#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jf9 h LEU 306 N 0.00 0.91 -1.15 2.46 3.38 -2.03 -2.11 115.31 116.76 2jf9 h LEU 306 Ca 0.00 0.05 0.20 0.00 0.09 0.00 0.00 57.88 58.22 2jf9 h LEU 306 Cb 0.00 -0.13 -0.10 0.00 0.09 0.00 0.00 40.66 40.53 2jf9 h LEU 306 CO 0.00 0.46 0.62 0.00 0.09 0.00 0.00 178.44 179.61 2jf9 h ALA 307 N 1.55 1.84 0.00 1.53 0.00 -1.99 -0.86 119.26 121.33 2jf9 h ALA 307 Ca 0.51 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2jf9 h ALA 307 Cb 0.55 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2jf9 h ALA 307 CO -0.28 -0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.05 2jf9 n LEU 308 N -4.69 0.00 -0.27 0.00 4.77 -0.79 -2.95 117.00 113.06 2jf9 n LEU 308 Ca 0.23 0.41 0.12 0.00 -0.03 0.00 0.00 56.01 56.74 2jf9 n LEU 308 Cb 0.63 -0.41 0.25 0.00 -2.33 0.00 0.00 43.42 41.56 2jf9 n LEU 308 CO 0.24 -0.02 0.52 -1.54 -1.33 0.00 0.00 177.39 175.25 2jf9 n SER 309 N -1.41 1.22 -4.73 -1.43 3.41 -0.33 -4.96 113.62 105.39 2jf9 n SER 309 Ca 0.10 -0.99 -0.42 0.00 -0.26 0.00 0.00 58.87 57.30 2jf9 n SER 309 Cb 0.28 0.27 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 2jf9 n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jf9 s LEU 310 N -2.56 4.38 0.95 1.04 1.43 -1.15 -5.02 118.68 117.75 2jf9 s LEU 310 Ca 0.21 2.59 -0.12 0.00 -1.03 0.00 0.00 54.13 55.78 2jf9 s LEU 310 Cb 0.19 -3.61 0.16 0.00 0.03 0.00 0.00 46.19 42.96 2jf9 s LEU 310 CO 0.56 -0.72 1.09 0.42 0.23 0.00 0.00 176.35 177.94 2jf9 s THR 311 N 0.48 2.33 0.18 5.49 -4.23 -1.26 -4.79 115.64 113.83 2jf9 s THR 311 Ca 0.63 0.11 -0.14 0.00 -1.18 0.00 0.00 61.69 61.11 2jf9 s THR 311 Cb -0.41 -2.60 0.07 0.00 1.34 0.00 0.00 72.50 70.90 2jf9 s THR 311 CO 0.38 -0.14 1.83 0.00 -0.54 0.00 0.00 174.62 176.14 2jf9 h ALA 312 N -1.74 0.67 -0.60 3.99 0.00 -1.94 0.04 119.26 119.68 2jf9 h ALA 312 Ca -0.52 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2jf9 h ALA 312 Cb 1.31 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 2jf9 h ALA 312 CO 0.56 0.06 0.38 -0.44 0.00 0.00 0.00 179.25 179.81 2jf9 h ASP 313 N 0.66 0.70 -0.59 0.00 3.32 -1.96 -1.52 116.42 117.03 2jf9 h ASP 313 Ca 0.20 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.16 2jf9 h ASP 313 Cb -0.02 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 2jf9 h ASP 313 CO -0.07 0.53 0.17 1.56 -1.72 0.00 0.00 179.24 179.71 2jf9 h GLN 314 N 0.81 0.97 -0.08 3.56 4.20 -1.86 -1.09 115.11 121.62 2jf9 h GLN 314 Ca 0.22 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2jf9 h GLN 314 Cb -0.06 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.57 2jf9 h GLN 314 CO -0.04 0.85 0.05 1.98 -0.67 0.00 0.00 178.83 181.00 2jf9 h MET 315 N 0.93 0.10 -0.24 1.46 4.05 -0.70 0.12 114.93 120.66 2jf9 h MET 315 Ca 0.20 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.62 2jf9 h MET 315 Cb 0.31 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 2jf9 h MET 315 CO -0.00 0.08 0.16 0.28 0.23 0.00 0.00 176.91 177.65 2jf9 h VAL 316 N 0.09 1.06 -0.59 -5.77 2.07 -1.13 0.01 116.25 111.99 2jf9 h VAL 316 Ca 0.03 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.46 2jf9 h VAL 316 Cb 0.00 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 2jf9 h VAL 316 CO -0.01 0.06 0.37 -1.28 0.02 0.00 0.00 177.57 176.74 2jf9 h SER 317 N 0.32 0.62 -0.57 0.57 0.87 -1.14 -0.14 113.55 114.08 2jf9 h SER 317 Ca 0.09 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 2jf9 h SER 317 Cb -0.03 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 2jf9 h SER 317 CO -0.02 0.44 0.25 0.00 -0.53 0.00 0.00 176.83 176.97 2jf9 h ALA 318 N 1.24 0.74 -0.40 6.23 0.00 -0.60 -1.74 119.26 124.74 2jf9 h ALA 318 Ca 0.23 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 2jf9 h ALA 318 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2jf9 h ALA 318 CO -0.08 0.33 -0.30 -0.07 0.00 0.00 0.00 179.25 179.13 2jf9 h LEU 319 N 0.78 0.91 -0.48 0.00 3.38 -0.58 -1.29 115.31 118.03 2jf9 h LEU 319 Ca 0.19 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 2jf9 h LEU 319 Cb 0.16 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2jf9 h LEU 319 CO -0.02 1.14 0.19 -0.07 0.09 0.00 0.00 178.44 179.76 2jf9 h LEU 320 N 0.74 0.67 -1.70 1.67 3.38 -0.98 -2.82 115.31 116.27 2jf9 h LEU 320 Ca 0.08 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2jf9 h LEU 320 Cb 0.86 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2jf9 h LEU 320 CO 0.08 0.66 -0.14 0.44 0.09 0.00 0.00 178.44 179.56 2jf9 h ASP 321 N 0.64 0.00 1.08 -0.43 5.19 -1.11 -2.67 116.42 119.12 2jf9 h ASP 321 Ca 0.16 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.57 2jf9 h ASP 321 Cb 0.21 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.72 2jf9 h ASP 321 CO -0.01 0.14 0.00 0.00 -3.12 0.00 0.00 179.24 176.25 2jf9 n ALA 322 N -2.25 2.19 -1.69 3.45 0.00 -0.51 -4.94 120.51 116.77 2jf9 n ALA 322 Ca -0.01 -0.06 -0.44 0.00 0.00 0.00 0.00 53.44 52.94 2jf9 n ALA 322 Cb 0.29 -1.44 -0.02 0.00 0.00 0.00 0.00 19.45 18.29 2jf9 n ALA 322 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jf9 n GLU 323 N -1.81 2.11 -1.75 0.00 -0.58 -1.01 -4.48 120.64 113.13 2jf9 n GLU 323 Ca 0.06 0.75 -0.29 0.00 -0.42 0.00 0.00 57.16 57.25 2jf9 n GLU 323 Cb 0.34 -2.38 0.09 0.00 -0.57 0.00 0.00 31.44 28.93 2jf9 n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2jf9 s PRO 324 N -1.06 1.97 0.56 3.49 0.04 -1.26 -5.01 135.00 133.73 2jf9 s PRO 324 Ca 0.62 0.32 -0.19 0.00 0.04 0.00 0.00 61.00 61.79 2jf9 s PRO 324 Cb -0.60 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 31.95 2jf9 s PRO 324 CO 0.55 -1.63 1.11 -1.25 0.04 0.00 0.00 177.00 175.82 2jf9 s PRO 325 N -5.39 3.33 -0.15 0.56 0.04 -1.26 -4.99 135.00 127.14 2jf9 s PRO 325 Ca 0.61 1.51 -0.29 0.00 0.04 0.00 0.00 61.00 62.87 2jf9 s PRO 325 Cb -0.12 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.39 2jf9 s PRO 325 CO 0.52 -0.85 1.22 0.42 0.04 0.00 0.00 177.00 178.35 2jf9 s ILE 326 N -1.94 4.33 0.03 0.56 1.01 -1.26 -5.01 121.20 118.92 2jf9 s ILE 326 Ca 0.70 1.62 -0.15 0.00 0.00 0.00 0.00 60.65 62.82 2jf9 s ILE 326 Cb -0.22 -4.04 -0.06 0.00 0.01 0.00 0.00 42.46 38.15 2jf9 s ILE 326 CO 0.29 -0.11 0.45 -0.76 0.00 0.00 0.00 174.94 174.81 2jf9 s LEU 327 N 3.16 4.46 0.34 2.97 1.43 -1.26 -5.04 118.68 124.75 2jf9 s LEU 327 Ca 0.54 1.01 -0.02 0.00 -1.03 0.00 0.00 54.13 54.63 2jf9 s LEU 327 Cb -0.21 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 2jf9 s LEU 327 CO 0.15 0.28 0.57 -0.31 0.23 0.00 0.00 176.35 177.28 2jf9 s TYR 328 N -1.15 3.50 0.16 0.29 1.51 -1.26 -4.27 117.35 116.13 2jf9 s TYR 328 Ca 0.27 0.52 0.01 0.00 -1.01 0.00 0.00 57.07 56.85 2jf9 s TYR 328 Cb -0.17 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.62 2jf9 s TYR 328 CO 0.15 0.10 0.32 0.45 -1.11 0.00 0.00 175.55 175.46 2jf9 s SER 329 N -3.68 6.37 -0.11 2.29 0.15 -1.26 -5.04 113.70 112.42 2jf9 s SER 329 Ca 0.42 0.28 0.04 0.00 0.70 0.00 0.00 55.95 57.39 2jf9 s SER 329 Cb -0.10 -1.96 0.00 0.00 -1.71 0.00 0.00 66.02 62.25 2jf9 s SER 329 CO 0.35 0.03 -0.23 -1.61 1.20 0.00 0.00 173.24 172.98 2jf9 s GLU 330 N -3.15 3.06 0.17 5.44 8.01 -1.26 -4.96 118.70 126.01 2jf9 s GLU 330 Ca 0.36 -0.87 -0.23 0.00 0.01 0.00 0.00 54.97 54.24 2jf9 s GLU 330 Cb -0.11 -2.33 0.06 0.00 -4.31 0.00 0.00 34.13 27.44 2jf9 s GLU 330 CO 0.28 0.16 0.64 1.52 0.01 0.00 0.00 175.26 177.87 2jf9 s TYR 331 N 0.40 -0.47 -0.33 1.61 1.13 -1.26 -5.04 117.35 113.38 2jf9 s TYR 331 Ca -0.17 0.22 -0.29 0.00 -1.41 0.00 0.00 57.07 55.42 2jf9 s TYR 331 Cb -0.18 0.58 0.00 0.00 -1.10 0.00 0.00 41.96 41.27 2jf9 s TYR 331 