEU 306 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1l2i h LEU 306 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1l2i h LEU 306 CO 0.00 0.58 -0.00 0.00 -0.34 0.00 0.00 178.44 178.67 1l2i h ALA 307 N 1.42 1.97 0.00 1.25 0.00 -1.98 -2.82 119.26 119.10 1l2i h ALA 307 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1l2i h ALA 307 Cb 1.25 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1l2i h ALA 307 CO 0.07 0.03 -0.00 -0.07 0.00 0.00 0.00 179.25 179.28 1l2i h LEU 308 N 0.02 0.00 0.00 0.00 3.38 -1.96 -2.96 115.31 113.79 1l2i h LEU 308 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1l2i h LEU 308 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1l2i h LEU 308 CO 0.00 0.00 -0.72 -1.54 0.09 0.00 0.00 178.44 176.27 1l2i n SER 309 N -3.09 0.67 -4.75 -0.43 3.41 -1.06 -4.95 113.62 103.41 1l2i n SER 309 Ca 0.00 -0.46 -0.37 0.00 -0.26 0.00 0.00 58.87 57.78 1l2i n SER 309 Cb 0.27 0.55 0.04 0.00 -0.26 0.00 0.00 64.21 64.81 1l2i n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1l2i s LEU 310 N -3.14 3.73 0.78 1.04 1.02 -1.12 -5.02 118.68 115.97 1l2i s LEU 310 Ca 0.09 2.58 -0.08 0.00 0.02 0.00 0.00 54.13 56.74 1l2i s LEU 310 Cb 0.17 -4.46 0.11 0.00 0.02 0.00 0.00 46.19 42.03 1l2i s LEU 310 CO 0.76 -1.65 1.10 0.42 0.02 0.00 0.00 176.35 177.01 1l2i s THR 311 N -1.43 2.16 0.22 5.49 -4.23 -1.26 -4.86 115.64 111.73 1l2i s THR 311 Ca 0.76 -0.26 -0.06 0.00 -1.18 0.00 0.00 61.69 60.95 1l2i s THR 311 Cb -0.36 -2.90 0.13 0.00 1.34 0.00 0.00 72.50 70.71 1l2i s THR 311 CO 0.40 0.00 1.75 0.00 -0.54 0.00 0.00 174.62 176.23 1l2i h ALA 312 N -0.89 1.02 -0.57 3.99 0.00 -1.95 -0.65 119.26 120.21 1l2i h ALA 312 Ca -0.43 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.17 1l2i h ALA 312 Cb 1.28 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1l2i h ALA 312 CO 0.50 0.64 0.06 -0.44 0.00 0.00 0.00 179.25 180.01 1l2i h ASP 313 N 1.02 0.94 -0.14 0.00 3.45 -1.96 -1.57 116.42 118.16 1l2i h ASP 313 Ca 0.21 -0.28 -0.12 0.00 0.43 0.00 0.00 57.03 57.27 1l2i h ASP 313 Cb 0.35 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.86 1l2i h ASP 313 CO 0.00 0.98 -0.32 1.56 -1.57 0.00 0.00 179.24 179.90 1l2i h GLN 314 N 0.86 0.63 0.01 3.56 4.20 -1.88 -1.57 115.11 120.92 1l2i h GLN 314 Ca 0.17 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1l2i h GLN 314 Cb 0.47 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1l2i h GLN 314 CO 0.02 0.86 -0.01 1.98 -0.67 0.00 0.00 178.83 181.02 1l2i h MET 315 N 0.53 -0.02 -0.43 1.46 4.05 -0.86 -0.41 114.93 119.27 1l2i h MET 315 Ca 0.06 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.50 1l2i h MET 315 Cb 0.81 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.58 1l2i h MET 315 CO 0.07 0.04 0.27 0.28 0.23 0.00 0.00 176.91 177.79 1l2i h VAL 316 N -0.07 1.07 -0.48 -5.77 2.07 -1.16 -1.41 116.25 110.50 1l2i h VAL 316 Ca -0.00 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.34 1l2i h VAL 316 Cb 0.06 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1l2i h VAL 316 CO 0.00 0.10 0.32 0.28 0.02 0.00 0.00 177.57 178.29 1l2i h SER 317 N 0.54 0.55 -0.10 0.57 0.02 -1.14 0.11 113.55 114.11 1l2i h SER 317 Ca 0.17 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.11 1l2i h SER 317 Cb -0.02 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1l2i h SER 317 CO -0.06 0.40 0.03 0.00 -1.14 0.00 0.00 176.83 176.05 1l2i h ALA 318 N 1.18 0.10 -0.57 3.77 0.00 -0.78 -0.77 119.26 122.19 1l2i h ALA 318 Ca 0.18 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1l2i h ALA 318 Cb -0.07 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1l2i h ALA 318 CO -0.04 -0.43 0.30 -0.07 0.00 0.00 0.00 179.25 179.00 1l2i h LEU 319 N 0.08 0.73 -0.68 0.00 3.38 -0.96 -2.02 115.31 115.84 1l2i h LEU 319 Ca 0.04 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1l2i h LEU 319 Cb 0.02 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1l2i h LEU 319 CO -0.05 0.63 0.35 -0.07 0.09 0.00 0.00 178.44 179.39 1l2i h LEU 320 N 0.77 0.87 -1.45 1.67 3.38 -0.59 -2.76 115.31 117.20 1l2i h LEU 320 Ca 0.20 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1l2i h LEU 320 Cb 0.08 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1l2i h LEU 320 CO -0.03 0.73 -0.16 0.44 0.09 0.00 0.00 178.44 179.52 1l2i h ASP 321 N 0.93 0.00 0.53 -0.43 3.32 -0.88 -2.72 116.42 117.18 1l2i h ASP 321 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1l2i h ASP 321 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1l2i h ASP 321 CO -0.03 0.16 -0.21 0.00 -1.72 0.00 0.00 179.24 177.43 1l2i n ALA 322 N -2.22 2.93 -1.62 3.45 0.00 -0.78 -4.93 120.51 117.34 1l2i n ALA 322 Ca -0.00 -0.27 -0.49 0.00 0.00 0.00 0.00 53.44 52.68 1l2i n ALA 322 Cb 0.35 -1.28 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 1l2i n ALA 322 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1l2i n GLU 323 N -1.21 1.52 -1.53 0.00 -0.58 -1.03 -4.66 120.64 113.16 1l2i n GLU 323 Ca 0.10 0.55 -0.30 0.00 -0.42 0.00 0.00 57.16 57.09 1l2i n GLU 323 Cb 0.32 -2.21 0.09 0.00 -0.57 0.00 0.00 31.44 29.07 1l2i n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1l2i s PRO 324 N 0.41 2.15 0.64 3.49 0.04 -1.26 -5.04 135.00 135.43 1l2i s PRO 324 Ca 0.80 0.70 -0.10 0.00 0.04 0.00 0.00 61.00 62.44 1l2i s PRO 324 Cb -0.83 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 31.78 1l2i s PRO 324 CO 0.45 -1.59 1.02 -1.25 0.04 0.00 0.00 177.00 175.67 1l2i s PRO 325 N -5.12 3.19 -0.19 0.56 0.04 -1.26 -5.03 135.00 127.19 1l2i s PRO 325 Ca 0.61 0.48 -0.24 0.00 0.04 0.00 0.00 61.00 61.88 1l2i s PRO 325 Cb -0.15 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 1l2i s PRO 325 CO 0.54 -0.75 0.77 0.42 0.04 0.00 0.00 177.00 178.02 1l2i s ILE 326 N -3.19 4.91 0.30 0.56 -1.09 -1.26 -5.04 121.20 116.38 1l2i s ILE 326 Ca 0.56 1.50 0.00 0.00 -2.23 0.00 0.00 60.65 60.47 1l2i s ILE 326 Cb -0.11 -4.08 -0.04 0.00 -1.58 0.00 0.00 42.46 36.66 1l2i s ILE 326 CO 0.51 0.04 0.49 -0.76 -1.23 0.00 0.00 174.94 173.99 1l2i s LEU 327 N 2.18 4.10 0.08 2.97 1.43 -1.26 -5.03 118.68 123.15 1l2i s LEU 327 Ca 0.35 0.41 0.02 0.00 -1.03 0.00 0.00 54.13 53.87 1l2i s LEU 327 Cb -0.16 -3.24 -0.04 0.00 0.03 0.00 0.00 46.19 42.78 1l2i s LEU 327 CO 0.11 -0.20 0.17 -0.31 0.23 0.00 0.00 176.35 176.35 1l2i s TYR 328 N -2.16 3.38 0.62 0.29 2.02 -1.26 -4.36 117.35 115.89 1l2i s TYR 328 Ca 0.39 0.16 -0.12 0.00 -0.37 0.00 0.00 57.07 57.14 1l2i s TYR 328 Cb -0.10 -1.69 -0.04 0.00 -0.40 0.00 0.00 41.96 39.74 1l2i s TYR 328 CO 0.33 0.55 1.03 0.45 -1.57 0.00 0.00 175.55 176.35 1l2i s SER 329 N -2.59 6.17 0.54 2.29 0.15 -1.26 -4.97 113.70 114.02 1l2i s SER 329 Ca 0.33 1.46 -0.22 0.00 0.70 0.00 0.00 55.95 58.22 1l2i s SER 329 Cb -0.12 -2.48 -0.05 0.00 -1.71 0.00 0.00 66.02 61.66 1l2i s SER 329 CO 0.26 -0.91 1.38 -1.61 1.20 0.00 0.00 173.24 173.55 1l2i s GLU 330 N -5.05 3.16 0.38 5.44 2.02 -1.26 -4.95 118.70 118.44 1l2i s GLU 330 Ca 0.56 2.28 -0.16 0.00 0.02 0.00 0.00 54.97 57.67 1l2i s GLU 330 Cb -0.11 -2.29 -0.09 0.00 0.10 0.00 0.00 34.13 31.74 1l2i s GLU 330 CO 0.52 -1.19 0.81 1.52 0.02 0.00 0.00 175.26 176.94 1l2i s TYR 331 N -1.28 3.38 0.00 1.61 1.13 -1.26 -5.05 117.35 115.88 1l2i s TYR 331 Ca 0.71 1.30 0.00 0.00 -1.41 0.00 0.00 57.07 57.67 1l2i s TYR 331 Cb -0.41 -2.62 0.00 0.00 -1.10 0.00 0.00 41.96 37.83 1l2i s TYR 331 CO 0.49 -0.03 0.00 -0.25 -2.51 0.00 0.00 175.55 173.26 1l2i n ASP 332 N -0.70 0.00 -0.12 -0.18 10.43 -1.26 -5.07 116.55 119.65 1l2i n ASP 332 Ca 0.04 0.00 -0.08 0.00 2.57 0.00 0.00 54.79 57.33 1l2i n ASP 332 Cb 0.54 0.00 0.08 0.00 1.84 0.00 0.00 41.12 43.58 1l2i n ASP 332 CO 0.00 0.00 0.00 -0.65 -1.07 0.00 0.00 177.20 175.48 1l2i h PRO 333 N 0.00 0.86 -6.02 -0.24 0.11 -2.01 -3.45 132.00 121.24 1l2i h PRO 333 Ca 0.00 -0.31 -0.81 0.00 0.11 0.00 0.00 66.00 64.99 1l2i h PRO 333 Cb 0.00 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 1l2i h PRO 333 CO 0.00 0.94 0.95 0.25 -0.21 0.00 0.00 178.00 179.93 1l2i n THR 334 N -4.15 0.06 -4.15 -1.15 -2.24 -1.26 -4.97 114.28 96.43 1l2i n THR 334 Ca 0.01 -0.02 -0.15 0.00 -2.27 0.00 0.00 64.05 61.62 