#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jqe s GLU 312 N 0.00 2.44 -1.26 3.17 -1.05 -1.26 -4.67 118.70 116.07 2jqe s GLU 312 Ca 0.00 -1.32 -0.01 0.00 -0.15 0.00 0.00 54.97 53.50 2jqe s GLU 312 Cb 0.00 -2.26 -0.00 0.00 -0.44 0.00 0.00 34.13 31.43 2jqe s GLU 312 CO 0.00 0.38 0.80 1.17 0.95 0.00 0.00 175.26 178.56 2jqe n LYS 313 N -0.90 -5.31 0.00 -4.83 3.00 -1.26 -4.95 118.16 103.91 2jqe n LYS 313 Ca -0.07 0.69 0.00 0.00 -0.00 0.00 0.00 58.31 58.93 2jqe n LYS 313 Cb 0.58 -5.39 0.00 0.00 0.00 0.00 0.00 35.03 30.23 2jqe n LYS 313 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2jqe n GLY 314 N -1.43 -0.22 2.89 3.14 0.00 -1.26 -5.02 105.19 103.29 2jqe n GLY 314 Ca -0.29 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 2jqe n GLY 314 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jqe s THR 315 N 0.00 1.13 0.00 2.61 -1.32 -1.26 -4.95 115.64 111.85 2jqe s THR 315 Ca 0.00 -0.66 0.00 0.00 -1.21 0.00 0.00 61.69 59.82 2jqe s THR 315 Cb 0.00 -1.31 0.00 0.00 -1.51 0.00 0.00 72.50 69.68 2jqe s THR 315 CO 0.00 0.11 0.00 0.49 -2.21 0.00 0.00 174.62 173.01 2jqe n PHE 316 N 4.86 0.00 0.00 9.09 3.72 -1.26 -4.94 117.46 128.94 2jqe n PHE 316 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 2jqe n PHE 316 Cb 0.47 -0.82 0.00 0.00 -0.94 0.00 0.00 39.48 38.19 2jqe n PHE 316 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2jqe n THR 317 N 1.22 0.00 -0.56 4.37 -2.24 -1.26 -4.94 114.28 110.87 2jqe n THR 317 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2jqe n THR 317 Cb 0.39 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 2jqe n THR 317 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2jqe n LEU 318 N 0.00 0.47 0.03 3.22 4.32 -1.25 -4.71 117.00 119.08 2jqe n LEU 318 Ca 0.00 -0.47 0.13 0.00 -0.02 0.00 0.00 56.01 55.65 2jqe n LEU 318 Cb 0.00 0.00 0.40 0.00 -1.62 0.00 0.00 43.42 42.20 2jqe n LEU 318 CO 0.00 0.12 0.69 1.17 -1.22 0.00 0.00 177.39 178.15 2jqe n LYS 319 N -0.01 0.09 0.21 3.23 4.81 -1.26 -3.57 118.16 121.65 2jqe n LYS 319 Ca 0.00 0.05 0.14 0.00 -0.87 0.00 0.00 58.31 57.63 2jqe n LYS 319 Cb 0.16 -1.58 0.42 0.00 0.02 0.00 0.00 35.03 34.05 2jqe n LYS 319 CO 0.00 0.00 0.00 0.38 1.17 0.00 0.00 177.40 178.95 2jqe h ASP 320 N 0.00 0.00 0.93 3.14 2.03 -1.94 -3.12 116.42 117.47 2jqe h ASP 320 Ca 0.00 0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.21 2jqe h ASP 320 Cb 0.58 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.06 2jqe h ASP 320 CO 0.00 0.00 -1.12 0.16 -1.03 0.00 0.00 179.24 177.25 2jqe h ILE 321 N 0.00 0.29 -0.31 4.15 3.07 -1.91 -3.33 117.51 119.46 2jqe h ILE 321 Ca 0.00 -1.54 -0.00 0.00 1.55 0.00 0.00 64.86 64.87 2jqe h ILE 321 