CO 0.08 -0.89 1.38 0.34 -2.51 0.00 0.00 175.55 173.94 2jf9 s ASP 332 N -2.76 6.52 0.00 -0.18 -1.08 -1.26 -4.91 116.67 113.00 2jf9 s ASP 332 Ca 0.03 1.12 0.30 0.00 -0.52 0.00 0.00 52.55 53.48 2jf9 s ASP 332 Cb -0.02 -2.54 1.56 0.00 -1.46 0.00 0.00 42.92 40.46 2jf9 s ASP 332 CO -0.10 -1.23 2.06 -0.81 0.52 0.00 0.00 175.17 175.62 2jf9 n PRO 333 N 7.62 0.56 0.00 4.34 -0.04 -1.26 -2.92 135.00 143.30 2jf9 n PRO 333 Ca 0.16 -0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.71 2jf9 n PRO 333 Cb 0.47 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.58 2jf9 n PRO 333 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2jf9 n THR 334 N -1.19 0.00 -4.37 0.52 -2.24 -1.26 -4.88 114.28 100.85 2jf9 n THR 334 Ca 0.16 -0.44 -0.34 0.00 -2.27 0.00 0.00 64.05 61.16 2jf9 n THR 334 Cb 0.22 1.33 -0.11 0.00 -2.10 0.00 0.00 70.33 69.67 2jf9 n THR 334 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2jf9 s ARG 335 N -2.04 3.46 0.59 -0.78 3.00 -1.15 -5.11 118.95 116.92 2jf9 s ARG 335 Ca 0.29 -0.47 -0.16 0.00 0.00 0.00 0.00 55.73 55.38 2jf9 s ARG 335 Cb 0.20 -2.89 -0.04 0.00 0.00 0.00 0.00 34.95 32.22 2jf9 s ARG 335 CO 0.33 0.40 1.06 -1.25 0.00 0.00 0.00 175.30 175.84 2jf9 s PRO 336 N -0.05 3.31 0.54 3.54 0.04 -1.26 -4.92 135.00 136.19 2jf9 s PRO 336 Ca 0.02 1.24 -0.21 0.00 0.04 0.00 0.00 61.00 62.09 2jf9 s PRO 336 Cb -0.13 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.33 2jf9 s PRO 336 CO 0.02 -0.82 1.28 -0.06 0.04 0.00 0.00 177.00 177.46 2jf9 s PHE 337 N -2.39 2.44 0.38 0.56 0.08 -1.26 -5.05 117.98 112.75 2jf9 s PHE 337 Ca 0.64 1.44 0.06 0.00 0.12 0.00 0.00 56.93 59.20 2jf9 s PHE 337 Cb -0.17 -3.64 -0.07 0.00 -0.57 0.00 0.00 43.02 38.57 2jf9 s PHE 337 CO 0.36 -2.44 0.02 -1.54 -0.10 0.00 0.00 175.22 171.52 2jf9 s SER 338 N -1.19 3.42 0.13 1.36 1.04 -1.26 -4.98 113.70 112.22 2jf9 s SER 338 Ca 0.71 -1.37 -0.22 0.00 0.48 0.00 0.00 55.95 55.55 2jf9 s SER 338 Cb -0.36 -0.30 -0.01 0.00 0.10 0.00 0.00 66.02 65.45 2jf9 s SER 338 CO 0.41 -0.50 1.66 -0.08 0.98 0.00 0.00 173.24 175.72 2jf9 h GLU 339 N 1.88 -0.18 -0.54 4.02 4.81 -1.98 0.58 114.58 123.17 2jf9 h GLU 339 Ca -0.43 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.84 2jf9 h GLU 339 Cb 1.24 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.62 2jf9 h GLU 339 CO 0.77 -0.12 0.31 0.00 -0.73 0.00 0.00 179.01 179.25 2jf9 h ALA 340 N 0.89 0.69 0.02 2.92 0.00 -1.97 -1.93 119.26 119.88 2jf9 h ALA 340 Ca 0.10 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.78 2jf9 h ALA 340 Cb 0.33 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2jf9 h ALA 340 CO -0.26 0.01 -0.98 0.66 0.00 0.00 0.00 179.25 178.69 2jf9 h SER 341 N 0.62 0.47 -0.06 0.00 4.64 -1.89 -0.03 113.55 117.30 2jf9 h SER 341 Ca 0.22 -0.39 -0.03 0.00 -0.47 0.00 0.00 61.79 61.11 2jf9 h SER 341 Cb 0.05 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2jf9 h SER 341 CO -0.11 1.21 -0.09 -0.03 -0.87 0.00 0.00 176.83 176.94 2jf9 h MET 342 N 0.19 0.17 -0.72 4.77 -1.53 -0.85 0.89 114.93 117.84 2jf9 h MET 342 Ca -0.08 -0.10 -0.02 0.00 -3.44 0.00 0.00 59.70 56.06 2jf9 h MET 342 Cb 1.62 0.01 -0.03 0.00 -0.55 0.00 0.00 31.60 32.65 2jf9 h MET 342 CO 0.16 0.66 0.38 1.98 0.14 0.00 0.00 176.91 180.24 2jf9 h MET 343 N -0.31 1.00 -0.47 0.39 -1.53 -1.41 -0.80 114.93 111.80 2jf9 h MET 343 Ca 0.01 -0.11 0.02 0.00 -3.44 0.00 0.00 59.70 56.17 2jf9 h MET 343 Cb 0.65 -0.20 -0.03 0.00 -0.55 0.00 0.00 31.60 31.47 2jf9 h MET 343 CO 0.02 0.74 0.29 0.78 0.14 0.00 0.00 176.91 178.88 2jf9 h GLY 344 N 1.06 0.66 0.93 1.39 0.00 -0.88 0.45 103.07 106.67 2jf9 h GLY 344 Ca 0.25 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 2jf9 h GLY 344 CO -0.04 0.20 0.13 1.41 0.00 0.00 0.00 176.54 178.24 2jf9 h LEU 345 N 0.58 0.37 -0.77 3.11 3.38 -0.18 -1.37 115.31 120.43 2jf9 h LEU 345 Ca 0.18 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2jf9 h LEU 345 Cb -0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2jf9 h LEU 345 CO -0.07 0.41 -0.04 -0.07 0.09 0.00 0.00 178.44 178.76 2jf9 h LEU 346 N 0.31 0.87 -0.31 1.67 3.38 -1.04 -1.46 115.31 118.73 2jf9 h LEU 346 Ca 0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2jf9 h LEU 346 Cb 0.14 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2jf9 h LEU 346 CO -0.01 0.95 0.13 0.74 0.09 0.00 0.00 178.44 180.34 2jf9 h THR 347 N 0.82 1.17 -0.49 0.22 2.02 -0.84 -0.99 112.91 114.82 2jf9 h THR 347 Ca 0.15 -0.52 0.01 0.00 0.77 0.00 0.00 66.41 66.81 2jf9 h THR 347 Cb 0.54 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 2jf9 h THR 347 CO 0.03 0.18 0.32 -1.13 0.37 0.00 0.00 175.52 175.30 2jf9 h ASN 348 N 0.35 0.56 0.19 4.18 -1.24 -1.05 -1.80 115.58 116.75 2jf9 h ASN 348 Ca 0.10 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.09 2jf9 h ASN 348 Cb 0.17 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.08 2jf9 h ASN 348 CO -0.01 0.40 -0.09 0.25 -1.29 0.00 0.00 177.43 176.69 2jf9 h LEU 349 N 0.66 -0.21 -0.68 0.34 5.85 -1.19 -2.12 115.31 117.95 2jf9 h LEU 349 Ca 0.18 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.96 2jf9 h LEU 349 Cb -0.07 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.95 2jf9 h LEU 349 CO -0.04 -0.12 0.33 0.00 -0.34 0.00 0.00 178.44 178.27 2jf9 h ALA 350 N 0.52 0.93 -0.57 1.25 0.00 -1.04 -0.19 119.26 120.15 2jf9 h ALA 350 Ca -0.03 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2jf9 h ALA 350 Cb 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2jf9 h ALA 350 CO 0.04 -0.06 0.05 -0.44 0.00 0.00 0.00 179.25 178.84 2jf9 h ASP 351 N 0.58 0.90 -0.40 0.00 3.32 -1.22 -0.00 116.42 119.59 2jf9 h ASP 351 Ca 0.33 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2jf9 h ASP 351 Cb 0.34 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2jf9 h ASP 351 CO -0.26 0.93 0.17 0.03 -1.72 0.00 0.00 179.24 178.39 2jf9 h ARG 352 N 0.88 0.59 -0.68 3.56 3.08 -0.88 -3.17 114.38 117.76 2jf9 h ARG 352 Ca 0.17 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 2jf9 h ARG 352 Cb 0.44 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 2jf9 h ARG 352 CO 0.02 0.55 0.40 0.93 -1.07 0.00 0.00 179.97 180.80 2jf9 h GLU 353 N 0.50 0.92 -0.99 0.04 5.08 -0.55 -2.28 114.58 117.30 2jf9 h GLU 353 Ca 0.13 -0.08 0.07 0.00 -1.00 0.00 0.00 59.36 58.48 2jf9 h GLU 353 Cb 0.17 -0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.16 2jf9 h GLU 353 CO -0.01 0.65 0.64 -0.07 -1.00 0.00 0.00 179.01 179.22 2jf9 h LEU 354 N 0.94 1.01 -0.13 1.33 3.38 -0.99 0.20 115.31 121.05 2jf9 h LEU 354 Ca 0.25 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2jf9 h LEU 354 Cb -0.03 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 2jf9 h LEU 354 CO -0.05 0.64 0.08 0.58 0.09 0.00 0.00 178.44 179.78 2jf9 h VAL 355 N 1.14 1.05 0.00 1.22 2.07 -1.39 -2.82 116.25 117.53 2jf9 h VAL 355 Ca 0.43 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.76 2jf9 h VAL 355 Cb 0.20 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2jf9 h VAL 355 CO -0.18 0.05 -0.29 0.45 0.02 0.00 0.00 177.57 177.63 2jf9 h HIS 356 N 0.15 0.00 -0.41 1.57 3.86 -1.34 -2.63 115.15 116.35 2jf9 h HIS 356 Ca 0.05 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 2jf9 h HIS 356 Cb 0.01 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 2jf9 h HIS 356 CO -0.06 0.29 0.23 1.98 0.86 0.00 0.00 177.93 181.23 2jf9 h MET 357 N 0.00 0.55 -0.39 2.45 -1.53 -0.36 -1.86 114.93 113.79 2jf9 h MET 357 Ca -0.00 -0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.18 2jf9 h MET 357 Cb 0.82 -0.12 -0.02 0.00 -0.55 0.00 0.00 31.60 31.74 2jf9 h