1l2i n THR 334 Cb 0.39 -0.68 -0.14 0.00 -2.10 0.00 0.00 70.33 67.80 1l2i n THR 334 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1l2i s ARG 335 N 4.13 0.48 0.69 -0.78 1.81 -1.26 -4.57 118.95 119.44 1l2i s ARG 335 Ca 1.09 -0.36 -0.11 0.00 -1.72 0.00 0.00 55.73 54.62 1l2i s ARG 335 Cb -1.39 -0.41 0.16 0.00 -0.45 0.00 0.00 34.95 32.85 1l2i s ARG 335 CO 0.73 0.10 0.93 -0.35 -0.68 0.00 0.00 175.30 176.04 1l2i n PRO 336 N 2.52 -0.84 -2.87 3.54 -0.04 -1.26 -5.16 135.00 130.89 1l2i n PRO 336 Ca -0.16 -1.52 -0.23 0.00 -0.04 0.00 0.00 63.50 61.56 1l2i n PRO 336 Cb 0.57 -0.94 0.02 0.00 -0.04 0.00 0.00 33.50 33.11 1l2i n PRO 336 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1l2i s PHE 337 N -3.00 3.14 0.48 0.54 0.40 -1.26 -5.09 117.98 113.19 1l2i s PHE 337 Ca 0.53 0.21 0.08 0.00 -0.60 0.00 0.00 56.93 57.15 1l2i s PHE 337 Cb -0.02 -2.44 0.03 0.00 0.51 0.00 0.00 43.02 41.11 1l2i s PHE 337 CO 0.37 -0.51 0.59 -1.54 0.70 0.00 0.00 175.22 174.84 1l2i s SER 338 N -4.27 5.25 0.22 1.36 1.04 -1.26 -4.90 113.70 111.14 1l2i s SER 338 Ca 0.51 -0.71 -0.08 0.00 0.48 0.00 0.00 55.95 56.14 1l2i s SER 338 Cb -0.10 -0.21 0.19 0.00 0.10 0.00 0.00 66.02 65.99 1l2i s SER 338 CO 0.38 -0.97 1.87 -0.08 0.98 0.00 0.00 173.24 175.42 1l2i h GLU 339 N 0.57 1.15 -0.06 4.02 4.81 -1.99 -1.85 114.58 121.23 1l2i h GLU 339 Ca -0.37 -0.11 -0.23 0.00 -0.13 0.00 0.00 59.36 58.53 1l2i h GLU 339 Cb 1.28 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 30.43 1l2i h GLU 339 CO 0.47 0.81 -0.89 0.00 -0.73 0.00 0.00 179.01 178.67 1l2i h ALA 340 N 1.27 0.31 -0.40 2.92 0.00 -1.95 -2.61 119.26 118.80 1l2i h ALA 340 Ca 0.30 -0.66 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 1l2i h ALA 340 Cb -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1l2i h ALA 340 CO -0.06 0.73 -0.14 0.66 0.00 0.00 0.00 179.25 180.44 1l2i h SER 341 N 0.39 0.81 -0.29 0.00 4.64 -1.91 0.80 113.55 117.99 1l2i h SER 341 Ca -0.08 -0.38 -0.04 0.00 -0.47 0.00 0.00 61.79 60.82 1l2i h SER 341 Cb 1.52 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 1l2i h SER 341 CO 0.17 1.01 0.03 -0.03 -0.87 0.00 0.00 176.83 177.14 1l2i h MET 342 N 0.61 0.49 0.00 4.77 -1.53 -1.41 -0.86 114.93 116.99 1l2i h MET 342 Ca 0.10 -0.14 -0.07 0.00 -3.44 0.00 0.00 59.70 56.15 1l2i h MET 342 Cb 0.68 -0.05 -0.01 0.00 -0.55 0.00 0.00 31.60 31.67 1l2i h MET 342 CO 0.05 0.61 -0.33 0.52 0.14 0.00 0.00 176.91 177.90 1l2i h MET 343 N 0.30 0.00 -0.38 0.39 2.07 -1.41 -1.08 114.93 114.82 1l2i h MET 343 Ca 0.09 0.00 -0.08 0.00 -2.07 0.00 0.00 59.70 57.63 1l2i h MET 343 Cb 0.37 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.09 1l2i h MET 343 CO 0.01 0.33 -0.08 0.78 1.07 0.00 0.00 176.91 179.02 1l2i h GLY 344 N 1.10 0.78 0.85 8.32 0.00 -0.42 -1.34 103.07 112.37 1l2i h GLY 344 Ca -0.00 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 46.64 1l2i h GLY 344 CO 0.04 0.58 -0.05 1.41 0.00 0.00 0.00 176.54 178.53 1l2i h LEU 345 N 0.53 0.48 -0.60 3.11 3.38 -0.72 -2.59 115.31 118.89 1l2i h LEU 345 Ca 0.10 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.63 1l2i h LEU 345 Cb 0.59 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1l2i h LEU 345 CO 0.04 0.72 0.06 -0.07 0.09 0.00 0.00 178.44 179.28 1l2i h LEU 346 N 0.23 0.99 -0.57 1.67 3.38 -1.18 -2.05 115.31 117.77 1l2i h LEU 346 Ca 0.07 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.60 1l2i h LEU 346 Cb 0.51 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1l2i h LEU 346 CO 0.02 1.02 -0.65 0.71 0.09 0.00 0.00 178.44 179.64 1l2i h THR 347 N 0.92 1.39 -0.58 0.22 1.35 -1.30 -0.45 112.91 114.47 1l2i h THR 347 Ca 0.18 -2.06 -0.07 0.00 -0.55 0.00 0.00 66.41 63.91 1l2i h THR 347 Cb 0.47 2.05 -0.02 0.00 -1.73 0.00 0.00 68.15 68.92 1l2i h THR 347 CO 0.02 0.61 0.07 -1.13 -0.25 0.00 0.00 175.52 174.84 1l2i h ASN 348 N 0.20 0.94 -0.14 5.36 -0.73 -1.35 -0.77 115.58 119.09 1l2i h ASN 348 Ca -0.01 -0.27 -0.03 0.00 1.87 0.00 0.00 56.30 57.85 1l2i h ASN 348 Cb 1.17 -0.25 -0.00 0.00 0.27 0.00 0.00 38.32 39.51 1l2i h ASN 348 CO 0.10 0.98 -0.05 0.25 -0.37 0.00 0.00 177.43 178.34 1l2i h LEU 349 N 0.87 0.28 -0.65 0.34 5.85 -1.24 -2.67 115.31 118.10 1l2i h LEU 349 Ca 0.17 -0.39 0.06 0.00 0.84 0.00 0.00 57.88 58.56 1l2i h LEU 349 Cb 0.45 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 1l2i h LEU 349 CO 0.02 0.61 0.35 0.00 -0.34 0.00 0.00 178.44 179.08 1l2i h ALA 350 N 0.69 0.86 -0.89 1.25 0.00 -0.98 0.26 119.26 120.44 1l2i h ALA 350 Ca 0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1l2i h ALA 350 Cb 0.49 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1l2i h ALA 350 CO 0.02 0.03 0.57 0.22 0.00 0.00 0.00 179.25 180.08 1l2i h ASP 351 N 0.66 1.05 0.10 0.00 3.58 -1.08 -0.32 116.42 120.40 1l2i h ASP 351 Ca 0.29 -0.05 -0.18 0.00 0.42 0.00 0.00 57.03 57.51 1l2i h ASP 351 Cb 0.18 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 40.96 1l2i h ASP 351 CO -0.18 0.78 -0.67 0.03 -2.88 0.00 0.00 179.24 176.33 1l2i h ARG 352 N 1.22 0.53 -0.39 0.28 3.08 -1.05 -3.10 114.38 114.95 1l2i h ARG 352 Ca 0.32 -0.39 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 1l2i h ARG 352 Cb -0.10 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1l2i h ARG 352 CO -0.07 1.01 -0.02 0.93 -1.07 0.00 0.00 179.97 180.76 1l2i h GLU 353 N 0.38 0.62 -0.81 0.04 5.08 -0.44 -2.78 114.58 116.66 1l2i h GLU 353 Ca -0.02 -0.15 0.02 0.00 -1.00 0.00 0.00 59.36 58.21 1l2i h GLU 353 Cb 1.24 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.36 1l2i h GLU 353 CO 0.12 0.66 0.54 -0.07 -1.00 0.00 0.00 179.01 179.26 1l2i h LEU 354 N 0.59 0.91 -0.46 1.33 3.38 -0.99 0.42 115.31 120.48 1l2i h LEU 354 Ca 0.12 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1l2i h LEU 354 Cb 0.40 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1l2i h LEU 354 CO 0.02 0.65 0.25 0.58 0.09 0.00 0.00 178.44 180.02 1l2i h VAL 355 N 1.07 1.17 -0.12 1.22 2.07 -1.51 -1.54 116.25 118.59 1l2i h VAL 355 Ca 0.31 -0.43 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 1l2i h VAL 355 Cb -0.06 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1l2i h VAL 355 CO -0.08 0.17 -0.41 0.45 0.02 0.00 0.00 177.57 177.73 1l2i h HIS 356 N 0.60 0.32 -0.63 1.57 3.86 -1.43 -2.88 115.15 116.56 1l2i h HIS 356 Ca 0.16 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 1l2i h HIS 356 Cb 0.06 -0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.43 1l2i h HIS 356 CO -0.02 0.64 0.27 1.98 0.86 0.00 0.00 177.93 181.67 1l2i h MET 357 N 0.23 0.94 -0.40 2.45 -1.53 -0.44 0.61 114.93 116.79 1l2i h MET 357 Ca 0.02 -0.16 0.01 0.00 -3.44 0.00 0.00 59.70 56.13 1l2i h MET 357 Cb 0.82 -0.16 -0.02 0.00 -0.55 0.00 0.00 31.60 31.69 1l2i h MET 357 CO 0.06 0.78 0.26 0.82 0.14 0.00 0.00 176.91 178.97 1l2i h ILE 358 N 0.88 1.09 -0.05 1.77 2.04 -1.11 0.82 117.51 122.96 1l2i h ILE 358 Ca 0.21 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.80 1l2i h ILE 358 Cb 0.18 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1l2i h ILE 358 CO -0.02 0.10 -0.41 0.78 0.00 0.00 0.00 178.15 178.60 1l2i h ASN 359 N 0.53 0.10 -0.34 1.72 4.21 -1.28 -2.68 115.58 117.83 1l2i h ASN 359 Ca 0.15 -0.04 -0.05 0.00 1.21 0.00 0.00 56.30 57.57 1l2i h ASN 359 Cb -0.05 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.11 1l2i h ASN 359 CO -0.04 0.50 0.02 -0.25 -1.29 0.00 0.00 177.43 176.37 1l2i h TRP 360 N 0.08 0.64 -0.87 1.19 7.01 -0.28 -3.06 115.95 120.67 1l2i h TRP 360 Ca 0.01 -0.10 0.06 0.00 2.11 0.00 0.00 58.89 60.96 1l2i h TRP 360 Cb 0.76 -0.17 -0.06 0.00 -2.10 0.00 0.00 29.16 27.59 1l2i h TRP 360 CO 0.01 0.69 0.54 0.00 -2.79 0.00 0.00 178.44 176.88 1l2i h ALA 361 N 0.87 1.19 0.00 2.65 0.00 -0.57 -0.65 119.26 122.75 1l2i h ALA 361 Ca 0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1l2i h ALA 361 Cb 0.42 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1l2i h ALA 361 CO 0.01 0.28 -0.01 0.87 0.00 0.00 0.00 179.25 180.41 1l2i h LYS 362 N 0.98 0.00 -0.26 0.00 1.57 -1.38 -0.76 116.57 116.72 1l2i h LYS 362 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1l2i h LYS 362 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1l2i