Cb 0.72 1.83 -0.02 0.00 -0.27 0.00 0.00 36.82 39.08 2jqe h ILE 321 CO 0.00 0.16 0.19 0.22 -1.05 0.00 0.00 178.15 177.67 2jqe h TYR 322 N 0.00 0.41 -0.26 0.16 5.03 -1.70 -2.41 116.97 118.21 2jqe h TYR 322 Ca -0.08 -0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.17 2jqe h TYR 322 Cb 1.30 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 39.43 2jqe h TYR 322 CO 0.00 0.30 -0.10 0.87 -1.32 0.00 0.00 178.16 177.91 2jqe h LYS 323 N 0.41 0.42 -0.89 1.82 1.57 -1.71 -2.28 116.57 115.90 2jqe h LYS 323 Ca 0.11 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2jqe h LYS 323 Cb 0.01 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 2jqe h LYS 323 CO -0.02 0.52 0.52 0.37 -0.57 0.00 0.00 179.45 180.27 2jqe h GLN 324 N 0.39 1.22 0.00 3.15 4.15 -1.55 -2.31 115.11 120.16 2jqe h GLN 324 Ca 0.08 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2jqe h GLN 324 Cb 0.41 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.85 2jqe h GLN 324 CO 0.02 0.87 -0.26 0.82 -1.93 0.00 0.00 178.83 178.35 2jqe h ILE 325 N 1.23 0.00 -0.92 2.39 1.08 -1.28 -3.29 117.51 116.72 2jqe h ILE 325 Ca 0.32 -0.92 0.21 0.00 -0.39 0.00 0.00 64.86 64.09 2jqe h ILE 325 Cb -0.02 1.78 -0.07 0.00 -3.07 0.00 0.00 36.82 35.44 2jqe h ILE 325 CO -0.06 0.00 0.61 -0.08 -0.69 0.00 0.00 178.15 177.93 2jqe h GLU 326 N 0.00 0.38 -0.59 2.37 4.22 -0.83 0.13 114.58 120.26 2jqe h GLU 326 Ca 0.00 -0.02 0.02 0.00 0.08 0.00 0.00 59.36 59.43 2jqe h GLU 326 Cb 0.96 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.09 2jqe h GLU 326 CO 0.00 0.25 0.39 0.00 -2.18 0.00 0.00 179.01 177.47 2jqe h ALA 327 N 1.61 1.63 -0.52 2.92 0.00 -1.64 -3.48 119.26 119.77 2jqe h ALA 327 Ca 0.48 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2jqe h ALA 327 Cb 1.24 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2jqe h ALA 327 CO -0.18 0.33 0.00 -1.33 0.00 0.00 0.00 179.25 178.07 2jqe n MET 328 N -4.46 0.00 -1.53 0.00 2.81 0.03 -3.43 117.12 110.54 2jqe n MET 328 Ca 0.06 0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.61 2jqe n MET 328 Cb 0.08 0.00 0.06 0.00 -0.71 0.00 0.00 33.22 32.66 2jqe n MET 328 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2jqe n ASN 329 N -3.61 7.28 -4.57 7.83 6.94 -1.26 -4.97 115.26 122.89 2jqe n ASN 329 Ca 0.00 -3.79 -0.40 0.00 -0.02 0.00 0.00 54.58 50.37 2jqe n ASN 329 Cb 0.00 -0.90 -0.03 0.00 -2.36 0.00 0.00 39.78 36.49 2jqe n ASN 329 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 2jqe s LYS 330 N -3.83 2.69 0.33 -3.83 2.20 -1.22 -4.81 119.74 111.27 2jqe s LYS 330 Ca 0.61 1.46 0.05 0.00 -0.36 0.00 0.00 55.97 57.73 2jqe s LYS 330 Cb 0.48 -4.43 0.58 0.00 -1.51 0.00 0.00 37.83 32.96 2jqe s