MET 357 CO 0.04 0.40 0.13 0.82 0.14 0.00 0.00 176.91 178.44 2jf9 h ILE 358 N 0.56 1.21 -0.55 1.77 2.04 -1.28 0.26 117.51 121.51 2jf9 h ILE 358 Ca 0.15 -0.67 -0.11 0.00 1.00 0.00 0.00 64.86 65.23 2jf9 h ILE 358 Cb -0.00 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2jf9 h ILE 358 CO -0.03 0.24 -0.08 0.78 0.00 0.00 0.00 178.15 179.06 2jf9 h ASN 359 N 0.48 1.03 -0.03 1.72 2.35 -1.55 -2.60 115.58 116.99 2jf9 h ASN 359 Ca 0.13 -0.34 0.01 0.00 -0.55 0.00 0.00 56.30 55.55 2jf9 h ASN 359 Cb 0.24 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 2jf9 h ASN 359 CO -0.01 1.13 -0.04 -0.25 -1.65 0.00 0.00 177.43 176.62 2jf9 h TRP 360 N 0.92 -0.09 -0.92 1.19 7.01 -1.18 -3.13 115.95 119.75 2jf9 h TRP 360 Ca 0.15 0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.18 2jf9 h TRP 360 Cb 0.65 0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 27.70 2jf9 h TRP 360 CO 0.05 -0.06 0.61 0.00 -2.79 0.00 0.00 178.44 176.24 2jf9 h ALA 361 N 0.97 1.39 0.00 2.65 0.00 -0.74 -0.51 119.26 123.02 2jf9 h ALA 361 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jf9 h ALA 361 Cb 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2jf9 h ALA 361 CO -0.06 0.53 0.00 0.87 0.00 0.00 0.00 179.25 180.59 2jf9 h LYS 362 N 1.18 0.00 -0.02 0.00 1.57 -1.42 -1.68 116.57 116.21 2jf9 h LYS 362 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 2jf9 h LYS 362 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2jf9 h LYS 362 CO -0.10 0.00 -0.34 0.54 -0.57 0.00 0.00 179.45 178.98 2jf9 n ARG 363 N -2.74 1.33 -2.48 3.15 1.74 -0.22 -4.57 116.66 112.86 2jf9 n ARG 363 Ca -0.00 -1.04 -0.43 0.00 -0.77 0.00 0.00 57.85 55.61 2jf9 n ARG 363 Cb 0.19 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.13 2jf9 n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jf9 s VAL 364 N -2.39 4.36 0.16 1.55 1.01 -0.63 -4.83 120.40 119.63 2jf9 s VAL 364 Ca 0.22 1.65 -0.34 0.00 0.00 0.00 0.00 61.98 63.52 2jf9 s VAL 364 Cb 0.19 -4.07 -0.15 0.00 0.00 0.00 0.00 36.38 32.35 2jf9 s VAL 364 CO 0.51 -0.09 1.45 -2.65 0.00 0.00 0.00 175.10 174.32 2jf9 n PRO 365 N 6.01 1.80 0.00 2.72 -0.02 -1.26 -1.54 135.00 142.70 2jf9 n PRO 365 Ca 0.12 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2jf9 n PRO 365 Cb 0.46 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2jf9 n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jf9 n GLY 366 N 2.84 3.20 0.20 -1.23 0.00 -1.26 -4.93 105.19 104.01 2jf9 n GLY 366 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 2jf9 n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2jf9 h PHE 367 N 0.00 0.74 0.00 1.61 3.57 -1.55 -2.56 116.94 118.75 2jf9 h PHE 367 Ca 0.00 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.33 2jf9 h PHE 367 Cb 0.00 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.56 2jf9 h PHE 367 CO 0.00 0.85 0.00 1.33 -2.23 0.00 0.00 178.31 178.26 2jf9 n VAL 368 N -4.40 0.56 0.25 1.41 0.24 -1.26 -2.00 118.33 113.12 2jf9 n VAL 368 Ca -0.03 0.14 0.14 0.00 -2.04 0.00 0.00 64.34 62.55 2jf9 n VAL 368 Cb 0.36 -0.78 0.57 0.00 -1.47 0.00 0.00 33.84 32.52 2jf9 n VAL 368 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2jf9 h ASP 369 N 0.00 0.00 -4.21 -1.34 3.32 -1.84 -3.45 116.42 108.90 2jf9 h ASP 369 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 2jf9 h ASP 369 Cb 0.36 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.96 2jf9 h ASP 369 CO 0.00 0.11 0.38 -0.76 -1.72 0.00 0.00 179.24 177.25 2jf9 s LEU 370 N -6.51 3.52 0.81 1.55 1.43 -0.85 -5.04 118.68 113.59 2jf9 s LEU 370 Ca 0.01 1.67 -0.12 0.00 -1.03 0.00 0.00 54.13 54.66 2jf9 s LEU 370 Cb 0.10 -4.52 0.08 0.00 0.03 0.00 0.00 46.19 41.88 2jf9 s LEU 370 CO 0.59 -0.89 1.16 0.42 0.23 0.00 0.00 176.35 177.86 2jf9 s THR 371 N -2.60 2.40 0.26 5.49 -4.23 -1.26 -4.79 115.64 110.91 2jf9 s THR 371 Ca 0.61 0.16 -0.02 0.00 -1.18 0.00 0.00 61.69 61.26 2jf9 s THR 371 Cb -0.13 -2.50 0.23 0.00 1.34 0.00 0.00 72.50 71.45 2jf9 s THR 371 CO 0.36 -0.14 1.76 0.25 -0.54 0.00 0.00 174.62 176.31 2jf9 h LEU 372 N -1.03 0.49 -0.49 4.79 5.85 -1.96 -0.28 115.31 122.66 2jf9 h LEU 372 Ca -0.45 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.37 2jf9 h LEU 372 Cb 1.27 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.29 2jf9 h LEU 372 CO 0.47 0.21 0.31 -0.74 -0.34 0.00 0.00 178.44 178.35 2jf9 h HIS 373 N 0.60 0.59 -0.39 1.25 2.76 -1.99 -0.72 115.15 117.24 2jf9 h HIS 373 Ca 0.45 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.49 2jf9 h HIS 373 Cb 0.63 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.38 2jf9 h HIS 373 CO -0.10 0.36 -0.33 -0.44 -1.30 0.00 0.00 177.93 176.11 2jf9 h ASP 374 N 0.63 0.94 -0.54 3.26 3.32 -1.72 -2.11 116.42 120.20 2jf9 h ASP 374 Ca 0.19 -0.40 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 2jf9 h ASP 374 Cb -0.03 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.23 2jf9 h ASP 374 CO -0.06 1.18 0.32 1.56 -1.72 0.00 0.00 179.24 180.52 2jf9 h GLN 375 N 0.74 0.74 -0.24 3.56 4.20 -0.72 -1.83 115.11 121.56 2jf9 h GLN 375 Ca 0.07 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2jf9 h GLN 375 Cb 0.91 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 2jf9 h GLN 375 CO 0.08 0.55 0.10 0.28 -0.67 0.00 0.00 178.83 179.17 2jf9 h VAL 376 N 0.73 1.17 -0.37 -0.54 2.07 -1.11 -2.62 116.25 115.57 2jf9 h VAL 376 Ca 0.19 -0.51 0.04 0.00 0.82 0.00 0.00 66.70 67.24 2jf9 h VAL 376 Cb 0.00 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2jf9 h VAL 376 CO -0.03 0.17 0.16 -0.74 0.02 0.00 0.00 177.57 177.14 2jf9 h HIS 377 N 0.24 0.28 -0.39 1.57 -0.00 -1.24 0.13 115.15 115.74 2jf9 h HIS 377 Ca 0.08 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.45 2jf9 h HIS 377 Cb 0.18 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.50 2jf9 h HIS 377 CO -0.01 0.13 0.19 -0.07 -0.00 0.00 0.00 177.93 178.18 2jf9 h LEU 378 N 0.33 0.50 -0.32 0.26 3.38 -1.29 -1.77 115.31 116.40 2jf9 h LEU 378 Ca 0.16 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2jf9 h LEU 378 Cb 0.11 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2jf9 h LEU 378 CO -0.14 0.48 -0.07 -0.07 0.09 0.00 0.00 178.44 178.73 2jf9 h LEU 379 N 0.49 0.61 -1.01 1.67 3.38 -1.29 -0.97 115.31 118.20 2jf9 h LEU 379 Ca 0.13 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.80 2jf9 h LEU 379 Cb 0.10 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 2jf9 h LEU 379 CO -0.02 0.83 0.65 -0.08 0.09 0.00 0.00 178.44 179.91 2jf9 h GLU 380 N 0.39 1.19 0.02 1.13 4.81 -0.61 -1.84 114.58 119.66 2jf9 h GLU 380 Ca 0.08 -0.07 -0.21 0.00 -0.13 0.00 0.00 59.36 59.03 2jf9 h GLU 380 Cb 0.55 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 2jf9 h GLU 380 CO 0.03 0.79 -0.98 0.00 -0.73 0.00 0.00 179.01 178.12 2jf9 n ALA 382 N -2.39 4.22 -0.32 0.00 0.00 -0.38 -4.68 120.51 116.96 2jf9 n ALA 382 Ca -0.02 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2jf9 n ALA 382 Cb 0.90 -0.71 0.18 0.00 0.00 0.00 0.00 19.45 19.82 2jf9 n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2jf9 h TRP 383 N 0.00 1.14 -0.07 0.00 5.08 -1.54 -1.15 115.95 119.41 2jf9 h TRP 383 Ca 0.00 0.03 -0.20 0.00 1.08 0.00 0.00 58.89 59.79 2jf9 h TRP 383 Cb 0.56 -0.38 0.00 0.00 -3.00 0.00 0.00 29.16 26.34 2jf9 h TRP 383 CO 0.00 0.68 -0.81 1.25 -1.28 0.00 0.00 178.44 178.29 2jf9 h LEU 384 N 1.19 0.58 -0.96 0.11 5.85 -1.87 -0.98 115.31 119.24 2jf9 h LEU 384 Ca 0.35 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 58.70 2jf9 h LEU 384 Cb -0.05 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2jf9 h LEU 384 CO -0.10 1.17 0.63 -0.33 -0.34 0.00 0.00 178.44 179.48 2jf9 h GLU 385 N 0.31 1.20 -0.30 1.25 5.08 -1.74 -0.61 114.58 119.77 2jf9 h GLU 385 Ca -0.05 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 2jf9 h GLU 385 Cb 1.41 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 2jf9 h GLU 385 CO 0.14 0.79 0.00 0.82 -1.00 0.00 0.00 179.01 179.77 2jf9 h ILE 386 N 1.23 1.26 -0.80 3.13 2.04 -1.03 0.09 117.51 123.44 2jf9 h ILE 386 Ca 0.37 -0.94 0.03 0.00 1.00 0.00 0.00 64.86 65.33 2jf9 h ILE 386 Cb -0.04 1.28 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 2jf9 h ILE 386 CO -0.11 0.30 0.51 -0.07 0.00 0.00 0.00 178.15 178.78 2jf9 h LEU 387 N 0.32 0.84 -0.36 1.44 3.38 -0.95 -2.60 115.31 117.39 2jf9 h LEU 387 Ca 0.08 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 2jf9 h LEU 387 Cb 0.43 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2jf9 h LEU 387 CO 0.02 0.58 -0.44 0.24 0.09 0.00 0.00 178.44 178.93 2jf9 h MET 388 N 0.99 0.92 -0.48 1.13 2.86 -0.93 -1.29 114.93 118.14 2jf9 h MET 388 Ca 0.32 -0.52 -0.10 0.00 -2.06 0.00 0.00 59.70 57.34 2jf9 h MET 388 Cb 0.01 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 2jf9 h MET 388 CO -0.11 1.17 -0.10 0.97 1.06 0.00 0.00 176.91 179.89 2jf9 h ILE 389 N 0.74 1.26 -0.68 -1.22 2.10 -0.95 -1.11 117.51 117.66 2jf9 h ILE 389 Ca 0.05 -1.20 0.01 0.00 1.08 0.00 0.00 64.86 64.79 2jf9 h ILE 389 Cb 1.04 1.00 -0.03 0.00 -1.09 0.00 0.00 36.82 37.74 2jf9 h ILE 389 CO 0.10 0.42 0.44 1.23 -1.08 0.00 0.00 178.15 179.26 2jf9 h GLY 390 N 0.97 0.95 0.96 8.18 0.00 -1.36 -1.17 103.07 111.61 2jf9 h GLY 390 Ca 0.13 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2jf9 h GLY 390 CO 0.04 0.35 0.18 -2.00 0.00 0.00 0.00 176.54 175.12 2jf9 h LEU 391 N 0.92 0.63 -0.50 3.11 5.85 -0.86 -1.58 115.31 122.88 2jf9 h LEU 391 Ca 0.25 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 2jf9 h LEU 391 Cb -0.10 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 2jf9 h LEU 391 CO -0.05 0.63 0.17 0.58 -0.34 0.00 0.00 178.44 179.43 2jf9 h VAL 392 N 0.60 1.22 0.04 1.05 2.07 -1.09 -1.96 116.25 118.18 2jf9 h VAL 392 Ca 0.15 -0.72 0.03 0.00 0.82 0.00 0.00 66.70 66.98 2jf9 h VAL 392 Cb 0.19 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 2jf9 h VAL 392 CO -0.01 0.27 -0.23 -0.25 0.02 0.00 0.00 177.57 177.36 2jf9 h TRP 393 N 0.67 -0.62 0.00 1.57 2.91 -1.06 -2.73 115.95 116.69 2jf9 h TRP 393 Ca 0.16 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.20 2jf9 h TRP 393 Cb 0.24 0.27 0.00 0.00 -0.51 0.00 0.00 29.16 29.16 2jf9 h TRP 393 CO 0.01 -0.33 0.00 2.89 -1.03 0.00 0.00 178.44 179.98 2jf9 n ARG 394 N -5.36 0.27 0.00 2.65 1.85 -0.61 -2.78 116.66 112.68 2jf9 n ARG 394 Ca -0.05 0.06 0.12 0.00 -1.00 0.00 0.00 57.85 56.98 2jf9 n ARG 394 Cb 0.27 -1.50 0.28 0.00 -1.05 0.00 0.00 32.46 30.46 2jf9 n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2jf9 n SER 395 N -1.33 0.96 -0.35 2.89 7.64 -0.75 -4.52 113.62 118.16 2jf9 n SER 395 Ca 0.10 -0.77 0.05 0.00 1.01 0.00 0.00 58.87 59.26 2jf9 n SER 395 Cb 0.21 0.25 0.22 0.00 -1.01 0.00 0.00 64.21 63.88 2jf9 n SER 395 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2jf9 h MET 396 N 0.90 1.05 -0.01 1.43 2.86 -1.45 0.58 114.93 120.28 2jf9 h MET 396 Ca 0.00 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2jf9 h MET 396 Cb 0.53 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.95 2jf9 h MET 396 CO 0.00 0.69 0.00 0.39 1.06 0.00 0.00 176.91 179.05 2jf9 n GLU 397 N -4.54 1.03 -3.40 1.72 -0.58 -1.26 -4.33 120.64 109.28 2jf9 n GLU 397 Ca 0.16 -0.05 -0.26 0.00 -0.42 0.00 0.00 57.16 56.60 2jf9 n GLU 397 Cb 0.26 -1.11 -0.09 0.00 -0.57 0.00 0.00 31.44 29.93 2jf9 n GLU 397 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2jf9 n HIS 398 N -0.56 1.11 -1.73 -0.32 8.25 0.19 -5.11 115.22 117.06 2jf9 n HIS 398 Ca 0.05 -3.77 -0.42 0.00 -0.26 0.00 0.00 57.72 53.31 2jf9 n HIS 398 Cb 0.03 -0.31 -0.01 0.00 1.12 0.00 0.00 29.99 30.82 2jf9 n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2jf9 n PRO 399 N 1.65 2.40 -0.79 -0.41 -0.02 -1.26 -1.42 135.00 135.15 2jf9 n PRO 399 Ca 0.25 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.58 2jf9 n PRO 399 Cb 0.46 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2jf9 n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jf9 n GLY 400 N 1.22 1.36 3.19 -1.23 0.00 -1.26 -5.00 105.19 103.46 2jf9 n GLY 400 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 2jf9 n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jf9 s LYS 401 N -0.02 0.92 -0.18 1.61 1.02 -0.51 -3.14 119.74 119.45 2jf9 s LYS 401 Ca 0.00 -1.40 0.00 0.00 0.02 0.00 0.00 55.97 54.60 2jf9 s LYS 401 Cb 0.00 -0.21 0.01 0.00 -0.52 0.00 0.00 37.83 37.11 2jf9 s LYS 401 CO 0.00 -0.06 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.69 2jf9 s LEU 402 N -3.08 2.30 -1.08 3.17 1.43 0.20 -4.80 118.68 116.82 2jf9 s LEU 402 Ca 0.16 -0.57 -0.16 0.00 -1.03 0.00 0.00 54.13 52.53 2jf9 s LEU 402 Cb 0.06 -1.53 0.15 0.00 0.03 0.00 0.00 46.19 44.90 2jf9 s LEU 402 CO -0.02 0.02 1.30 -0.22 0.23 0.00 0.00 176.35 177.66 2jf9 s LEU 403 N 1.17 5.04 0.22 1.79 2.96 -1.26 -1.26 118.68 127.33 2jf9 s LEU 403 Ca 0.02 -2.55 -0.08 0.00 -0.22 0.00 0.00 54.13 51.30 2jf9 s LEU 403 Cb -0.14 -2.40 0.19 0.00 0.50 0.00 0.00 46.19 44.34 2jf9 s LEU 403 CO -0.08 -0.90 1.85 -0.26 -1.32 0.00 0.00 176.35 175.65 2jf9 h PHE 404 N 7.93 1.18 -3.80 5.38 0.04 -1.51 -3.43 116.94 122.74 2jf9 h PHE 404 Ca 0.24 -0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.90 2jf9 h PHE 404 Cb 0.94 -0.38 -0.13 0.00 2.20 0.00 0.00 35.95 38.58 2jf9 h PHE 404 CO 1.14 0.82 -0.31 0.00 -0.60 0.00 0.00 178.31 179.35 2jf9 s ALA 405 N -5.85 -0.18 0.58 2.45 0.00 -1.03 -4.94 121.76 112.78 2jf9 s ALA 405 Ca -0.13 -0.70 0.27 0.00 0.00 0.00 0.00 51.96 51.41 2jf9 s ALA 405 Cb 0.16 0.70 1.60 0.00 0.00 0.00 0.00 23.12 25.58 2jf9 s ALA 405 CO 0.82 -0.60 2.09 -1.35 0.00 0.00 0.00 175.76 176.73 2jf9 h PRO 406 N 2.60 0.00 -0.34 0.00 0.11 -1.88 -0.50 132.00 132.00 2jf9 h PRO 406 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2jf9 h PRO 406 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2jf9 h PRO 406 CO 0.51 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.57 2jf9 n ASN 407 N -3.93 4.22 -3.43 -2.05 6.94 -1.26 -4.81 115.26 110.95 2jf9 n ASN 407 Ca 0.02 -2.94 -0.25 0.00 -0.02 0.00 0.00 54.58 51.40 2jf9 n ASN 407 Cb 0.34 -0.56 -0.10 0.00 -2.36 0.00 0.00 39.78 37.10 2jf9 n ASN 407 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2jf9 s LEU 408 N -2.70 0.60 -0.25 -4.53 2.96 -0.20 -4.90 118.68 109.66 2jf9 s LEU 408 Ca 0.44 -1.96 -0.03 0.00 -0.22 0.00 0.00 54.13 52.35 2jf9 s LEU 408 Cb 0.35 -0.05 0.01 0.00 0.50 0.00 0.00 46.19 47.00 2jf9 s LEU 408 CO 0.11 -0.29 -0.03 -0.22 -1.32 0.00 0.00 176.35 174.60 2jf9 s LEU 409 N 1.21 3.23 -0.11 -0.68 2.96 -1.26 -1.20 118.68 122.83 2jf9 s LEU 409 Ca 0.18 -0.69 0.02 0.00 -0.22 0.00 0.00 54.13 53.41 2jf9 s LEU 409 Cb -0.20 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.75 2jf9 s LEU 409 CO -0.01 -0.11 -0.17 -0.76 -1.32 0.00 0.00 176.35 173.99 2jf9 s LEU 410 N 1.41 2.52 0.63 -0.68 1.43 -0.39 -4.94 118.68 118.65 2jf9 s LEU 410 Ca 0.02 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 2jf9 s LEU 410 Cb -0.16 -1.54 0.06 0.00 0.03 0.00 0.00 46.19 44.58 2jf9 s LEU 410 CO -0.03 0.19 0.88 1.51 0.23 0.00 0.00 176.35 179.13 2jf9 s ASP 411 N 0.21 4.95 0.25 2.29 1.47 -1.26 -0.63 116.67 123.96 2jf9 s ASP 411 Ca -0.10 0.03 -0.03 0.00 1.18 0.00 0.00 52.55 53.62 2jf9 s ASP 411 Cb -0.16 -0.75 0.41 0.00 -0.34 