h LYS 362 CO -0.17 0.01 0.00 0.54 -0.57 0.00 0.00 179.45 179.25 1l2i n ARG 363 N -3.27 2.24 -2.84 3.15 1.74 -0.27 -4.46 116.66 112.95 1l2i n ARG 363 Ca -0.03 -1.86 -0.42 0.00 -0.77 0.00 0.00 57.85 54.77 1l2i n ARG 363 Cb 0.11 -1.47 -0.04 0.00 -1.02 0.00 0.00 32.46 30.04 1l2i n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1l2i s VAL 364 N -1.68 4.74 -0.39 1.55 1.01 -0.29 -4.80 120.40 120.54 1l2i s VAL 364 Ca 0.35 1.47 -0.43 0.00 0.00 0.00 0.00 61.98 63.37 1l2i s VAL 364 Cb 0.21 -4.21 -0.17 0.00 0.00 0.00 0.00 36.38 32.21 1l2i s VAL 364 CO 0.30 -0.24 1.75 -2.65 0.00 0.00 0.00 175.10 174.26 1l2i n PRO 365 N 6.30 0.60 0.00 2.72 -0.02 -1.26 -1.11 135.00 142.23 1l2i n PRO 365 Ca 0.07 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1l2i n PRO 365 Cb 0.48 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1l2i n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l2i n GLY 366 N 4.56 3.44 0.21 -1.23 0.00 -1.26 -4.92 105.19 105.99 1l2i n GLY 366 Ca 0.32 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.21 1l2i n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1l2i h PHE 367 N 0.00 0.83 0.00 1.61 3.04 -1.40 -2.95 116.94 118.07 1l2i h PHE 367 Ca 0.00 -0.23 0.00 0.00 3.98 0.00 0.00 57.97 61.72 1l2i h PHE 367 Cb 0.00 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.33 1l2i h PHE 367 CO 0.00 0.96 0.00 -0.39 -2.02 0.00 0.00 178.31 176.86 1l2i h VAL 368 N 0.46 0.00 0.00 1.41 -1.51 -1.78 -2.20 116.25 112.63 1l2i h VAL 368 Ca 0.06 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 1l2i h VAL 368 Cb 0.78 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 1l2i h VAL 368 CO 0.06 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.87 1l2i n ASP 369 N -2.85 0.29 -4.91 4.19 10.43 -1.11 -4.78 116.55 117.81 1l2i n ASP 369 Ca -0.00 0.55 -0.27 0.00 2.57 0.00 0.00 54.79 57.64 1l2i n ASP 369 Cb 0.22 -0.62 -0.00 0.00 1.84 0.00 0.00 41.12 42.56 1l2i n ASP 369 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1l2i s LEU 370 N -3.60 3.63 0.72 0.64 1.43 -0.83 -5.07 118.68 115.60 1l2i s LEU 370 Ca 0.09 0.91 -0.11 0.00 -1.03 0.00 0.00 54.13 53.99 1l2i s LEU 370 Cb 0.12 -3.86 0.02 0.00 0.03 0.00 0.00 46.19 42.50 1l2i s LEU 370 CO 0.41 -0.58 1.07 0.42 0.23 0.00 0.00 176.35 177.90 1l2i s THR 371 N -2.74 3.71 0.21 5.49 -4.23 -1.26 -4.79 115.64 112.04 1l2i s THR 371 Ca 0.47 0.58 -0.08 0.00 -1.18 0.00 0.00 61.69 61.48 1l2i s THR 371 Cb -0.10 -3.20 0.16 0.00 1.34 0.00 0.00 72.50 70.69 1l2i s THR 371 CO 0.45 -0.70 1.75 0.25 -0.54 0.00 0.00 174.62 175.83 1l2i h LEU 372 N -0.76 0.30 -0.51 4.79 5.85 -1.97 -0.15 115.31 122.86 1l2i h LEU 372 Ca -0.44 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.44 1l2i h LEU 372 Cb 1.22 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.22 1l2i h LEU 372 CO 0.55 0.17 0.12 -0.74 -0.34 0.00 0.00 178.44 178.20 1l2i h HIS 373 N 0.47 0.20 -0.41 1.25 2.76 -1.99 0.33 115.15 117.76 1l2i h HIS 373 Ca 0.32 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.40 1l2i h HIS 373 Cb 0.38 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.32 1l2i h HIS 373 CO -0.15 0.02 -0.22 -0.44 -1.30 0.00 0.00 177.93 175.84 1l2i h ASP 374 N 0.27 0.91 -0.53 3.26 3.45 -1.68 -1.79 116.42 120.30 1l2i h ASP 374 Ca 0.25 -0.41 0.03 0.00 0.43 0.00 0.00 57.03 57.33 1l2i h ASP 374 Cb 0.33 -0.25 -0.04 0.00 -0.56 0.00 0.00 39.33 38.81 1l2i h ASP 374 CO -0.31 1.12 0.31 1.56 -1.57 0.00 0.00 179.24 180.34 1l2i h GLN 375 N 0.70 0.59 -0.32 3.56 4.20 -0.50 -0.96 115.11 122.37 1l2i h GLN 375 Ca 0.09 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 1l2i h GLN 375 Cb 0.79 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.42 1l2i h GLN 375 CO 0.07 0.39 0.19 0.28 -0.67 0.00 0.00 178.83 179.08 1l2i h VAL 376 N 0.60 1.12 -0.33 -0.54 2.07 -0.82 -2.26 116.25 116.08 1l2i h VAL 376 Ca 0.22 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.48 1l2i h VAL 376 Cb 0.06 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1l2i h VAL 376 CO -0.11 0.12 0.19 -0.74 0.02 0.00 0.00 177.57 177.04 1l2i h HIS 377 N 0.41 0.36 -0.26 1.57 -0.00 -0.92 -0.76 115.15 115.56 1l2i h HIS 377 Ca 0.12 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.50 1l2i h HIS 377 Cb 0.02 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.30 1l2i h HIS 377 CO -0.04 0.21 0.16 -0.07 -0.00 0.00 0.00 177.93 178.19 1l2i h LEU 378 N 0.39 0.32 -0.71 0.26 3.38 -1.03 -2.00 115.31 115.91 1l2i h LEU 378 Ca 0.13 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1l2i h LEU 378 Cb 0.01 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1l2i h LEU 378 CO -0.07 0.28 0.21 -0.07 0.09 0.00 0.00 178.44 178.89 1l2i h LEU 379 N 0.33 1.05 -1.10 1.67 3.38 -1.24 -1.19 115.31 118.21 1l2i h LEU 379 Ca 0.09 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1l2i h LEU 379 Cb 0.02 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 1l2i h LEU 379 CO -0.02 0.99 0.47 -0.33 0.09 0.00 0.00 178.44 179.64 1l2i h GLU 380 N 1.06 1.09 0.06 1.13 5.08 -0.95 -0.71 114.58 121.33 1l2i h GLU 380 Ca 0.23 -0.10 -0.24 0.00 -1.00 0.00 0.00 59.36 58.25 1l2i h GLU 380 Cb 0.32 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1l2i h GLU 380 CO -0.00 0.77 -1.07 0.00 -1.00 0.00 0.00 179.01 177.71 1l2i n ALA 382 N -2.50 3.45 -0.34 0.00 0.00 -0.47 -4.71 120.51 115.94 1l2i n ALA 382 Ca -0.06 -0.59 0.09 0.00 0.00 0.00 0.00 53.44 52.87 1l2i n ALA 382 Cb 0.92 -0.69 0.26 0.00 0.00 0.00 0.00 19.45 19.94 1l2i n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1l2i h TRP 383 N 2.03 1.04 -0.04 0.00 5.08 -1.32 -0.90 115.95 121.84 1l2i h TRP 383 Ca 0.00 0.03 -0.23 0.00 1.08 0.00 0.00 58.89 59.77 1l2i h TRP 383 Cb 0.65 -0.32 0.01 0.00 -3.00 0.00 0.00 29.16 26.50 1l2i h TRP 383 CO 0.00 0.33 -0.91 1.25 -1.28 0.00 0.00 178.44 177.82 1l2i h LEU 384 N 0.84 0.72 -0.90 0.11 5.85 -1.87 -1.62 115.31 118.44 1l2i h LEU 384 Ca 0.51 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1l2i h LEU 384 Cb 0.65 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 1l2i h LEU 384 CO -0.32 1.33 0.53 -0.33 -0.34 0.00 0.00 178.44 179.31 1l2i h GLU 385 N 0.35 1.23 -0.45 1.25 5.08 -1.71 0.43 114.58 120.76 1l2i h GLU 385 Ca -0.08 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.04 1l2i h GLU 385 Cb 1.54 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1l2i h GLU 385 CO 0.17 0.87 -0.17 0.82 -1.00 0.00 0.00 179.01 179.70 1l2i h ILE 386 N 1.24 1.27 -0.66 3.13 2.04 -1.12 -0.33 117.51 123.09 1l2i h ILE 386 Ca 0.32 -1.31 -0.08 0.00 1.00 0.00 0.00 64.86 64.79 1l2i h ILE 386 Cb -0.03 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1l2i h ILE 386 CO -0.06 0.45 0.11 -0.07 0.00 0.00 0.00 178.15 178.58 1l2i h LEU 387 N 0.74 1.04 -0.41 1.44 3.38 -0.97 -2.53 115.31 118.01 1l2i h LEU 387 Ca 0.11 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 1l2i h LEU 387 Cb 0.73 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1l2i h LEU 387 CO 0.06 1.03 -0.04 0.24 0.09 0.00 0.00 178.44 179.82 1l2i h MET 388 N 1.01 0.76 0.00 1.13 2.86 -0.72 -1.84 114.93 118.13 1l2i h MET 388 Ca 0.20 -0.26 -0.08 0.00 -2.06 0.00 0.00 59.70 57.50 1l2i h MET 388 Cb 0.43 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1l2i h MET 388 CO 0.01 0.86 -0.36 0.97 1.06 0.00 0.00 176.91 179.45 1l2i h ILE 389 N 0.59 1.04 -0.29 -1.22 2.10 -1.03 -0.25 117.51 118.44 1l2i h ILE 389 Ca 0.11 -1.35 -0.09 0.00 1.08 0.00 0.00 64.86 64.61 1l2i h ILE 389 Cb 0.55 1.78 -0.01 0.00 -1.09 0.00 0.00 36.82 38.04 1l2i h ILE 389 CO 0.03 0.36 -0.19 1.23 -1.08 0.00 0.00 178.15 178.50 1l2i h GLY 390 N 1.51 0.69 0.92 8.18 0.00 -1.24 -1.22 103.07 111.91 1l2i h GLY 390 Ca -0.00 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.65 1l2i h GLY 390 CO 0.05 0.59 0.13 -2.00 0.00 0.00 0.00 176.54 175.31 1l2i h LEU 391 N 0.38 0.48 -1.05 3.11 5.85 -0.94 -2.03 115.31 121.11 1l2i h LEU 391 Ca 0.06 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1l2i h LEU 391 Cb 0.72 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1l2i h LEU 391 CO 0.05 0.54 0.63 0.58 -0.34 0.00 0.00 178.44 179.90 1l2i h VAL 392 N 0.41 