LYS 330 CO -0.07 -2.62 1.85 0.52 -0.36 0.00 0.00 175.35 174.67 2jqe h MET 331 N 16.42 0.48 0.00 4.03 2.86 -1.94 -3.47 114.93 133.31 2jqe h MET 331 Ca -0.31 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 2jqe h MET 331 Cb 1.23 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.82 2jqe h MET 331 CO 1.09 0.56 0.00 0.41 1.06 0.00 0.00 176.91 180.03 2jqe n GLY 332 N -0.78 2.79 3.78 8.32 0.00 -1.26 -5.11 105.19 112.93 2jqe n GLY 332 Ca 0.01 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 2jqe n GLY 332 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jqe s PRO 333 N 0.00 2.47 0.02 1.61 0.04 -1.26 -5.06 135.00 132.81 2jqe s PRO 333 Ca 0.00 1.12 0.06 0.00 0.04 0.00 0.00 61.00 62.22 2jqe s PRO 333 Cb 0.00 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 2jqe s PRO 333 CO 0.00 -1.48 -0.19 0.54 0.04 0.00 0.00 177.00 175.91 2jqe s VAL 334 N -2.91 1.50 -0.96 -0.36 0.11 -1.26 -5.08 120.40 111.43 2jqe s VAL 334 Ca 0.61 -1.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.51 2jqe s VAL 334 Cb -0.16 -1.28 0.20 0.00 -1.53 0.00 0.00 36.38 33.60 2jqe s VAL 334 CO 0.55 0.25 1.02 -0.60 -3.33 0.00 0.00 175.10 172.99 2jqe s ARG 335 N -0.88 3.78 0.38 1.54 3.52 -1.26 -4.84 118.95 121.20 2jqe s ARG 335 Ca 0.06 -2.44 0.16 0.00 -0.13 0.00 0.00 55.73 53.38 2jqe s ARG 335 Cb -0.08 -4.66 0.78 0.00 -1.56 0.00 0.00 34.95 29.43 2jqe s ARG 335 CO 0.01 -1.47 1.82 1.57 -0.81 0.00 0.00 175.30 176.42 2jqe h LYS 336 N 7.76 0.00 -3.77 5.12 2.10 -2.06 -3.49 116.57 122.23 2jqe h LYS 336 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 2jqe h LYS 336 Cb 0.98 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.31 2jqe h LYS 336 CO 0.96 0.36 -0.97 1.51 -2.00 0.00 0.00 179.45 179.31 2jqe n ILE 337 N -3.90 -3.28 0.00 0.07 0.13 -1.26 -5.03 119.36 106.09 2jqe n ILE 337 Ca -0.01 1.61 0.00 0.00 -1.10 0.00 0.00 62.75 63.24 2jqe n ILE 337 Cb 0.42 -2.58 0.00 0.00 -0.84 0.00 0.00 39.64 36.64 2jqe n ILE 337 CO 0.00 0.00 0.00 0.33 2.80 0.00 0.00 176.55 179.68 2jqe n PHE 338 N -2.39 0.00 -3.81 9.51 7.35 -1.26 -5.13 117.46 121.73 2jqe n PHE 338 Ca 0.00 0.00 -0.24 0.00 -0.76 0.00 0.00 57.45 56.45 2jqe n PHE 338 Cb 0.42 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.23 2jqe n PHE 338 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 2jqe s GLU 339 N -1.00 3.47 0.91 -4.13 2.02 -1.26 -5.11 118.70 113.60 2jqe s GLU 339 Ca 0.00 -0.55 -0.13 0.00 0.02 0.00 0.00 54.97 54.31 2jqe s GLU 339 Cb 0.00 -2.87 0.19 0.00 0.10 0.00 0.00 34.13 31.55 2jqe s GLU 339 CO 0.00 0.41 1.26 -1.64 0.02 0.00 0.00 175.26 175.31 2jqe s MET 340 N -3.65 0.84 0.14 1.61 -1.94 -1.26 -4.87 119.30 110.17 2jqe s MET 340 Ca 0.36 -0.56 