0.00 0.00 42.92 42.08 2jf9 s ASP 411 CO 0.06 -1.42 1.84 -0.09 0.68 0.00 0.00 175.17 176.24 2jf9 h ARG 412 N -0.23 0.91 0.00 2.11 2.43 -1.95 -1.34 114.38 116.31 2jf9 h ARG 412 Ca -0.41 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 58.67 2jf9 h ARG 412 Cb 1.29 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2jf9 h ARG 412 CO 0.51 0.60 -0.14 -0.91 -1.51 0.00 0.00 179.97 178.53 2jf9 h ASN 413 N 0.94 0.00 0.75 -3.80 4.21 -1.94 -1.89 115.58 113.85 2jf9 h ASN 413 Ca 0.41 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.79 2jf9 h ASN 413 Cb 0.30 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.48 2jf9 h ASN 413 CO -0.22 0.14 -0.64 1.56 -1.29 0.00 0.00 177.43 176.99 2jf9 h GLN 414 N 0.00 0.00 -0.24 0.81 4.20 -1.62 -3.09 115.11 115.17 2jf9 h GLN 414 Ca -0.00 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.78 2jf9 h GLN 414 Cb 0.30 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 2jf9 h GLN 414 CO 0.02 0.64 0.19 0.78 -0.67 0.00 0.00 178.83 179.78 2jf9 h GLY 415 N 2.13 0.00 2.00 3.46 0.00 -1.14 -1.73 103.07 107.78 2jf9 h GLY 415 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2jf9 h GLY 415 CO 0.08 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.90 2jf9 n LYS 416 N -4.28 0.16 -0.27 4.80 5.02 -1.17 -2.70 118.16 119.73 2jf9 n LYS 416 Ca 0.03 0.48 0.14 0.00 -2.02 0.00 0.00 58.31 56.93 2jf9 n LYS 416 Cb 0.33 -1.86 0.41 0.00 -0.02 0.00 0.00 35.03 33.89 2jf9 n LYS 416 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jf9 s VAL 418 N -5.62 4.22 0.00 0.00 1.01 -1.10 -4.04 120.40 114.87 2jf9 s VAL 418 Ca -0.10 -0.41 -0.37 0.00 0.00 0.00 0.00 61.98 61.11 2jf9 s VAL 418 Cb 0.22 -3.07 -0.16 0.00 0.00 0.00 0.00 36.38 33.37 2jf9 s VAL 418 CO 0.79 0.20 1.48 -1.84 0.00 0.00 0.00 175.10 175.73 2jf9 n GLU 419 N 4.91 1.29 0.00 2.72 0.00 -1.26 -1.28 120.64 127.02 2jf9 n GLU 419 Ca -0.15 0.47 0.00 0.00 0.00 0.00 0.00 57.16 57.47 2jf9 n GLU 419 Cb 0.50 -2.14 0.00 0.00 0.00 0.00 0.00 31.44 29.80 2jf9 n GLU 419 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2jf9 n GLY 420 N 3.06 3.08 0.22 -1.84 0.00 -1.26 -4.89 105.19 103.57 2jf9 n GLY 420 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.32 2jf9 n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2jf9 h MET 421 N 1.64 0.00 0.00 1.61 1.85 -1.40 -3.21 114.93 115.41 2jf9 h MET 421 Ca 0.00 0.00 -0.08 0.00 -0.61 0.00 0.00 59.70 59.01 2jf9 h MET 421 Cb 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 2jf9 h MET 421 CO 0.00 0.23 -0.37 -0.24 -0.40 0.00 0.00 176.91 176.13 2jf9 h VAL 422 N 0.00 1.17 -0.86 -5.77 3.04 -1.75 -0.88 116.25 111.19 2jf9 h VAL 422 Ca -0.00 -1.31 -0.03 0.00 -1.01 0.00 0.00 66.70 64.35 2jf9 h VAL 422 Cb 0.74 1.73 -0.04 0.00 -2.01 0.00 0.00 31.29 31.71 2jf9 h VAL 422 CO 0.03 0.36 0.43 -0.33 -1.01 0.00 0.00 177.57 177.06 2jf9 h GLU 423 N 0.00 1.23 -0.03 4.17 4.39 -1.94 -1.51 114.58 120.89 2jf9 h GLU 423 Ca -0.00 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.52 2jf9 h GLU 423 Cb 0.70 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 29.12 2jf9 h GLU 423 CO 0.05 0.93 -0.02 0.82 -1.16 0.00 0.00 179.01 179.63 2jf9 h ILE 424 N 1.22 1.35 -0.67 3.13 2.04 -1.52 -2.93 117.51 120.13 2jf9 h ILE 424 Ca 0.30 -1.06 0.14 0.00 1.00 0.00 0.00 64.86 65.24 2jf9 h ILE 424 Cb 0.09 1.99 -0.10 0.00 -0.74 0.00 0.00 36.82 38.06 2jf9 h ILE 424 CO -0.04 0.29 0.10 -0.26 0.00 0.00 0.00 178.15 178.23 2jf9 h PHE 425 N -0.34 0.14 -0.41 1.37 -1.00 -1.06 -0.57 116.94 115.06 2jf9 h PHE 425 Ca 0.01 0.04 -0.06 0.00 2.81 0.00 0.00 57.97 60.77 2jf9 h PHE 425 Cb 0.47 0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.06 2jf9 h PHE 425 CO 0.08 -0.11 -0.01 -0.44 -1.61 0.00 0.00 178.31 176.22 2jf9 h ASP 426 N 0.21 0.63 -0.37 2.17 3.32 -1.26 0.68 116.42 121.79 2jf9 h ASP 426 Ca 0.37 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 57.17 2jf9 h ASP 426 Cb 0.60 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2jf9 h ASP 426 CO -0.51 0.70 -0.19 0.24 -1.72 0.00 0.00 179.24 177.77 2jf9 h MET 427 N 0.62 0.79 -0.53 3.56 2.86 -1.10 -2.10 114.93 119.02 2jf9 h MET 427 Ca 0.13 -0.35 -0.04 0.00 -2.06 0.00 0.00 59.70 57.38 2jf9 h MET 427 Cb 0.40 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 2jf9 h MET 427 CO 0.02 0.97 0.17 -0.07 1.06 0.00 0.00 176.91 179.06 2jf9 h LEU 428 N 0.59 0.77 -0.48 1.22 3.38 -0.67 -2.07 115.31 118.04 2jf9 h LEU 428 Ca 0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2jf9 h LEU 428 Cb 0.74 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2jf9 h LEU 428 CO 0.06 0.76 0.21 -0.07 0.09 0.00 0.00 178.44 179.49 2jf9 h LEU 429 N 0.73 0.64 -1.21 1.67 3.38 -0.87 -1.35 115.31 118.29 2jf9 h LEU 429 Ca 0.17 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2jf9 h LEU 429 Cb 0.26 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2jf9 h LEU 429 CO -0.01 0.60 0.51 0.00 0.09 0.00 0.00 178.44 179.63 2jf9 h ALA 430 N 1.06 1.42 -0.38 1.53 0.00 -1.28 -1.07 119.26 120.54 2jf9 h ALA 430 Ca 0.16 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 2jf9 h ALA 430 Cb 0.15 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2jf9 h ALA 430 CO -0.02 0.53 -0.35 1.15 0.00 0.00 0.00 179.25 180.56 2jf9 h THR 431 N 1.06 1.28 -0.56 0.00 2.02 -1.07 -0.94 112.91 114.70 2jf9 h THR 431 Ca 0.28 -1.52 -0.04 0.00 0.77 0.00 0.00 66.41 65.90 2jf9 h THR 431 Cb -0.10 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 2jf9 h THR 431 CO -0.06 0.51 0.18 -1.28 0.37 0.00 0.00 175.52 175.24 2jf9 h SER 432 N 0.72 0.81 -0.42 4.18 0.87 -1.00 -1.51 113.55 117.20 2jf9 h SER 432 Ca 0.06 -0.20 -0.05 0.00 -1.23 0.00 0.00 61.79 60.37 2jf9 h SER 432 Cb 0.94 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 2jf9 h SER 432 CO 0.09 0.80 0.10 -1.28 -0.53 0.00 0.00 176.83 176.01 2jf9 h SER 433 N 0.78 0.71 -0.41 6.23 0.87 -1.06 -1.34 113.55 119.33 2jf9 h SER 433 Ca 0.18 -0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 60.57 2jf9 h SER 433 Cb 0.28 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2jf9 h SER 433 CO -0.01 0.72 0.08 -0.09 -0.53 0.00 0.00 176.83 177.00 2jf9 h ARG 434 N 0.73 0.67 -0.60 2.24 9.65 -0.81 -1.01 114.38 125.25 2jf9 h ARG 434 Ca 0.16 -0.17 -0.05 0.00 -1.10 0.00 0.00 59.98 58.81 2jf9 h ARG 434 Cb 0.31 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.78 2jf9 h ARG 434 CO 0.00 0.70 0.17 0.74 2.80 0.00 0.00 179.97 184.38 2jf9 h PHE 435 N 0.53 0.95 -0.09 2.20 0.04 -1.06 -1.40 116.94 118.11 2jf9 h PHE 435 Ca 0.13 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.80 2jf9 h PHE 435 Cb 0.35 -0.28 -0.00 0.00 2.20 0.00 0.00 35.95 38.22 2jf9 h PHE 435 CO 0.02 0.78 0.04 -0.09 -0.60 0.00 0.00 178.31 178.46 2jf9 h ARG 436 N 0.89 0.14 -0.45 1.51 2.43 -1.06 -2.00 114.38 115.84 2jf9 h ARG 436 Ca 0.20 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.38 2jf9 h ARG 436 Cb 0.29 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 2jf9 h ARG 436 CO -0.00 0.25 0.30 1.98 -1.51 0.00 0.00 179.97 180.98 2jf9 h MET 437 N -0.00 0.46 -0.00 0.20 4.05 -0.98 -0.61 114.93 118.04 2jf9 h MET 437 Ca 0.03 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2jf9 h MET 437 Cb 0.16 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.86 2jf9 h MET 437 CO -0.00 0.30 -0.07 -1.33 0.23 0.00 0.00 176.91 176.03 2jf9 n MET 438 N -4.48 0.38 -3.75 0.39 2.81 -0.54 -4.95 117.12 106.97 2jf9 n MET 438 Ca 0.05 -0.07 -0.24 0.00 -1.81 0.00 0.00 57.70 55.63 2jf9 n MET 438 Cb 0.17 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.21 2jf9 n MET 438 