1.25 0.27 1.05 2.07 -0.99 -1.82 116.25 118.48 1l2i h VAL 392 Ca 0.11 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1l2i h VAL 392 Cb 0.21 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 1l2i h VAL 392 CO -0.01 0.24 -0.13 -0.25 0.02 0.00 0.00 177.57 177.44 1l2i h TRP 393 N 1.30 -0.33 0.00 1.57 2.91 -0.87 -2.94 115.95 117.59 1l2i h TRP 393 Ca 0.35 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.36 1l2i h TRP 393 Cb -0.15 0.11 0.00 0.00 -0.51 0.00 0.00 29.16 28.61 1l2i h TRP 393 CO 0.00 -0.13 0.00 2.89 -1.03 0.00 0.00 178.44 180.17 1l2i n ARG 394 N -5.20 0.08 0.00 2.65 1.85 -0.80 -2.49 116.66 112.76 1l2i n ARG 394 Ca -0.10 0.24 0.13 0.00 -1.00 0.00 0.00 57.85 57.13 1l2i n ARG 394 Cb 0.20 -1.63 0.46 0.00 -1.05 0.00 0.00 32.46 30.43 1l2i n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1l2i n SER 395 N -1.79 0.50 -0.07 2.89 7.64 -0.70 -4.14 113.62 117.96 1l2i n SER 395 Ca 0.04 -0.34 0.05 0.00 1.01 0.00 0.00 58.87 59.63 1l2i n SER 395 Cb 0.25 -0.01 0.40 0.00 -1.01 0.00 0.00 64.21 63.84 1l2i n SER 395 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1l2i h MET 396 N 0.41 0.60 0.00 1.43 2.86 -1.39 -1.17 114.93 117.68 1l2i h MET 396 Ca 0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1l2i h MET 396 Cb 0.45 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1l2i h MET 396 CO 0.00 0.40 0.00 0.93 1.06 0.00 0.00 176.91 179.30 1l2i h GLU 397 N 0.62 0.00 -2.24 1.72 5.08 -1.81 -3.36 114.58 114.59 1l2i h GLU 397 Ca 0.21 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.96 1l2i h GLU 397 Cb 0.07 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.91 1l2i h GLU 397 CO -0.05 0.00 -0.50 0.72 -1.00 0.00 0.00 179.01 178.17 1l2i n HIS 398 N -2.57 3.58 -1.55 4.33 8.25 -0.44 -5.09 115.22 121.73 1l2i n HIS 398 Ca 0.03 -4.06 -0.50 0.00 -0.26 0.00 0.00 57.72 52.93 1l2i n HIS 398 Cb 0.32 -0.60 -0.04 0.00 1.12 0.00 0.00 29.99 30.79 1l2i n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1l2i n PRO 399 N 0.88 0.91 -0.10 -0.41 -0.02 -1.26 -1.07 135.00 133.93 1l2i n PRO 399 Ca 0.30 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1l2i n PRO 399 Cb 0.40 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1l2i n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l2i n GLY 400 N 1.93 2.00 3.27 -1.23 0.00 -1.26 -5.02 105.19 104.88 1l2i n GLY 400 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 1l2i n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l2i s LYS 401 N -0.27 1.12 -0.25 1.61 1.02 -0.23 -4.32 119.74 118.41 1l2i s LYS 401 Ca 0.00 -1.48 -0.03 0.00 0.02 0.00 0.00 55.97 54.48 1l2i s LYS 401 Cb 0.00 -0.71 0.02 0.00 -0.52 0.00 0.00 37.83 36.61 1l2i s LYS 401 CO 0.00 0.09 -0.03 -0.51 -0.92 0.00 0.00 175.35 173.98 1l2i s LEU 402 N -3.20 3.25 -1.07 3.17 1.43 -0.04 -4.82 118.68 117.40 1l2i s LEU 402 Ca 0.18 -0.75 -0.17 0.00 -1.03 0.00 0.00 54.13 52.37 1l2i s LEU 402 Cb 0.02 -1.72 0.14 0.00 0.03 0.00 0.00 46.19 44.66 1l2i s LEU 402 CO 0.02 -0.12 1.30 -0.22 0.23 0.00 0.00 176.35 177.56 1l2i s LEU 403 N 1.39 4.92 0.28 1.79 2.96 -1.26 -1.44 118.68 127.32 1l2i s LEU 403 Ca 0.02 -2.44 0.01 0.00 -0.22 0.00 0.00 54.13 51.50 1l2i s LEU 403 Cb -0.16 -2.42 0.42 0.00 0.50 0.00 0.00 46.19 44.54 1l2i s LEU 403 CO -0.03 -0.95 1.77 -0.26 -1.32 0.00 0.00 176.35 175.56 1l2i h PHE 404 N 8.10 0.66 -3.10 5.38 -1.00 -1.74 -3.43 116.94 121.82 1l2i h PHE 404 Ca 0.24 -0.10 -0.02 0.00 2.81 0.00 0.00 57.97 60.89 1l2i h PHE 404 Cb 0.95 -0.18 -0.12 0.00 3.61 0.00 0.00 35.95 40.22 1l2i h PHE 404 CO 1.16 0.69 0.14 0.00 -1.61 0.00 0.00 178.31 178.69 1l2i s ALA 405 N -4.80 -1.41 0.53 2.45 0.00 -1.15 -4.92 121.76 112.47 1l2i s ALA 405 Ca -0.08 0.31 0.26 0.00 0.00 0.00 0.00 51.96 52.45 1l2i s ALA 405 Cb 0.14 0.84 1.41 0.00 0.00 0.00 0.00 23.12 25.52 1l2i s ALA 405 CO 0.79 -0.75 1.99 -1.35 0.00 0.00 0.00 175.76 176.45 1l2i h PRO 406 N 2.09 0.00 -0.47 0.00 0.11 -1.88 0.83 132.00 132.68 1l2i h PRO 406 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1l2i h PRO 406 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1l2i h PRO 406 CO 0.40 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.46 1l2i n ASN 407 N -4.34 5.11 -3.05 -2.05 6.94 -1.26 -4.66 115.26 111.96 1l2i n ASN 407 Ca 0.10 -2.96 -0.17 0.00 -0.02 0.00 0.00 54.58 51.53 1l2i n ASN 407 Cb 0.61 -0.64 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 1l2i n ASN 407 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1l2i n LEU 408 N 0.24 -1.54 -4.49 -4.53 7.94 0.28 -4.88 117.00 110.02 1l2i n LEU 408 Ca 0.26 -3.89 -0.42 0.00 -1.11 0.00 0.00 56.01 50.85 1l2i n LEU 408 Cb 1.10 0.69 -0.10 0.00 0.53 0.00 0.00 43.42 45.63 1l2i n LEU 408 CO 0.27 1.96 -0.10 -0.22 -1.11 0.00 0.00 177.39 178.19 1l2i s LEU 409 N -0.24 4.80 0.17 -1.96 2.96 -1.25 -1.87 118.68 121.29 1l2i s LEU 409 Ca 0.33 -0.65 0.06 0.00 -0.22 0.00 0.00 54.13 53.64 1l2i s LEU 409 Cb 0.11 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 1l2i s LEU 409 CO -0.15 -0.34 0.11 -0.76 -1.32 0.00 0.00 176.35 173.89 1l2i s LEU 410 N 1.70 3.70 0.39 -0.68 1.43 -0.52 -4.93 118.68 119.77 1l2i s LEU 410 Ca 0.06 -0.19 0.08 0.00 -1.03 0.00 0.00 54.13 53.04 1l2i s LEU 410 Cb -0.18 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.68 1l2i s LEU 410 CO 0.10 0.07 0.23 1.51 0.23 0.00 0.00 176.35 178.49 1l2i s ASP 411 N -3.12 4.71 0.24 2.29 1.47 -1.26 -0.86 116.67 120.14 1l2i s ASP 411 Ca 0.30 -0.88 -0.04 0.00 1.18 0.00 0.00 52.55 53.11 1l2i s ASP 411 Cb -0.10 -0.59 0.41 0.00 -0.34 0.00 0.00 42.92 42.31 1l2i s ASP 411 CO 0.22 -0.50 1.78 -0.09 0.68 0.00 0.00 175.17 177.26 1l2i h ARG 412 N 1.34 0.64 -0.81 2.11 2.43 -1.97 -1.69 114.38 116.42 1l2i h ARG 412 Ca -0.43 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 58.75 1l2i h ARG 412 Cb 1.26 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 30.61 1l2i h ARG 412 CO 0.64 0.43 0.53 -0.91 -1.51 0.00 0.00 179.97 179.15 1l2i h ASN 413 N 0.66 0.84 0.62 -3.80 2.35 -1.96 0.88 115.58 115.17 1l2i h ASN 413 Ca 0.40 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.14 1l2i h ASN 413 Cb 0.46 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1l2i h ASN 413 CO -0.29 0.56 0.00 0.00 -1.65 0.00 0.00 177.43 176.05 1l2i n GLN 414 N -4.46 0.12 0.23 0.81 6.02 -0.65 -1.79 117.38 117.66 1l2i n GLN 414 Ca 0.11 0.36 0.13 0.00 -0.01 0.00 0.00 57.00 57.59 1l2i n GLN 414 Cb 0.15 -1.72 0.32 0.00 1.02 0.00 0.00 30.24 30.01 1l2i n GLN 414 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1l2i h GLY 415 N 2.30 0.00 -5.34 1.08 0.00 -0.70 -3.41 103.07 97.00 1l2i h GLY 415 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 1l2i h GLY 415 CO 0.00 0.00 3.34 0.28 0.00 0.00 0.00 176.54 180.16 1l2i n LYS 416 N -3.12 3.02 0.00 4.80 5.02 -0.74 -3.03 118.16 124.12 1l2i n LYS 416 Ca 0.03 -2.03 0.00 0.00 -2.02 0.00 0.00 58.31 54.28 1l2i n LYS 416 Cb 0.47 -2.78 0.00 0.00 -0.02 0.00 0.00 35.03 32.70 1l2i n LYS 416 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1l2i n VAL 418 N 4.10 0.00 -1.80 -0.18 0.31 -1.26 -4.94 118.33 114.56 1l2i n VAL 418 Ca 0.64 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 64.56 1l2i n VAL 418 Cb 0.24 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.15 1l2i n VAL 418 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1l2i s GLU 419 N 0.00 4.14 0.00 5.55 -1.05 -1.26 -2.06 118.70 124.01 1l2i s GLU 419 Ca 0.00 2.55 0.00 0.00 -0.15 0.00 0.00 54.97 57.37 1l2i s GLU 419 Cb 0.00 -3.03 0.00 0.00 -0.44 0.00 0.00 34.13 30.66 1l2i s GLU 419 CO 0.00 -0.61 0.00 0.41 0.95 0.00 0.00 175.26 176.01 1l2i n GLY 420 N 2.16 1.96 0.08 -3.83 0.00 -1.26 -4.89 105.19 99.42 1l2i n GLY 420 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1l2i n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1l2i h MET 421 N 2.59 0.05 -0.57 1.61 -1.53 -1.60 -3.35 114.93 112.13 1l2i h MET 421 Ca 0.00 -0.09 0.03 0.00 -3.44 0.00 0.00 59.70 56.20 1l2i h MET 421 Cb 0.00 0.03 -0.03 0.00 -0.55 0.00 0.00 31.60 31.05 1l2i h MET 421 CO 0.00 0.87 0.38 -0.24 0.14 0.00 0.00 176.91 178.05 1l2i h VAL 422 N 0.01 1.07 -0.63 -5.77 3.04 -1.71 -0.28 116.25 111.98 1l2i h VAL 422 Ca -0.14 -0.23 -0.04 0.00 -1.01 0.00 0.00 66.70 65.28 1l2i h VAL 422 Cb 1.90 0.35 -0.03 0.00 -2.01 0.00 0.00 31.29 31.50 1l2i h VAL 422 CO 0.12 0.12 0.21 -0.33 -1.01 0.00 0.00 177.57 176.68 1l2i h GLU 423 N 0.66 0.94 -0.08 4.17 3.07 -1.92 -1.31 114.58 120.11 1l2i h GLU 423 Ca 0.23 -0.17 -0.21 0.00 -0.50 0.00 0.00 59.36 58.70 1l2i h GLU 423 Cb 0.08 -0.15 0.01 0.00 -0.84 0.00 0.00 28.75 27.85 1l2i h GLU 423 CO -0.06 0.80 -0.77 0.82 -1.40 0.00 0.00 179.01 178.39 1l2i h ILE 424 N 0.91 1.31 -0.92 3.13 2.04 -1.43 -2.95 117.51 119.61 1l2i h ILE 424 Ca 0.21 -2.03 0.04 0.00 1.00 0.00 0.00 64.86 64.08 1l2i h ILE 424 Cb 0.24 2.20 -0.06 0.00 -0.74 0.00 0.00 36.82 38.46 1l2i h ILE 424 CO -0.01 0.63 0.60 -0.26 0.00 0.00 0.00 178.15 179.10 1l2i h PHE 425 N 0.34 1.11 -0.56 1.37 0.05 -0.86 -1.42 116.94 116.97 1l2i h PHE 425 Ca -0.07 0.03 -0.08 0.00 3.82 0.00 0.00 57.97 61.67 1l2i h PHE 425 Cb 1.42 -0.37 -0.02 0.00 2.00 0.00 0.00 35.95 38.98 1l2i h PHE 425 CO 0.10 0.63 0.04 -0.44 -0.18 0.00 0.00 178.31 178.47 1l2i h ASP 426 N 1.14 0.89 -0.50 2.17 3.32 -1.23 0.32 116.42 122.53 1l2i h ASP 426 Ca 0.37 -0.21 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 1l2i h ASP 426 Cb 0.03 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1l2i h ASP 426 CO -0.13 0.92 -0.17 0.24 -1.72 0.00 0.00 179.24 178.39 1l2i h MET 427 N 0.87 1.00 -0.49 3.56 2.86 -1.25 -2.00 114.93 119.48 1l2i h MET 427 Ca 0.17 -0.41 -0.05 0.00 -2.06 0.00 0.00 59.70 57.35 1l2i h MET 427 Cb 0.45 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1l2i h MET 427 CO 0.02 1.08 0.09 -0.07 1.06 0.00 0.00 176.91 179.09 1l2i h LEU 428 N 0.86 0.77 -1.04 1.22 3.38 -0.95 -1.85 115.31 117.70 1l2i h LEU 428 Ca 0.12 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1l2i h LEU 428 Cb 0.75 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1l2i h LEU 428 CO 0.06 0.82 0.18 -0.07 0.09 0.00 0.00 178.44 179.53 1l2i h LEU 429 N 0.68 0.81 -0.73 1.67 3.38 -0.86 -1.65 115.31 118.61 1l2i h LEU 429 Ca 0.15 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 1l2i h LEU 429 Cb 0.37 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1l2i h LEU 429 CO 0.01 0.76 -0.37 0.00 0.09 0.00 0.00 178.44 178.93 1l2i h ALA 430 N 1.35 0.90 -0.50 1.53 0.00 -1.15 -1.61 119.26 119.78 1l2i h ALA 430 Ca 0.19 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1l2i h ALA 430 Cb 0.24 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1l2i h ALA 430 CO -0.01 0.63 -0.10 1.15 0.00 0.00 0.00 179.25 180.92 1l2i h THR 431 N 0.46 1.27 -0.55 0.00 2.02 -0.95 -0.68 112.91 114.47 1l2i h THR 431 Ca 0.05 -1.24 -0.04 0.00 0.77 0.00 0.00 66.41 65.95 1l2i h THR 431 Cb 0.85 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 1l2i h THR 431 CO 0.07 0.43 0.17 -1.28 0.37 0.00 0.00 175.52 175.28 1l2i h SER 432 N 0.80 0.81 -0.82 4.18 0.87 -1.18 -0.66 113.55 117.54 1l2i h SER 432 Ca 0.13 -0.21 -0.04 0.00 -1.23 0.00 0.00 61.79 60.44 1l2i h SER 432 Cb 0.66 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.37 1l2i h SER 432 CO 0.05 0.80 0.38 -1.28 -0.53 0.00 0.00 176.83 176.24 1l2i h SER 433 N 0.77 1.10 -0.62 6.23 0.87 -1.09 0.92 113.55 121.73 1l2i h SER 433 Ca 0.18 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1l2i h SER 433 Cb 0.28 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 1l2i h SER 433 CO -0.01 0.94 0.29 -0.09 -0.53 0.00 0.00 176.83 177.43 1l2i h ARG 434 N 1.18 0.91 -0.45 2.24 9.65 -0.64 -0.59 114.38 126.68 1l2i h ARG 434 Ca 0.28 -0.14 -0.14 0.00 -1.10 0.00 0.00 59.98 58.88 1l2i h ARG 434 Cb 0.15 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.56 1l2i h ARG 434 CO -0.03 0.74 -0.27 0.74 2.80 0.00 0.00 179.97 183.95 1l2i h PHE 435 N 0.86 1.12 -0.53 2.20 0.04 -0.73 -2.27 116.94 117.63 1l2i h PHE 435 Ca 0.21 -0.29 -0.01 0.00 2.80 0.00 0.00 57.97 60.68 1l2i h PHE 435 Cb 0.14 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 1l2i h PHE 435 CO 0.00 1.12 0.29 -0.09 -0.60 0.00 0.00 178.31 179.02 1l2i h ARG 436 N 0.82 0.74 -0.04 1.51 2.43 -0.52 -0.90 114.38 118.41 1l2i h ARG 436 Ca 0.10 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 1l2i h ARG 436 Cb 0.85 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 1l2i h ARG 436 CO 0.08 0.58 -0.36 0.52 -1.51 0.00 0.00 179.97 179.27 1l2i h MET 437 N 0.71 0.09 0.00 0.20 2.86 -1.03 -1.63 114.93 116.12 1l2i h MET 437 Ca 0.19 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1l2i h MET 437 Cb 0.06 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1l2i h MET 437 CO -0.03 0.44 0.00 -1.33 1.06 0.00 0.00 176.91 177.05 1l2i n MET 438 N -4.09 0.15 -3.30 1.72 2.81 -0.86 -4.92 117.12 108.62 1l2i n MET 438 Ca -0.02 0.15 -0.16 0.00 -1.81 0.00 0.00 57.70 55.87 1l2i n MET 438 Cb 0.42 -1.68 0.08 0.00 -0.71 0.00 0.00 33.22 31.33 1l2i n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1l2i n ASN 439 N -1.94 -2.07 -4.69 7.83 5.15 -0.41 -4.90 115.26 114.23 1l2i n ASN 439 Ca 0.06 -0.56 -0.44 0.00 -0.60 0.00 0.00 54.58 53.03 1l2i n ASN 439 Cb 0.37 -4.71 -0.03 0.00 -0.53 0.00 0.00 39.78 34.88 1l2i n ASN 439 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1l2i n LEU 440 N -3.86 3.36 -4.91 1.20 7.94 -0.78 -4.98 117.00 114.97 1l2i n LEU 440 Ca -0.26 1.12 -0.28 0.00 -1.11 0.00 0.00 56.01 55.48 1l2i n LEU 440 Cb 0.65 -1.46 -0.03 0.00 0.53 0.00 0.00 43.42 43.11 1l2i n LEU 440 CO 0.56 -0.29 0.11 -1.10 -1.11 0.00 0.00 177.39 175.55 1l2i s GLN 441 N -0.01 3.58 0.30 1.96 -1.52 -1.26 -4.97 119.66 117.74 1l2i s GLN 441 Ca 0.71 -0.16 0.01 0.00 -1.95 0.00 0.00 55.36 53.96 1l2i s GLN 441 Cb -0.62 -2.75 0.54 0.00 -0.22 0.00 0.00 33.01 29.95 1l2i s GLN 441 CO 0.45 0.32 1.90 0.78 -0.25 0.00 0.00 175.29 178.49 1l2i h GLY 442 N 1.91 1.38 1.40 3.09 0.00 -1.99 -0.56 103.07 108.29 1l2i h GLY 442 Ca -0.48 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 46.37 1l2i h GLY 442 CO 0.67 0.27 -0.02 0.83 0.00 0.00 0.00 176.54 178.30 1l2i h GLU 443 N 1.02 0.74 -0.19 4.80 3.07 -1.99 -2.08 114.58 119.95 1l2i h GLU 443 Ca 0.41 -0.20 -0.20 0.00 -0.50 0.00 0.00 59.36 58.88 1l2i h GLU 443 Cb 0.26 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1l2i h GLU 443 CO -0.17 0.76 -0.66 0.93 -1.40 0.00 0.00 179.01 178.47 1l2i h GLU 444 N 0.69 0.72 -0.42 2.33 5.08 -1.73 -3.14 114.58 118.11 1l2i h GLU 444 Ca 0.13 -0.52 0.03 0.00 -1.00 0.00 0.00 59.36 58.01 1l2i h GLU 444 Cb 0.45 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 1l2i h GLU 444 CO 0.02 1.14 0.21 0.35 -1.00 0.00 0.00 179.01 179.73 1l2i h PHE 445 N 0.52 0.38 -0.19 4.33 3.57 -0.82 -1.05 116.94 123.67 1l2i h PHE 445 Ca -0.02 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 1l2i h PHE 445 Cb 1.26 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.88 1l2i h PHE 445 CO 0.07 0.19 -0.10 -0.39 -2.23 0.00 0.00 178.31 175.86 1l2i h VAL 446 N 0.42 1.18 -0.21 1.41 -1.51 -1.41 -1.16 116.25 114.97 1l2i h VAL 446 Ca 0.18 -0.76 -0.06 0.00 -1.23 0.00 0.00 66.70 64.83 1l2i h VAL 446 Cb 0.09 1.14 -0.01 0.00 -2.13 0.00 0.00 31.29 30.39 1l2i h VAL 446 CO -0.13 0.24 -0.10 0.00 -1.23 0.00 0.00 177.57 176.35 1l2i h LEU 448 N 0.13 0.68 -0.95 0.00 3.38 -0.76 -0.67 115.31 117.13 1l2i h LEU 448 Ca 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1l2i h LEU 448 Cb 0.59 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1l2i h LEU 448 CO 0.03 0.47 0.50 0.50 0.09 0.00 0.00 178.44 180.04 1l2i h LYS 449 N 0.82 1.24 -0.29 1.13 3.64 -1.20 -1.61 116.57 120.29 1l2i h LYS 449 Ca 0.27 -0.13 -0.12 0.00 -1.27 0.00 0.00 60.65 59.40 1l2i h LYS 449 Cb 0.02 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 1l2i h LYS 449 CO -0.11 0.89 -0.30 0.77 -2.27 0.00 0.00 179.45 178.43 1l2i h SER 450 N 1.25 0.63 -0.71 4.20 0.02 -0.99 -2.52 113.55 115.42 1l2i h SER 450 Ca 0.32 -0.25 -0.06 0.00 -0.84 0.00 0.00 61.79 60.97 1l2i h SER 450 Cb 0.00 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 1l2i h SER 450 CO -0.05 0.90 0.23 0.40 -1.14 0.00 0.00 176.83 177.17 1l2i h ILE 451 N 0.53 1.26 -0.17 3.27 2.04 -0.55 -1.72 117.51 122.17 1l2i h ILE 451 Ca 0.06 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 