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2jf9 n ASN 439 N -1.25 -2.77 -4.63 7.83 4.13 -0.24 -4.89 115.26 113.45 2jf9 n ASN 439 Ca 0.12 -0.78 -0.48 0.00 1.68 0.00 0.00 54.58 55.12 2jf9 n ASN 439 Cb 0.28 -4.13 -0.05 0.00 -1.54 0.00 0.00 39.78 34.35 2jf9 n ASN 439 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 2jf9 n LEU 440 N -4.45 2.35 -4.90 3.41 7.94 -0.81 -4.97 117.00 115.56 2jf9 n LEU 440 Ca -0.17 1.11 -0.29 0.00 -1.11 0.00 0.00 56.01 55.56 2jf9 n LEU 440 Cb 0.62 -1.31 -0.03 0.00 0.53 0.00 0.00 43.42 43.23 2jf9 n LEU 440 CO 0.70 -0.74 0.24 -1.10 -1.11 0.00 0.00 177.39 175.38 2jf9 s GLN 441 N 0.36 3.65 0.38 1.96 -1.52 -1.26 -4.96 119.66 118.27 2jf9 s GLN 441 Ca 0.78 0.07 0.08 0.00 -1.95 0.00 0.00 55.36 54.34 2jf9 s GLN 441 Cb -0.80 -2.61 0.81 0.00 -0.22 0.00 0.00 33.01 30.20 2jf9 s GLN 441 CO 0.45 0.18 1.97 0.78 -0.25 0.00 0.00 175.29 178.41 2jf9 h GLY 442 N 1.62 0.86 1.48 3.09 0.00 -1.99 0.83 103.07 108.96 2jf9 h GLY 442 Ca -0.48 -0.27 -0.13 0.00 0.00 0.00 0.00 47.33 46.46 2jf9 h GLY 442 CO 0.66 0.19 -0.39 0.83 0.00 0.00 0.00 176.54 177.83 2jf9 h GLU 443 N 0.66 0.57 -0.19 4.80 3.07 -1.98 -2.00 114.58 119.52 2jf9 h GLU 443 Ca 0.30 -0.29 -0.11 0.00 -0.50 0.00 0.00 59.36 58.76 2jf9 h GLU 443 Cb 0.31 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.22 2jf9 h GLU 443 CO -0.10 0.87 -0.31 0.93 -1.40 0.00 0.00 179.01 179.00 2jf9 h GLU 444 N 0.47 0.55 -0.57 2.33 5.08 -1.69 -3.00 114.58 117.74 2jf9 h GLU 444 Ca 0.04 -0.33 0.10 0.00 -1.00 0.00 0.00 59.36 58.17 2jf9 h GLU 444 Cb 0.89 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.09 2jf9 h GLU 444 CO 0.08 0.94 0.13 0.35 -1.00 0.00 0.00 179.01 179.50 2jf9 h PHE 445 N 0.21 0.21 -0.16 4.33 3.57 -0.72 -1.30 116.94 123.07 2jf9 h PHE 445 Ca 0.01 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.44 2jf9 h PHE 445 Cb 0.89 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 2jf9 h PHE 445 CO 0.09 -0.01 -0.37 -0.39 -2.23 0.00 0.00 178.31 175.40 2jf9 h VAL 446 N 0.27 1.30 -0.27 1.41 -1.51 -1.39 -0.86 116.25 115.20 2jf9 h VAL 446 Ca 0.30 -1.46 -0.01 0.00 -1.23 0.00 0.00 66.70 64.29 2jf9 h VAL 446 Cb 0.42 1.59 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 2jf9 h VAL 446 CO -0.37 0.44 0.11 0.00 -1.23 0.00 0.00 177.57 176.53 2jf9 h LEU 448 N 0.29 1.06 -0.61 0.00 3.38 -0.76 -1.24 115.31 117.43 2jf9 h LEU 448 Ca 0.09 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 2jf9 h LEU 448 Cb 0.16 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2jf9 h LEU 448 CO -0.01 0.89 0.08 0.50 0.09 0.00 0.00 178.44 179.99 2jf9 h LYS 449 N 1.15 1.02 -0.54 1.13 3.64 -1.12 -0.90 116.57 120.94 2jf9 h LYS 449 Ca 0.28 -0.29 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 2jf9 h LYS 449 Cb 0.11 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2jf9 h LYS 449 CO -0.04 0.97 0.01 0.77 -2.27 0.00 0.00 179.45 178.89 2jf9 h SER 450 N 0.92 0.89 -0.56 4.20 0.02 -1.35 -2.49 113.55 115.18 2jf9 h SER 450 Ca 0.18 -0.23 0.06 0.00 -0.84 0.00 0.00 61.79 60.96 2jf9 h SER 450 Cb 0.46 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 2jf9 h SER 450 CO 0.02 0.95 0.27 0.40 -1.14 0.00 0.00 176.83 177.32 2jf9 h ILE 451 N 0.85 0.90 -0.33 3.27 2.04 -0.86 -1.39 117.51 122.00 2jf9 h ILE 451 Ca 0.16 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.89 2jf9 h ILE 451 Cb 0.49 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 2jf9 h ILE 451 CO 0.02 0.09 0.10 0.40 0.00 0.00 0.00 178.15 178.77 2jf9 h ILE 452 N 0.51 0.89 -0.19 -0.67 2.04 -0.92 0.36 117.51 119.52 2jf9 h ILE 452 Ca 0.26 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 66.06 2jf9 h ILE 452 Cb 0.21 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2jf9 h ILE 452 CO -0.20 0.04 0.05 0.25 0.00 0.00 0.00 178.15 178.29 2jf9 h LEU 453 N 0.24 0.04 -0.38 1.44 5.85 -1.25 -0.34 115.31 120.91 2jf9 h LEU 453 Ca 0.15 0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.72 2jf9 h LEU 453 Cb 0.13 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 2jf9 h LEU 453 CO -0.17 0.05 -0.81 -0.07 -0.34 0.00 0.00 178.44 177.10 2jf9 h LEU 454 N 0.13 0.05 -0.72 2.25 3.38 -0.91 -3.11 115.31 116.38 2jf9 h LEU 454 Ca 0.08 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2jf9 h LEU 454 Cb 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2jf9 h LEU 454 CO -0.10 0.84 -0.06 -3.20 0.09 0.00 0.00 178.44 176.01 2jf9 n ASN 455 N -3.60 1.17 -4.60 -0.43 4.05 0.12 -4.98 115.26 107.00 2jf9 n ASN 455 Ca -0.01 -1.26 -0.58 0.00 0.45 0.00 0.00 54.58 53.18 2jf9 n ASN 455 Cb 0.78 0.02 -0.07 0.00 1.23 0.00 0.00 39.78 41.73 2jf9 n ASN 455 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 177.26 173.97 2jf9 n SER 456 N -0.19 1.08 0.00 1.20 2.88 -0.15 -4.70 113.62 113.73 2jf9 n SER 456 Ca 0.18 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.86 2jf9 n SER 456 Cb 0.32 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 2jf9 n SER 456 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jf9 n GLY 457 N 2.60 -0.13 2.77 0.46 0.00 -1.26 -4.87 105.19 104.75 2jf9 n GLY 457 Ca 0.22 -1.25 -0.19 0.00 0.00 0.00 0.00 46.02 44.81 2jf9 n GLY 457 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jf9 s VAL 458 N 0.00 -0.23 0.03 1.61 1.01 -1.26 -5.15 120.40 116.40 2jf9 s VAL 458 Ca 0.00 0.23 -0.21 0.00 0.00 0.00 0.00 61.98 62.00 2jf9 s VAL 458 Cb 0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 36.38 35.85 2jf9 s VAL 458 CO 0.00 0.04 1.28 -0.08 0.00 0.00 0.00 175.10 176.35 2jf9 h GLU 470 N 8.37 0.34 -0.35 2.72 4.57 -2.08 -3.55 114.58 124.60 2jf9 h GLU 470 Ca -0.14 -0.21 0.01 0.00 -1.18 0.00 0.00 59.36 57.84 2jf9 h GLU 470 Cb 1.13 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.72 2jf9 h GLU 470 CO 0.18 0.79 0.22 1.49 -1.18 0.00 0.00 179.01 180.52 2jf9 h GLU 471 N -0.08 0.44 -3.74 1.92 4.81 -2.09 -3.42 114.58 112.42 2jf9 h GLU 471 Ca 0.01 -0.03 -0.37 0.00 -0.13 0.00 0.00 59.36 58.84 2jf9 h GLU 471 Cb 0.77 -0.10 -0.35 0.00 0.63 0.00 0.00 28.75 29.70 2jf9 h GLU 471 CO 0.04 0.29 -0.75 0.15 -0.73 0.00 0.00 179.01 178.01 2jf9 s LYS 472 N -6.16 0.42 0.90 1.92 1.02 -1.26 -5.12 119.74 111.45 2jf9 s LYS 472 Ca -0.13 0.07 -0.13 0.00 0.02 0.00 0.00 55.97 55.79 2jf9 s LYS 472 Cb 0.10 -0.62 0.20 0.00 -0.52 0.00 0.00 37.83 37.00 2jf9 s LYS 472 CO 0.71 -0.16 1.22 -0.40 -0.92 0.00 0.00 175.35 175.80 2jf9 n ASP 473 N 4.34 0.29 -0.13 2.83 5.68 -1.26 -4.84 116.55 123.46 2jf9 n ASP 473 Ca -0.22 -1.56 -0.06 0.00 -0.50 0.00 0.00 54.79 52.45 2jf9 n ASP 473 Cb 0.50 -0.91 0.03 0.00 -1.14 0.00 0.00 41.12 39.60 2jf9 n ASP 473 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 2jf9 h HIS 474 N -1.55 0.35 -0.50 2.11 -0.00 -2.01 -1.92 115.15 111.63 2jf9 h HIS 474 Ca -0.40 0.02 0.03 0.00 -0.00 0.00 0.00 60.37 60.03 2jf9 h HIS 474 Cb 1.14 -0.10 -0.04 0.00 -0.00 0.00 0.00 27.41 28.41 2jf9 h HIS 474 CO 0.00 0.17 0.28 0.82 -0.00 0.00 0.00 177.93 179.20 2jf9 h ILE 475 N 0.39 1.01 -0.61 6.26 2.04 -1.95 -0.95 117.51 123.70 2jf9 h ILE 475 Ca 0.18 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.90 2jf9 h ILE 475 Cb 0.11 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.55 2jf9 h ILE 475 CO -0.14 0.10 0.34 -0.74 0.00 0.00 0.00 178.15 177.71 2jf9 h HIS 476 N 0.55 0.62 -0.56 1.37 2.76 -1.85 0.11 115.15 118.15 2jf9 h HIS 476 Ca 0.21 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.34 2jf9 h HIS 476 Cb 0.07 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 28.82 2jf9 h HIS 476 CO -0.08 0.32 0.08 0.00 -1.30 0.00 0.00 177.93 176.95 2jf9 h ARG 477 N 0.64 0.94 -0.62 5.26 3.08 -0.66 -1.35 114.38 121.66 2jf9 h ARG 477 Ca 0.26 -0.26 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 2jf9 h ARG 477 Cb 0.13 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2jf9 h ARG 477 CO -0.16 0.90 0.10 0.28 -1.07 0.00 0.00 179.97 180.03 2jf9 h VAL 478 N 0.83 1.26 -0.63 2.04 2.07 -0.99 -2.31 116.25 118.52 2jf9 h VAL 478 Ca 0.17 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 2jf9 h VAL 478 Cb 0.43 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 2jf9 h VAL 478 CO 0.01 0.38 0.33 -0.07 0.02 0.00 0.00 177.57 178.24 2jf9 h LEU 479 N 0.94 0.78 -0.92 2.57 3.38 -0.47 -1.55 115.31 120.04 2jf9 h LEU 479 Ca 0.19 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2jf9 h LEU 479 Cb 0.43 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2jf9 h LEU 479 CO 0.01 0.64 0.48 0.44 0.09 0.00 0.00 178.44 180.10 2jf9 h ASP 480 N 0.88 1.12 -0.43 -0.43 3.32 -0.85 -1.29 116.42 118.73 2jf9 h ASP 480 Ca 0.22 -0.10 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 2jf9 h ASP 480 Cb 0.04 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 2jf9 h ASP 480 CO -0.03 0.90 0.01 0.11 -1.72 0.00 0.00 179.24 178.50 2jf9 h LYS 481 N 1.25 0.84 -0.28 3.56 1.79 -0.79 -1.08 116.57 121.86 2jf9 h LYS 481 Ca 0.31 -0.23 -0.12 0.00 -2.18 0.00 0.00 60.65 58.43 2jf9 h LYS 481 Cb 0.04 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.58 2jf9 h LYS 481 CO -0.05 0.84 -0.32 0.82 -1.08 0.00 0.00 179.45 179.65 2jf9 h ILE 482 N 0.78 1.28 -0.07 1.86 2.04 -0.84 -1.58 117.51 120.99 2jf9 h ILE 482 Ca 0.15 -1.44 0.00 0.00 1.00 0.00 0.00 64.86 64.57 2jf9 h ILE 482 Cb 0.46 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.96 2jf9 h ILE 482 CO 0.02 0.46 0.04 0.74 0.00 0.00 0.00 178.15 179.41 2jf9 h THR 483 N 0.50 1.01 -1.01 -0.27 2.02 -0.95 -0.47 112.91 113.76 2jf9 h THR 483 Ca 0.06 -0.03 0.18 0.00 0.77 0.00 0.00 66.41 67.39 2jf9 h THR 483 Cb 0.80 0.92 -0.10 0.00 -1.74 0.00 0.00 68.15 68.03 2jf9 h THR 483 CO 0.07 0.02 0.62 0.44 0.37 0.00 0.00 175.52 177.03 2jf9 h ASP 484 N 0.09 0.81 -0.20 4.18 3.32 -1.02 -1.31 116.42 122.29 2jf9 h ASP 484 Ca 0.03 0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.08 2jf9 h ASP 484 Cb -0.01 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 2jf9 h ASP 484 CO -0.01 0.31 -0.20 0.74 -1.72 0.00 0.00 179.24 178.37 2jf9 h THR 485 N 0.81 1.33 -0.36 0.35 2.02 -0.65 -0.63 112.91 115.78 2jf9 h THR 485 Ca 0.57 -1.36 0.05 0.00 0.77 0.00 0.00 66.41 66.44 2jf9 h THR 485 Cb 0.83 1.76 -0.04 0.00 -1.74 0.00 0.00 68.15 68.95 2jf9 h THR 485 CO -0.36 0.41 0.09 -0.07 0.37 0.00 0.00 175.52 175.96 2jf9 h LEU 486 N 0.16 0.06 -0.56 2.58 3.38 -0.66 -0.83 115.31 119.44 2jf9 h LEU 486 Ca 0.03 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2jf9 h LEU 486 Cb 0.74 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 2jf9 h LEU 486 CO 0.05 0.07 0.29 0.40 0.09 0.00 0.00 178.44 179.34 2jf9 h ILE 487 N 0.23 1.19 -0.38 1.22 1.08 -1.20 -1.80 117.51 117.85 2jf9 h ILE 487 Ca 0.17 -0.52 0.07 0.00 -0.39 0.00 0.00 64.86 64.19 2jf9 h ILE 487 Cb 0.17 0.51 -0.06 0.00 -3.07 0.00 0.00 36.82 34.38 2jf9 h ILE 487 CO -0.20 0.21 0.01 -0.74 -0.69 0.00 0.00 178.15 176.75 2jf9 h HIS 488 N 0.75 0.00 -0.71 1.37 2.76 -0.83 0.78 115.15 119.29 2jf9 h HIS 488 Ca 0.19 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.45 2jf9 h HIS 488 Cb 0.08 0.06 -0.06 0.00 1.55 0.00 0.00 27.41 29.04 2jf9 h HIS 488 CO -0.01 -0.06 0.41 -0.07 -1.30 0.00 0.00 177.93 176.90 2jf9 h LEU 489 N 0.12 0.61 -0.34 0.26 3.38 -0.85 -0.71 115.31 117.77 2jf9 h LEU 489 Ca 0.19 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 2jf9 h LEU 489 Cb 0.25 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2jf9 h LEU 489 CO -0.30 0.39 -0.06 0.24 0.09 0.00 0.00 178.44 178.80 2jf9 h MET 490 N 0.74 0.65 -0.67 1.13 2.86 -0.70 -2.34 114.93 116.61 2jf9 h MET 490 Ca 0.32 -0.24 0.04 0.00 -2.06 0.00 0.00 59.70 57.75 2jf9 h MET 490 Cb 0.19 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 2jf9 h MET 490 CO -0.18 0.81 0.41 0.00 1.06 0.00 0.00 176.91 179.00 2jf9 h ALA 491 N 0.82 0.87 -0.08 6.32 0.00 -0.68 -2.09 119.26 124.43 2jf9 h ALA 491 Ca 0.09 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2jf9 h ALA 491 Cb 0.55 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2jf9 h ALA 491 CO 0.03 0.15 -0.37 -0.22 0.00 0.00 0.00 179.25 178.84 2jf9 h LYS 492 N 0.79 0.16 0.00 0.00 3.64 -1.02 -1.51 116.57 118.62 2jf9 h LYS 492 Ca 0.27 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2jf9 h LYS 492 Cb 0.06 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2jf9 h LYS 492 CO -0.12 0.52 0.00 0.00 -2.27 0.00 0.00 179.45 177.57 2jf9 n ALA 493 N -2.47 2.35 -0.31 5.00 0.00 -0.89 -4.89 120.51 119.29 2jf9 n ALA 493 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2jf9 n ALA 493 Cb 0.43 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2jf9 n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jf9 n GLY 494 N 0.67 0.84 3.77 0.00 0.00 -0.57 -5.06 105.19 104.85 2jf9 n GLY 494 Ca 0.16 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 2jf9 n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jf9 s LEU 495 N 0.00 4.15 0.87 0.99 1.02 -0.82 -5.01 118.68 119.88 2jf9 s LEU 495 Ca 0.00 2.39 -0.12 0.00 0.02 0.00 0.00 54.13 56.42 2jf9 s LEU 495 Cb 0.00 -4.05 0.11 0.00 0.02 0.00 0.00 46.19 42.27 2jf9 s LEU 495 CO 0.00 -0.77 1.10 0.42 0.02 0.00 0.00 176.35 177.13 2jf9 s THR 496 N -1.42 2.62 0.20 5.49 -4.23 -1.26 -4.59 115.64 112.45 2jf9 s THR 496 Ca 0.59 0.20 -0.10 0.00 -1.18 0.00 0.00 61.69 61.20 2jf9 s THR 496 Cb -0.31 -2.86 0.14 0.00 1.34 0.00 0.00 72.50 70.81 2jf9 s THR 496 CO 0.39 -0.26 1.83 -0.07 -0.54 0.00 0.00 174.62 175.97 2jf9 h LEU 497 N -1.38 0.91 -0.52 4.79 3.38 -1.99 0.60 115.31 121.10 2jf9 h LEU 497 Ca -0.49 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.41 2jf9 h LEU 497 Cb 1.29 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 2jf9 h LEU 497 CO 0.59 0.74 0.32 -0.61 0.09 0.00 0.00 178.44 179.56 2jf9 h GLN 498 N 1.02 0.61 -0.88 1.13 4.15 -2.00 -1.65 115.11 117.48 2jf9 h GLN 498 Ca 0.26 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.62 2jf9 h GLN 498 Cb 0.02 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 27.53 2jf9 h GLN 498 CO -0.04 0.40 0.46 1.96 -1.93 0.00 0.00 178.83 179.68 2jf9 h GLN 499 N 0.63 1.24 0.05 1.69 4.20 -1.78 -0.90 115.11 120.24 2jf9 h GLN 499 Ca 0.21 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 2jf9 h GLN 499 Cb 0.02 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.56 2jf9 h GLN 499 CO -0.09 0.92 -0.02 1.96 -0.67 0.00 0.00 178.83 180.93 2jf9 h GLN 500 N 1.24 -0.06 -0.48 1.46 4.20 -0.47 -0.77 115.11 120.23 2jf9 h GLN 500 Ca 0.31 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.93 2jf9 h GLN 500 Cb 0.06 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 2jf9 h GLN 500 CO -0.05 -0.01 -0.07 0.45 -0.67 0.00 0.00 178.83 178.49 2jf9 h HIS 501 N -0.10 0.93 -0.74 2.96 3.86 -1.12 -1.18 115.15 119.76 2jf9 h HIS 501 Ca -0.01 -0.16 -0.03 0.00 -1.16 0.00 0.00 60.37 59.01 2jf9 h HIS 501 Cb 0.09 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.28 2jf9 h HIS 501 CO -0.06 0.88 0.36 1.96 0.86 0.00 0.00 177.93 181.93 2jf9 h GLN 502 N 0.78 1.07 -0.11 2.45 4.20 -1.01 -1.87 115.11 120.61 2jf9 h GLN 502 Ca 0.14 -0.16 -0.23 0.00 0.06 0.00 0.00 58.65 58.46 2jf9 h GLN 502 Cb 0.57 -0.19 0.01 0.00 0.30 0.00 0.00 27.48 28.17 2jf9 h GLN 502 CO 0.03 0.84 -0.83 -0.09 -0.67 0.00 0.00 178.83 178.11 2jf9 h ARG 503 N 1.05 0.74 -0.44 1.46 2.43 -0.93 -1.60 