65.04 1l2i h ILE 451 Cb 0.78 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1l2i h ILE 451 CO 0.06 0.35 0.11 0.40 0.00 0.00 0.00 178.15 179.07 1l2i h ILE 452 N 1.07 1.07 -0.21 -0.67 2.04 -1.09 0.15 117.51 119.88 1l2i h ILE 452 Ca 0.24 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.96 1l2i h ILE 452 Cb 0.29 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1l2i h ILE 452 CO -0.01 0.07 0.00 0.25 0.00 0.00 0.00 178.15 178.46 1l2i h LEU 453 N 0.21 -0.07 -0.03 1.44 5.85 -1.16 -2.08 115.31 119.47 1l2i h LEU 453 Ca 0.06 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 1l2i h LEU 453 Cb 0.02 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1l2i h LEU 453 CO -0.01 -0.01 -0.47 -0.07 -0.34 0.00 0.00 178.44 177.54 1l2i h LEU 454 N 0.07 0.00 0.05 2.25 3.38 -1.16 -3.38 115.31 116.52 1l2i h LEU 454 Ca 0.10 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.71 1l2i h LEU 454 Cb 0.12 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1l2i h LEU 454 CO -0.16 0.47 -2.09 -3.20 0.09 0.00 0.00 178.44 173.54 1l2i n ASN 455 N -3.22 1.55 -0.24 -0.43 5.15 0.51 -4.20 115.26 114.38 1l2i n ASN 455 Ca 0.02 0.15 0.04 0.00 -0.60 0.00 0.00 54.58 54.19 1l2i n ASN 455 Cb 0.72 -0.35 0.16 0.00 -0.53 0.00 0.00 39.78 39.78 1l2i n ASN 455 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1l2i h SER 456 N 0.03 -0.01 -0.29 1.20 0.02 -1.56 -2.68 113.55 110.26 1l2i h SER 456 Ca -0.45 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1l2i h SER 456 Cb 2.03 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.76 1l2i h SER 456 CO 0.04 -0.04 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1l2i n GLY 457 N -1.35 1.47 0.35 -3.77 0.00 -1.26 -4.62 105.19 96.01 1l2i n GLY 457 Ca 0.13 -0.57 0.18 0.00 0.00 0.00 0.00 46.02 45.76 1l2i n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1l2i h VAL 458 N 3.46 0.23 -0.41 1.61 3.04 -1.64 -2.07 116.25 120.47 1l2i h VAL 458 Ca 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.61 1l2i h VAL 458 Cb 0.82 0.74 -0.05 0.00 -2.01 0.00 0.00 31.29 30.79 1l2i h VAL 458 CO 0.00 0.00 0.05 -1.22 -1.01 0.00 0.00 177.57 175.39 1l2i n TYR 459 N -3.38 1.39 -1.26 3.17 4.01 -1.26 -5.00 117.16 114.83 1l2i n TYR 459 Ca 0.01 -1.07 0.02 0.00 -0.16 0.00 0.00 57.90 56.71 1l2i n TYR 459 Cb 0.40 -0.45 0.03 0.00 -0.31 0.00 0.00 39.34 39.02 1l2i n TYR 459 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1l2i n THR 460 N -0.47 0.59 0.00 -0.72 -2.24 -0.78 -5.25 114.28 105.41 1l2i n THR 460 Ca 0.28 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1l2i n THR 460 Cb 1.05 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 1l2i n THR 460 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1l2i n LYS 472 N -0.41 0.00 -0.24 -0.78 5.02 -1.26 -5.12 118.16 115.36 1l2i n LYS 472 Ca 0.04 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.25 1l2i n LYS 472 Cb 0.57 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.62 1l2i n LYS 472 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1l2i h ASP 473 N 0.00 1.07 0.08 4.39 3.32 -2.00 -1.37 116.42 121.91 1l2i h ASP 473 Ca 0.00 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.79 1l2i h ASP 473 Cb 0.00 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.27 1l2i h ASP 473 CO 0.00 1.05 -0.04 -0.74 -1.72 0.00 0.00 179.24 177.79 1l2i h HIS 474 N 1.04 -0.10 -0.78 4.55 -0.00 -2.03 -0.57 115.15 117.27 1l2i h HIS 474 Ca 0.21 -0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.59 1l2i h HIS 474 Cb 0.43 0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 27.83 1l2i h HIS 474 CO 0.03 0.03 0.51 0.82 -0.00 0.00 0.00 177.93 179.31 1l2i h ILE 475 N -0.21 1.16 -0.51 6.26 2.04 -1.94 -0.86 117.51 123.46 1l2i h ILE 475 Ca -0.01 -0.35 -0.04 0.00 1.00 0.00 0.00 64.86 65.46 1l2i h ILE 475 Cb 0.17 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 1l2i h ILE 475 CO 0.02 0.19 0.14 0.45 0.00 0.00 0.00 178.15 178.94 1l2i h HIS 476 N 1.01 0.78 -0.19 1.37 3.86 -1.06 -0.77 115.15 120.15 1l2i h HIS 476 Ca 0.30 -0.06 -0.12 0.00 -1.16 0.00 0.00 60.37 59.32 1l2i h HIS 476 Cb -0.06 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 1l2i h HIS 476 CO -0.02 0.65 -0.39 0.00 0.86 0.00 0.00 177.93 179.03 1l2i h ARG 477 N 0.75 0.44 -0.14 2.45 3.08 -0.24 -2.30 114.38 118.42 1l2i h ARG 477 Ca 0.17 -0.21 -0.16 0.00 0.07 0.00 0.00 59.98 59.85 1l2i h ARG 477 Cb 0.25 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1l2i h ARG 477 CO -0.01 0.76 -0.59 0.28 -1.07 0.00 0.00 179.97 179.35 1l2i h VAL 478 N 0.37 1.34 -0.63 2.04 2.07 -0.60 -2.70 116.25 118.14 1l2i h VAL 478 Ca 0.03 -1.88 -0.09 0.00 0.82 0.00 0.00 66.70 65.58 1l2i h VAL 478 Cb 0.85 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1l2i h VAL 478 CO 0.07 0.57 0.04 -0.07 0.02 0.00 0.00 177.57 178.20 1l2i h LEU 479 N 0.34 1.05 -1.01 2.57 3.38 -0.96 -1.59 115.31 119.10 1l2i h LEU 479 Ca -0.00 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 1l2i h LEU 479 Cb 1.12 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 1l2i h LEU 479 CO 0.10 1.08 0.20 0.44 0.09 0.00 0.00 178.44 180.35 1l2i h ASP 480 N 1.00 0.84 -0.21 -0.43 3.32 -1.36 -1.37 116.42 118.21 1l2i h ASP 480 Ca 0.18 -0.13 0.02 0.00 0.02 0.00 0.00 57.03 57.12 1l2i h ASP 480 Cb 0.52 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 1l2i h ASP 480 CO 0.02 0.79 0.09 0.50 -1.72 0.00 0.00 179.24 178.92 1l2i h LYS 481 N 0.89 0.19 -0.33 3.56 3.11 -1.09 -0.04 116.57 122.86 1l2i h LYS 481 Ca 0.20 -0.01 -0.06 0.00 -2.81 0.00 0.00 60.65 57.97 1l2i h LYS 481 Cb 0.24 -0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 31.41 1l2i h LYS 481 CO -0.01 0.12 -0.04 0.82 -2.81 0.00 0.00 179.45 177.53 1l2i h ILE 482 N 0.19 1.21 -0.19 2.00 2.04 -0.95 -1.00 117.51 120.81 1l2i h ILE 482 Ca 0.09 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1l2i h ILE 482 Cb 0.04 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1l2i h ILE 482 CO -0.08 0.29 0.09 0.74 0.00 0.00 0.00 178.15 179.19 1l2i h THR 483 N 0.49 1.13 -0.89 -0.27 2.02 -0.58 -0.18 112.91 114.64 1l2i h THR 483 Ca 0.10 -0.38 0.07 0.00 0.77 0.00 0.00 66.41 66.97 1l2i h THR 483 Cb 0.38 1.04 -0.07 0.00 -1.74 0.00 0.00 68.15 67.77 1l2i h THR 483 CO 0.02 0.13 0.55 0.44 0.37 0.00 0.00 175.52 177.02 1l2i h ASP 484 N 0.18 0.85 -0.62 4.18 3.32 -0.58 -1.73 116.42 122.02 1l2i h ASP 484 Ca 0.07 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 1l2i h ASP 484 Cb 0.12 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 1l2i h ASP 484 CO -0.01 0.53 0.20 0.74 -1.72 0.00 0.00 179.24 178.98 1l2i h THR 485 N 0.98 1.24 -0.42 0.35 2.02 -0.59 -0.61 112.91 115.89 1l2i h THR 485 Ca 0.40 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 1l2i h THR 485 Cb 0.23 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1l2i h THR 485 CO -0.19 0.32 0.23 -0.07 0.37 0.00 0.00 175.52 176.17 1l2i h LEU 486 N 0.89 0.53 -0.42 2.58 3.38 -0.34 -1.16 115.31 120.77 1l2i h LEU 486 Ca 0.20 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1l2i h LEU 486 Cb 0.28 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1l2i h LEU 486 CO -0.01 0.47 0.15 0.40 0.09 0.00 0.00 178.44 179.54 1l2i h ILE 487 N 0.54 1.21 -0.51 1.22 1.08 -1.21 -2.03 117.51 117.81 1l2i h ILE 487 Ca 0.15 -0.67 0.09 0.00 -0.39 0.00 0.00 64.86 64.04 1l2i h ILE 487 Cb 0.06 0.87 -0.07 0.00 -3.07 0.00 0.00 36.82 34.61 1l2i h ILE 487 CO -0.02 0.24 0.09 -0.74 -0.69 0.00 0.00 178.15 177.03 1l2i h HIS 488 N 0.53 0.14 -0.89 1.37 2.76 -0.83 0.14 115.15 118.37 1l2i h HIS 488 Ca 0.14 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.32 1l2i h HIS 488 Cb 0.23 0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.16 1l2i h HIS 488 CO 0.01 -0.02 0.49 -0.07 -1.30 0.00 0.00 177.93 177.04 1l2i h LEU 489 N 0.22 1.10 -0.38 0.26 3.38 -0.92 -0.89 115.31 118.08 1l2i h LEU 489 Ca 0.26 -0.09 -0.17 0.00 0.09 0.00 0.00 57.88 57.96 1l2i h LEU 489 Cb 0.36 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1l2i h LEU 489 CO -0.35 0.88 -0.51 0.24 0.09 0.00 0.00 178.44 178.80 1l2i h MET 490 N 1.24 0.82 -0.41 1.13 2.86 -0.51 -1.60 114.93 118.46 1l2i h MET 490 Ca 0.31 -0.49 -0.03 0.00 -2.06 0.00 0.00 59.70 57.43 1l2i h MET 490 Cb 0.02 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1l2i h MET 490 CO -0.05 1.13 0.14 0.00 1.06 0.00 0.00 176.91 179.19 1l2i h ALA 491 N 0.78 0.54 -0.09 6.32 0.00 -0.56 -1.91 119.26 124.33 1l2i h ALA 491 Ca 0.03 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1l2i h ALA 491 Cb 1.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1l2i h ALA 491 CO 0.11 0.17 -0.16 1.57 0.00 0.00 0.00 179.25 180.94 1l2i h LYS 492 N 0.52 0.15 0.00 0.00 2.10 -1.09 -0.74 116.57 117.51 1l2i h LYS 492 Ca 0.13 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 1l2i h LYS 492 Cb 0.24 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 1l2i h LYS 492 CO -0.01 0.31 0.00 0.00 -2.00 0.00 0.00 179.45 177.75 1l2i n ALA 493 N -2.49 2.48 -0.51 0.07 0.00 -0.61 -4.87 120.51 114.58 1l2i n ALA 493 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1l2i n ALA 493 Cb 0.26 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1l2i n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l2i n GLY 494 N 0.65 0.75 3.77 0.00 0.00 -0.28 -5.06 105.19 105.01 1l2i n GLY 494 Ca 0.20 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1l2i n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l2i s LEU 495 N 0.00 4.26 0.88 0.99 1.02 -0.78 -5.02 118.68 120.03 1l2i s LEU 495 Ca 0.00 2.23 -0.12 0.00 0.02 0.00 0.00 54.13 56.26 1l2i s LEU 495 Cb 0.00 -3.98 0.12 0.00 0.02 0.00 0.00 46.19 42.35 1l2i s LEU 495 CO 0.00 -0.49 1.10 0.42 0.02 0.00 0.00 176.35 177.40 1l2i s THR 496 N -1.43 2.66 0.27 5.49 -4.23 -1.26 -4.63 115.64 112.51 1l2i s THR 496 Ca 0.54 0.21 -0.00 0.00 -1.18 0.00 0.00 61.69 61.27 1l2i s THR 496 Cb -0.28 -2.79 0.26 0.00 1.34 0.00 0.00 72.50 71.02 1l2i s THR 496 CO 0.36 -0.28 1.80 -0.07 -0.54 0.00 0.00 174.62 175.88 1l2i h LEU 497 N -1.46 0.71 -0.34 4.79 3.38 -1.99 0.18 115.31 120.58 1l2i h LEU 497 Ca -0.49 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 1l2i h LEU 497 Cb 1.29 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 1l2i h LEU 497 CO 0.57 0.34 0.00 -0.61 0.09 0.00 0.00 178.44 178.83 1l2i h GLN 498 N 0.79 0.60 -0.09 1.13 4.15 -2.01 -2.71 115.11 116.97 1l2i h GLN 498 Ca 0.48 -0.19 -0.05 0.00 0.77 0.00 0.00 58.65 59.65 1l2i h GLN 498 Cb 0.58 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 1l2i h GLN 498 CO -0.31 0.72 -0.18 1.96 -1.93 0.00 0.00 178.83 179.09 1l2i h GLN 499 N 0.41 0.14 0.23 1.69 4.20 -1.67 -2.11 115.11 118.01 1l2i h GLN 499 Ca 0.10 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1l2i h GLN 499 Cb 0.45 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1l2i h GLN 499 CO 0.02 0.32 -0.11 1.96 -0.67 0.00 0.00 178.83 180.35 1l2i h GLN 500 N 0.13 -0.30 0.00 1.46 4.20 -0.74 -0.41 115.11 119.45 1l2i h GLN 500 Ca 0.03 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1l2i h GLN 500 Cb 0.40 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1l2i h GLN 500 CO 0.03 -0.01 -0.34 1.12 -0.67 0.00 0.00 178.83 178.95 1l2i h HIS 501 N -0.59 0.00 -0.15 2.96 2.07 -1.42 -0.90 115.15 117.13 1l2i h HIS 501 Ca -0.03 0.00 -0.20 0.00 -2.85 0.00 0.00 60.37 57.28 1l2i h HIS 501 Cb 0.43 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.41 1l2i h HIS 501 CO 0.01 0.34 -0.72 1.96 -3.07 0.00 0.00 177.93 176.45 1l2i h GLN 502 N 0.00 0.69 -0.27 5.12 4.20 -1.33 -2.01 115.11 121.51 1l2i h GLN 502 Ca -0.00 -0.54 -0.16 0.00 0.06 0.00 0.00 58.65 58.01 1l2i h GLN 502 Cb 0.80 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.68 1l2i h GLN 502 CO 0.04 1.15 -0.48 -0.09 -0.67 0.00 0.00 178.83 178.79 1l2i h ARG 503 N 0.48 0.74 -0.32 1.46 2.43 -0.82 -1.78 114.38 116.56 1l2i h ARG 503 Ca -0.03 -0.43 0.01 0.00 -0.81 0.00 0.00 59.98 58.71 1l2i h ARG 503 Cb 1.33 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.90 1l2i h ARG 503 CO 0.14 1.05 0.21 1.25 -1.51 0.00 0.00 179.97 181.11 1l2i h LEU 504 N 0.58 0.35 -0.52 3.80 5.85 -1.13 -1.12 115.31 123.12 1l2i h LEU 504 Ca 0.03 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1l2i h LEU 504 Cb 1.05 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 1l2i h LEU 504 CO 0.10 0.25 0.26 0.00 -0.34 0.00 0.00 178.44 178.71 1l2i h ALA 505 N 1.13 0.67 -0.69 1.25 0.00 -1.26 -2.04 119.26 118.32 1l2i h ALA 505 Ca 0.12 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.98 1l2i h ALA 505 Cb -0.03 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.50 1l2i h ALA 505 CO -0.04 0.22 0.38 1.96 0.00 0.00 0.00 179.25 181.78 1l2i h GLN 506 N 0.69 0.69 -0.25 0.00 4.20 -0.96 -0.97 115.11 118.51 1l2i h GLN 506 Ca 0.18 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 1l2i h GLN 506 Cb 0.10 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1l2i h GLN 506 CO -0.02 0.45 0.01 -0.07 -0.67 0.00 0.00 178.83 178.53 1l2i h LEU 507 N 0.71 0.43 -1.10 1.46 3.38 -0.96 -3.01 115.31 116.21 1l2i h LEU 507 Ca 0.31 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1l2i h LEU 507 Cb 0.19 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1l2i h LEU 507 CO -0.18 0.62 -0.43 -0.07 0.09 0.00 0.00 178.44 178.47 1l2i h LEU 508 N 0.21 0.05 -1.07 1.67 3.38 -1.11 -2.80 115.31 115.64 1l2i h LEU 508 Ca 0.07 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1l2i h LEU 508 Cb 0.40 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1l2i h LEU 508 CO 0.01 0.47 -0.28 -0.07 0.09 0.00 0.00 178.44 178.66 1l2i h LEU 509 N 0.04 0.31 -1.68 1.67 3.38 -1.15 -1.87 115.31 116.01 1l2i h LEU 509 Ca 0.00 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1l2i h LEU 509 Cb 0.77 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1l2i h LEU 509 CO 0.06 0.59 -0.19 0.40 0.09 0.00 0.00 178.44 179.39 1l2i h ILE 510 N 0.27 0.84 -0.03 1.22 2.04 -1.36 -2.35 117.51 118.14 1l2i h ILE 510 Ca 0.04 -0.73 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 1l2i h ILE 510 Cb 0.64 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1l2i h ILE 510 CO 0.05 0.19 -0.13 -0.07 0.00 0.00 0.00 178.15 178.18 1l2i h LEU 511 N 0.00 0.04 -0.83 1.44 3.38 -1.33 -0.59 115.31 117.42 1l2i h LEU 511 Ca -0.00 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1l2i h LEU 511 Cb 0.41 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1l2i h LEU 511 CO 0.02 0.18 -0.54 0.77 0.09 0.00 0.00 178.44 178.96 1l2i h SER 512 N 0.05 0.00 0.25 -0.43 4.64 -1.48 -1.45 113.55 115.13 1l2i h SER 512 Ca 0.01 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.14 1l2i h SER 512 Cb 0.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1l2i h SER 512 CO 0.02 0.54 -0.75 0.45 -0.87 0.00 0.00 176.83 176.22 1l2i h HIS 513 N 0.00 0.57 -0.33 4.77 3.86 -1.20 -1.90 115.15 120.92 1l2i h HIS 513 Ca -0.01 -0.26 -0.09 0.00 -1.16 0.00 0.00 60.37 58.85 1l2i h HIS 513 Cb 1.02 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.39 1l2i h HIS 513 CO 0.00 1.02 -0.18 0.82 0.86 0.00 0.00 177.93 180.45 1l2i h ILE 514 N 0.28 1.26 -0.42 2.45 2.04 -1.00 -1.05 117.51 121.07 1l2i h ILE 514 Ca -0.04 -1.20 -0.04 0.00 1.00 0.00 0.00 64.86 64.59 1l2i h ILE 514 Cb 1.34 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 1l2i h ILE 514 CO 0.13 0.39 0.12 -0.09 0.00 0.00 0.00 178.15 178.71 1l2i h ARG 515 N 0.55 0.67 -0.43 2.37 9.65 -1.13 -1.47 114.38 124.58 1l2i h ARG 515 Ca 0.09 -0.15 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1l2i h ARG 515 Cb 0.62 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.09 1l2i h ARG 515 CO 0.04 0.66 0.28 1.25 2.80 0.00 0.00 179.97 185.01 1l2i h HIS 516 N 0.55 0.55 -0.70 2.20 2.76 -0.94 -1.66 115.15 117.91 1l2i h HIS 516 Ca 0.14 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.27 1l2i h HIS 516 Cb 0.28 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 29.02 1l2i h HIS 516 CO 0.01 0.36 0.26 0.52 -1.30 0.00 0.00 177.93 177.78 1l2i h MET 517 N 0.59 1.04 -0.53 5.26 2.86 -1.05 -1.79 114.93 121.31 1l2i h MET 517 Ca 0.16 -0.19 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1l2i h MET 517 Cb -0.05 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.41 1l2i h MET 517 CO -0.03 0.86 0.26 1.03 1.06 0.00 0.00 176.91 180.09 1l2i h