114.38 117.09 2jf9 h ARG 503 Ca 0.26 -0.64 0.08 0.00 -0.81 0.00 0.00 59.98 58.86 2jf9 h ARG 503 Cb 0.12 0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 29.75 2jf9 h ARG 503 CO -0.03 1.25 0.05 1.25 -1.51 0.00 0.00 179.97 180.98 2jf9 h LEU 504 N 0.49 -0.07 -0.37 3.80 5.85 -1.16 -1.15 115.31 122.70 2jf9 h LEU 504 Ca -0.07 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2jf9 h LEU 504 Cb 1.47 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.61 2jf9 h LEU 504 CO 0.17 -0.00 0.21 0.00 -0.34 0.00 0.00 178.44 178.47 2jf9 h ALA 505 N 1.36 0.47 -0.39 1.25 0.00 -1.18 -1.90 119.26 118.87 2jf9 h ALA 505 Ca 0.22 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.08 2jf9 h ALA 505 Cb 0.29 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2jf9 h ALA 505 CO -0.31 -0.01 0.22 1.96 0.00 0.00 0.00 179.25 181.10 2jf9 h GLN 506 N 0.47 0.43 -0.18 0.00 4.20 -1.03 -0.63 115.11 118.36 2jf9 h GLN 506 Ca 0.13 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.81 2jf9 h GLN 506 Cb 0.04 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2jf9 h GLN 506 CO -0.02 0.28 0.10 -0.07 -0.67 0.00 0.00 178.83 178.45 2jf9 h LEU 507 N 0.44 0.23 -1.10 1.46 3.38 -1.10 -2.69 115.31 115.93 2jf9 h LEU 507 Ca 0.16 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 2jf9 h LEU 507 Cb 0.03 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2jf9 h LEU 507 CO -0.09 0.25 -0.39 -0.07 0.09 0.00 0.00 178.44 178.24 2jf9 h LEU 508 N 0.19 0.12 -1.18 1.67 3.38 -1.08 -2.48 115.31 115.93 2jf9 h LEU 508 Ca 0.06 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2jf9 h LEU 508 Cb 0.07 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2jf9 h LEU 508 CO -0.01 0.50 0.01 -0.07 0.09 0.00 0.00 178.44 178.96 2jf9 h LEU 509 N 0.10 0.54 -1.69 1.67 3.38 -0.98 -2.02 115.31 116.30 2jf9 h LEU 509 Ca 0.01 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2jf9 h LEU 509 Cb 0.73 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 2jf9 h LEU 509 CO 0.05 0.60 -0.15 0.40 0.09 0.00 0.00 178.44 179.44 2jf9 h ILE 510 N 0.55 1.11 -0.19 1.22 2.04 -1.11 -1.66 117.51 119.47 2jf9 h ILE 510 Ca 0.12 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 2jf9 h ILE 510 Cb 0.34 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 2jf9 h ILE 510 CO 0.01 0.15 0.08 -0.07 0.00 0.00 0.00 178.15 178.33 2jf9 h LEU 511 N 0.00 0.22 -0.70 1.44 3.38 -1.26 -0.82 115.31 117.58 2jf9 h LEU 511 Ca -0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2jf9 h LEU 511 Cb 0.27 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2jf9 h LEU 511 CO 0.02 0.20 0.40 0.28 0.09 0.00 0.00 178.44 179.43 2jf9 h SER 512 N 0.26 0.86 -0.37 -0.43 0.02 -1.31 -0.60 113.55 111.97 2jf9 h SER 512 Ca 0.07 -0.08 -0.09 0.00 -0.84 0.00 0.00 61.79 60.85 2jf9 h SER 512 Cb 0.04 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 2jf9 h SER 512 CO -0.01 0.69 -0.07 0.45 -1.14 0.00 0.00 176.83 176.75 2jf9 h HIS 513 N 0.96 0.87 -0.64 3.45 3.86 -1.30 -1.61 115.15 120.73 2jf9 h HIS 513 Ca 0.25 -0.15 -0.08 0.00 -1.16 0.00 0.00 60.37 59.23 2jf9 h HIS 513 Cb 0.01 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.23 2jf9 h HIS 513 CO -0.01 0.84 0.07 0.82 0.86 0.00 0.00 177.93 180.51 2jf9 h ILE 514 N 0.73 1.26 -0.40 2.45 2.04 -0.85 -1.15 117.51 121.59 2jf9 h ILE 514 Ca 0.13 -1.08 0.02 0.00 1.00 0.00 0.00 64.86 64.93 2jf9 h ILE 514 Cb 0.55 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 2jf9 h ILE 514 CO 0.03 0.40 0.22 -0.09 0.00 0.00 0.00 178.15 178.72 2jf9 h ARG 515 N 1.00 0.44 -0.25 2.37 9.65 -0.96 -0.58 114.38 126.06 2jf9 h ARG 515 Ca 0.19 -0.03 0.02 0.00 -1.10 0.00 0.00 59.98 59.07 2jf9 h ARG 515 Cb 0.48 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.94 2jf9 h ARG 515 CO 0.02 0.29 0.10 1.25 2.80 0.00 0.00 179.97 184.43 2jf9 h HIS 516 N 0.45 0.17 -0.60 2.20 2.76 -0.95 -0.50 115.15 118.69 2jf9 h HIS 516 Ca 0.16 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.30 2jf9 h HIS 516 Cb 0.03 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 28.92 2jf9 h HIS 516 CO -0.08 0.09 0.22 0.52 -1.30 0.00 0.00 177.93 177.37 2jf9 h MET 517 N 0.22 0.92 -0.50 5.26 2.86 -0.96 -0.96 114.93 121.76 2jf9 h MET 517 Ca 0.11 -0.18 0.03 0.00 -2.06 0.00 0.00 59.70 57.60 2jf9 h MET 517 Cb 0.07 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 2jf9 h MET 517 CO -0.10 0.80 0.28 1.03 1.06 0.00 0.00 176.91 179.97 2jf9 h SER 518 N 0.85 0.43 -0.62 1.22 0.87 -0.86 0.06 113.55 115.51 2jf9 h SER 518 Ca 0.20 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2jf9 h SER 518 Cb 0.24 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 2jf9 h SER 518 CO -0.01 0.30 0.38 0.78 -0.53 0.00 0.00 176.83 177.75 2jf9 h ASN 519 N 0.55 0.74 -0.61 6.23 2.35 -0.53 0.07 115.58 124.38 2jf9 h ASN 519 Ca 0.21 -0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.83 2jf9 h ASN 519 Cb 0.07 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 2jf9 h ASN 519 CO -0.12 0.58 0.10 0.11 -1.65 0.00 0.00 177.43 176.45 2jf9 h LYS 520 N 0.83 1.03 -0.29 0.81 1.79 -0.98 -1.82 116.57 117.94 2jf9 h LYS 520 Ca 0.22 -0.26 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2jf9 h LYS 520 Cb -0.03 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.48 2jf9 h LYS 520 CO -0.04 0.95 0.14 0.78 -1.08 0.00 0.00 179.45 180.20 2jf9 h GLY 521 N 1.04 0.46 1.06 3.86 0.00 -0.53 -1.49 103.07 107.46 2jf9 h GLY 521 Ca 0.19 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.26 2jf9 h GLY 521 CO 0.01 0.22 0.35 -0.33 0.00 0.00 0.00 176.54 176.79 2jf9 h MET 522 N 0.34 1.21 -0.18 4.80 2.86 -0.89 0.47 114.93 123.53 2jf9 h MET 522 Ca 0.10 -0.20 0.05 0.00 -2.06 0.00 0.00 59.70 57.59 2jf9 h MET 522 Cb 0.12 -0.20 -0.06 0.00 0.06 0.00 0.00 31.60 31.52 2jf9 h MET 522 CO -0.01 0.95 -0.21 0.93 1.06 0.00 0.00 176.91 179.63 2jf9 h GLU 523 N 1.18 -0.23 -0.58 1.72 5.08 -1.21 -0.08 114.58 120.46 2jf9 h GLU 523 Ca 0.28 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.63 2jf9 h GLU 523 Cb 0.18 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2jf9 h GLU 523 CO -0.03 -0.16 0.27 1.25 -1.00 0.00 0.00 179.01 179.35 2jf9 h HIS 524 N -0.24 0.84 -0.52 4.33 2.76 -0.74 -0.95 115.15 120.63 2jf9 h HIS 524 Ca 0.12 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.20 2jf9 h HIS 524 Cb 0.42 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 2jf9 h HIS 524 CO -0.34 0.65 0.16 -0.07 -1.30 0.00 0.00 177.93 177.03 2jf9 h LEU 525 N 0.79 0.75 -0.69 0.26 3.38 -0.82 -2.46 115.31 116.52 2jf9 h LEU 525 Ca 0.20 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2jf9 h LEU 525 Cb 0.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2jf9 h LEU 525 CO -0.02 0.76 -0.13 1.88 0.09 0.00 0.00 178.44 181.02 2jf9 h TYR 526 N 0.70 0.98 0.00 1.13 0.99 -0.81 -2.57 116.97 117.39 2jf9 h TYR 526 Ca 0.17 -0.20 -0.04 0.00 2.00 0.00 0.00 58.73 60.66 2jf9 h TYR 526 Cb 0.28 -0.24 -0.01 0.00 1.00 0.00 0.00 36.73 37.76 2jf9 h TYR 526 CO 0.02 0.95 -0.20 0.66 -0.00 0.00 0.00 178.16 179.58 2jf9 h SER 527 N 0.79 0.00 0.59 3.88 4.64 -1.10 -3.08 113.55 119.27 2jf9 h SER 527 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2jf9 h SER 527 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2jf9 h SER 527 CO 0.05 0.20 -1.07 1.15 -0.87 0.00 0.00 176.83 176.28 2jf9 n MET 528 N -3.30 0.41 0.00 4.77 0.00 -0.93 -5.09 117.12 112.97 2jf9 n MET 528 Ca 0.01 0.02 0.06 0.00 0.00 0.00 0.00 57.70 57.78 2jf9 n MET 528 Cb 0.45 -1.66 0.33 0.00 0.00 0.00 0.00 33.22 32.35 2jf9 n MET 528 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60