SER 518 N 1.02 0.68 -0.47 1.22 0.87 -0.86 0.24 113.55 116.25 1l2i h SER 518 Ca 0.23 -0.12 -0.09 0.00 -1.23 0.00 0.00 61.79 60.59 1l2i h SER 518 Cb 0.22 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1l2i h SER 518 CO -0.02 0.61 -0.02 0.78 -0.53 0.00 0.00 176.83 177.65 1l2i h ASN 519 N 0.70 0.87 -0.30 6.23 2.35 -0.99 0.52 115.58 124.96 1l2i h ASN 519 Ca 0.18 -0.23 -0.13 0.00 -0.55 0.00 0.00 56.30 55.57 1l2i h ASN 519 Cb 0.10 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 1l2i h ASN 519 CO -0.02 0.94 -0.30 0.11 -1.65 0.00 0.00 177.43 176.51 1l2i h LYS 520 N 0.83 0.82 -0.25 0.81 1.79 -1.03 -2.25 116.57 117.29 1l2i h LYS 520 Ca 0.15 -0.38 -0.13 0.00 -2.18 0.00 0.00 60.65 58.12 1l2i h LYS 520 Cb 0.51 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.14 1l2i h LYS 520 CO 0.03 1.01 -0.38 0.78 -1.08 0.00 0.00 179.45 179.81 1l2i h GLY 521 N 0.92 0.61 1.00 3.86 0.00 -0.21 -1.92 103.07 107.33 1l2i h GLY 521 Ca 0.08 -0.59 -0.07 0.00 0.00 0.00 0.00 47.33 46.75 1l2i h GLY 521 CO 0.07 0.53 0.02 1.98 0.00 0.00 0.00 176.54 179.15 1l2i h MET 522 N 0.47 0.86 -0.12 4.80 -1.53 -0.79 -0.57 114.93 118.06 1l2i h MET 522 Ca 0.05 -0.26 -0.00 0.00 -3.44 0.00 0.00 59.70 56.04 1l2i h MET 522 Cb 0.87 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 31.83 1l2i h MET 522 CO 0.07 0.89 0.07 0.93 0.14 0.00 0.00 176.91 179.01 1l2i h GLU 523 N 0.73 0.16 -0.89 0.39 5.08 -1.26 -1.87 114.58 116.92 1l2i h GLU 523 Ca 0.14 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1l2i h GLU 523 Cb 0.48 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 1l2i h GLU 523 CO 0.02 0.16 0.49 1.25 -1.00 0.00 0.00 179.01 179.92 1l2i h HIS 524 N 0.12 1.22 -0.48 4.33 2.76 -1.20 -2.33 115.15 119.58 1l2i h HIS 524 Ca 0.04 -0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.09 1l2i h HIS 524 Cb 0.04 -0.39 -0.02 0.00 1.55 0.00 0.00 27.41 28.59 1l2i h HIS 524 CO -0.05 0.85 -0.09 1.25 -1.30 0.00 0.00 177.93 178.59 1l2i h LEU 525 N 1.24 0.84 -0.66 0.26 5.85 -0.91 -0.66 115.31 121.28 1l2i h LEU 525 Ca 0.31 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 1l2i h LEU 525 Cb 0.03 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1l2i h LEU 525 CO -0.05 0.95 0.29 0.22 -0.34 0.00 0.00 178.44 179.51 1l2i h TYR 526 N 0.77 0.98 -0.13 1.25 3.20 -1.04 0.08 116.97 122.08 1l2i h TYR 526 Ca 0.13 -0.06 -0.14 0.00 3.14 0.00 0.00 58.73 61.80 1l2i h TYR 526 Cb 0.58 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1l2i h TYR 526 CO 0.03 0.75 -0.53 0.66 -1.64 0.00 0.00 178.16 177.44 1l2i h SER 527 N 0.92 0.41 -0.69 -2.11 4.64 -1.15 -1.57 113.55 114.01 1l2i h SER 527 Ca 0.22 -0.21 -0.07 0.00 -0.47 0.00 0.00 61.79 61.26 1l2i h SER 527 Cb 0.17 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.11 1l2i h SER 527 CO -0.02 0.86 0.15 0.24 -0.87 0.00 0.00 176.83 177.19 1l2i h MET 528 N 0.29 1.12 0.14 4.77 2.86 -0.76 -1.20 114.93 122.15 1l2i h MET 528 Ca 0.01 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.36 1l2i h MET 528 Cb 1.03 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1l2i h MET 528 CO 0.09 1.00 -0.07 -0.22 1.06 0.00 0.00 176.91 178.77 1l2i h LYS 529 N 1.05 -0.18 0.00 1.72 3.64 -0.66 -1.83 116.57 120.31 1l2i h LYS 529 Ca 0.21 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 1l2i h LYS 529 Cb 0.40 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1l2i h LYS 529 CO 0.01 -0.08 -0.17 0.00 -2.27 0.00 0.00 179.45 176.94 1l2i n LYS 531 N -3.87 0.74 -4.29 0.00 2.85 -0.47 -4.92 118.16 108.19 1l2i n LYS 531 Ca -0.02 -0.19 -0.33 0.00 -1.05 0.00 0.00 58.31 56.71 1l2i n LYS 531 Cb 0.26 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.08 1l2i n LYS 531 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1l2i n ASN 532 N -0.96 -0.54 0.31 -5.58 2.85 -0.07 -4.80 115.26 106.47 1l2i n ASN 532 Ca 0.16 -1.18 0.19 0.00 -0.11 0.00 0.00 54.58 53.64 1l2i n ASN 532 Cb 0.25 -2.04 1.00 0.00 1.24 0.00 0.00 39.78 40.23 1l2i n ASN 532 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1l2i h VAL 533 N -1.54 0.20 -1.26 3.44 2.07 -1.77 -3.44 116.25 113.96 1l2i h VAL 533 Ca -0.63 -0.17 0.16 0.00 0.82 0.00 0.00 66.70 66.88 1l2i h VAL 533 Cb 1.39 1.14 -0.29 0.00 -1.52 0.00 0.00 31.29 32.01 1l2i h VAL 533 CO 0.75 0.02 0.75 0.54 0.02 0.00 0.00 177.57 179.65 1l2i s VAL 534 N -4.18 0.00 0.35 2.57 0.11 -1.26 -4.69 120.40 113.30 1l2i s VAL 534 Ca -0.04 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.73 1l2i s VAL 534 Cb 0.13 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.88 1l2i s VAL 534 CO 0.49 0.00 1.33 -2.84 -3.33 0.00 0.00 175.10 170.75 1l2i s PRO 535 N -0.29 4.25 -0.10 1.54 0.02 -1.26 -4.92 135.00 134.23 1l2i s PRO 535 Ca 0.05 2.26 -0.10 0.00 0.02 0.00 0.00 61.00 63.23 1l2i s PRO 535 Cb -0.04 -3.00 -0.05 0.00 0.02 0.00 0.00 34.50 31.44 1l2i s PRO 535 CO -0.10 -0.30 0.23 -0.51 -0.33 0.00 0.00 177.00 176.00 1l2i s LEU 536 N -1.95 4.38 0.74 -5.54 1.43 -1.26 -5.06 118.68 111.41 1l2i s LEU 536 Ca 0.51 0.58 -0.15 0.00 -1.03 0.00 0.00 54.13 54.04 1l2i s LEU 536 Cb -0.40 -2.25 0.04 0.00 0.03 0.00 0.00 46.19 43.61 1l2i s LEU 536 CO 0.54 0.33 1.22 -0.31 0.23 0.00 0.00 176.35 178.36 1l2i s TYR 537 N -0.72 1.97 0.18 0.29 2.02 -1.26 -4.77 117.35 115.06 1l2i s TYR 537 Ca 0.17 1.60 -0.13 0.00 -0.37 0.00 0.00 57.07 58.34 1l2i s TYR 537 Cb -0.13 -3.52 0.13 0.00 -0.40 0.00 0.00 41.96 38.04 1l2i s TYR 537 CO 0.06 -2.75 1.79 -0.44 -1.57 0.00 0.00 175.55 172.64 1l2i h ASP 538 N -0.34 0.40 -0.22 2.29 3.45 -1.98 -0.89 116.42 119.12 1l2i h ASP 538 Ca -0.48 0.02 -0.03 0.00 0.43 0.00 0.00 57.03 56.98 1l2i h ASP 538 Cb 1.30 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 40.01 1l2i h ASP 538 CO 0.49 0.28 0.03 0.25 -1.57 0.00 0.00 179.24 178.71 1l2i h LEU 539 N 0.53 0.36 -1.13 1.55 5.85 -1.96 -0.67 115.31 119.83 1l2i h LEU 539 Ca 0.22 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1l2i h LEU 539 Cb 0.11 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 1l2i h LEU 539 CO -0.14 0.54 0.59 0.25 -0.34 0.00 0.00 178.44 179.34 1l2i h LEU 540 N 0.16 1.00 -0.49 2.25 5.85 -1.89 -1.27 115.31 120.92 1l2i h LEU 540 Ca 0.07 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1l2i h LEU 540 Cb 0.34 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1l2i h LEU 540 CO 0.01 0.72 0.07 0.25 -0.34 0.00 0.00 178.44 179.14 1l2i h LEU 541 N 1.18 0.80 -0.11 2.25 6.46 -0.91 -1.18 115.31 123.80 1l2i h LEU 541 Ca 0.33 -0.27 0.02 0.00 -0.12 0.00 0.00 57.88 57.85 1l2i h LEU 541 Cb -0.10 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.59 1l2i h LEU 541 CO -0.08 0.86 -0.04 -0.33 -0.62 0.00 0.00 178.44 178.23 1l2i h GLU 542 N 0.70 -0.03 -0.68 1.25 5.08 -0.34 0.43 114.58 120.99 1l2i h GLU 542 Ca 0.15 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1l2i h GLU 542 Cb 0.42 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1l2i h GLU 542 CO 0.01 -0.02 0.35 0.52 -1.00 0.00 0.00 179.01 178.87 1l2i h MET 543 N -0.03 0.95 0.04 2.33 2.86 -1.12 -2.29 114.93 117.68 1l2i h MET 543 Ca 0.06 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1l2i h MET 543 Cb 0.11 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.59 1l2i h MET 543 CO -0.13 0.72 -0.02 1.25 1.06 0.00 0.00 176.91 179.79 1l2i h LEU 544 N 0.96 -0.04 -2.10 1.22 5.85 -0.78 -3.11 115.31 117.30 1l2i h LEU 544 Ca 0.24 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.63 1l2i h LEU 544 Cb 0.06 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1l2i h LEU 544 CO -0.04 0.37 0.14 0.44 -0.34 0.00 0.00 178.44 179.02 1l2i h ASP 545 N -0.47 0.00 -0.02 1.25 3.45 -0.80 -0.23 116.42 119.60 1l2i h ASP 545 Ca -0.01 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.46 1l2i h ASP 545 Cb 0.43 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.20 1l2i h ASP 545 CO 0.01 0.00 0.16 0.00 -1.57 0.00 0.00 179.24 177.84 1l2i h ALA 546 N 1.88 1.23 -0.03 3.45 0.00 -1.34 -3.51 119.26 120.94 1l2i h ALA 546 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1l2i h ALA 546 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1l2i h ALA 546 CO -0.00 -0.17 0.00 0.72 0.00 0.00 0.00 179.25 179.80