0.00 0.00 -1.71 0.00 0.00 55.69 53.79 2jqe s MET 340 Cb -0.10 -1.94 0.00 0.00 2.01 0.00 0.00 34.83 34.80 2jqe s MET 340 CO 0.30 -2.23 0.00 -0.11 -0.01 0.00 0.00 175.02 172.97 2jqe n LEU 341 N -3.58 -5.96 0.25 -0.03 7.94 -1.26 -4.78 117.00 109.58 2jqe n LEU 341 Ca 0.15 2.94 0.12 0.00 -1.11 0.00 0.00 56.01 58.11 2jqe n LEU 341 Cb 0.60 -3.04 0.65 0.00 0.53 0.00 0.00 43.42 42.16 2jqe n LEU 341 CO 0.45 -1.96 0.92 1.55 -1.11 0.00 0.00 177.39 177.24 2jqe h PRO 342 N 4.01 0.00 -2.37 1.96 0.13 -1.97 -3.45 132.00 130.31 2jqe h PRO 342 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.91 2jqe h PRO 342 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 2jqe h PRO 342 CO 0.00 0.15 -0.23 0.34 -0.23 0.00 0.00 178.00 178.03 2jqe n PHE 343 N -3.50 -0.84 0.29 1.56 7.35 -1.26 -4.76 117.46 116.29 2jqe n PHE 343 Ca -0.01 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.78 2jqe n PHE 343 Cb 0.30 -2.38 0.26 0.00 0.35 0.00 0.00 39.48 38.01 2jqe n PHE 343 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2jqe n GLY 344 N -0.40 1.57 3.78 7.13 0.00 -1.26 -4.95 105.19 111.05 2jqe n GLY 344 Ca -0.12 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 2jqe n GLY 344 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jqe s LEU 345 N -1.12 3.23 0.00 0.99 2.01 -1.26 -4.34 118.68 118.20 2jqe s LEU 345 Ca 0.38 1.87 0.00 0.00 0.01 0.00 0.00 54.13 56.39 2jqe s LEU 345 Cb 0.20 -4.53 0.00 0.00 0.01 0.00 0.00 46.19 41.87 2jqe s LEU 345 CO 0.27 -1.72 0.00 0.61 1.01 0.00 0.00 176.35 176.52 2jqe n GLY 346 N -1.00 2.44 0.31 -3.19 0.00 -1.26 -4.78 105.19 97.72 2jqe n GLY 346 Ca 0.09 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.37 2jqe n GLY 346 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jqe h LEU 347 N 0.00 0.73 -7.00 0.99 3.38 -1.99 -3.46 115.31 107.96 2jqe h LEU 347 Ca 0.00 -0.08 0.16 0.00 0.09 0.00 0.00 57.88 58.05 2jqe h LEU 347 Cb 0.00 -0.19 -0.20 0.00 0.09 0.00 0.00 40.66 40.37 2jqe h LEU 347 CO 0.00 0.65 0.66 -1.59 0.09 0.00 0.00 178.44 178.25 2jqe s LYS 348 N -5.40 0.52 -1.24 1.13 -2.85 -1.26 -5.07 119.74 105.57 2jqe s LYS 348 Ca -0.10 -0.09 -0.20 0.00 -1.00 0.00 0.00 55.97 54.58 2jqe s LYS 348 Cb 0.16 0.24 -0.01 0.00 -2.06 0.00 0.00 37.83 36.16 2jqe s LYS 348 CO 0.78 -0.21 1.85 0.28 0.10 0.00 0.00 175.35 178.15 2jqe n VAL 349 N 0.15 2.92 -2.77 1.79 0.31 -1.26 -4.50 118.33 114.97 2jqe n VAL 349 Ca -0.05 -3.02 -0.43 0.00 -0.01 0.00 0.00 64.34 60.83 2jqe n VAL 349 Cb 0.59 -2.27 -0.04 0.00 -0.91 0.00 0.00 33.84 31.22 2jqe n VAL 349 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 2jqe s ASP 350 N 5.30 6.36 1.02 4.52 -4.77 -1.26 -5.02 116.67 122.81 2jqe s ASP 350 Ca 0.61 -0.25 -0.17 0.00 -3.30 0.00 0.00 52.55 49.44 2jqe s ASP 350 Cb 0.02 -2.47 0.22 0.00 -1.09 0.00 0.00 42.92 39.61 2jqe s ASP 350 CO 0.10 -1.30 1.29 0.21 0.70 0.00 0.00 175.17 176.17 2jqe s ASN 351 N 2.90 2.61 0.69 2.11 3.04 -1.26 -4.92 114.94 120.11 2jqe s ASN 351 Ca 0.33 0.31 0.00 0.00 0.04 0.00 0.00 52.86 53.55 2jqe s ASN 351 Cb -0.11 -0.37 0.00 0.00 -1.54 0.00 0.00 41.25 39.23 2jqe s ASN 351 CO 0.21 -3.05 0.00 -0.90 -3.04 0.00 0.00 177.10 170.31 2jqe n ASP 352 N -3.99 -0.40 -0.94 -4.21 5.68 -1.26 -4.97 116.55 106.46 2jqe n ASP 352 Ca 0.15 -0.49 0.08 0.00 -0.50 0.00 0.00 54.79 54.02 2jqe n ASP 352 Cb 0.59 0.00 0.23 0.00 -1.14 0.00 0.00 41.12 40.80 2jqe n ASP 352 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2jqe n VAL 353 N -1.68 1.30 -0.03 2.12 0.24 -1.26 -4.55 118.33 114.48 2jqe n VAL 353 Ca 0.00 -1.15 0.06 0.00 -2.04 0.00 0.00 64.34 61.21 2jqe n VAL 353 Cb 0.00 0.34 0.44 0.00 -1.47 0.00 0.00 33.84 33.15 2jqe n VAL 353 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 2jqe h MET 354 N 2.69 0.51 -0.03 7.34 2.86 -2.00 -3.38 114.93 122.91 2jqe h MET 354 Ca 0.00 -0.03 -0.17 0.00 -2.06 0.00 0.00 59.70 57.44 2jqe h MET 354 Cb 0.98 -0.11 -0.14 0.00 0.06 0.00 0.00 31.60 32.39 2jqe h MET 354 CO 0.07 0.33 -0.34 -1.91 1.06 0.00 0.00 176.91 176.11 2jqe n GLU 355 N -4.48 0.56 -0.02 1.72 4.07 -1.26 -5.05 120.64 116.18 2jqe n GLU 355 Ca 0.05 -1.40 -0.03 0.00 -0.06 0.00 0.00 57.16 55.73 2jqe n GLU 355 Cb 0.15 -1.06 -0.01 0.00 -0.06 0.00 0.00 31.44 30.46 2jqe n GLU 355 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 2jqe n MET 356 N 1.67 0.15 -4.18 5.31 2.81 -1.26 -5.08 117.12 116.53 2jqe n MET 356 Ca 0.07 0.06 -0.11 0.00 -1.81 0.00 0.00 57.70 55.91 2jqe n MET 356 Cb 0.65 -0.66 -0.10 0.00 -0.71 0.00 0.00 33.22 32.40 2jqe n MET 356 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2jqe s THR 357 N -1.69 0.71 -0.10 2.03 -1.32 -1.26 -5.15 115.64 108.85 2jqe s THR 357 Ca -0.08 -1.95 -0.02 0.00 -1.21 0.00 0.00 61.69 58.43 2jqe s THR 357 Cb 0.01 -1.75 -0.03 0.00 -1.51 0.00 0.00 72.50 69.22 2jqe s THR 357 CO 0.12 -0.81 -0.03 -1.10 -2.21 0.00 0.00 174.62 170.59 2jqe s GLN 358 N -3.84 3.15 -0.10 7.08 -1.52 -1.26 -5.10 119.66 118.07 2jqe s GLN 358 Ca 0.14 -0.49 0.04 0.00 -1.95 0.00 0.00 55.36 53.09 2jqe s GLN 358 Cb 0.05 -2.77 0.00 0.00 -0.22 0.00 0.00 33.01 30.07 2jqe s GLN 358 CO -0.03 0.53 -0.22 -2.00 -0.25 0.00 0.00 175.29 173.32 2jqe s GLU 359 N -0.42 2.80 0.10 2.91 2.12 -1.26 -5.01 118.70 119.95 2jqe s GLU 359 Ca 0.07 -0.79 0.15 0.00 0.36 0.00 0.00 54.97 54.76 2jqe s GLU 359 Cb -0.12 -2.15 -0.11 0.00 0.26 0.00 0.00 34.13 32.01 2jqe s GLU 359 CO 0.02 0.14 0.97 1.57 -0.54 0.00 0.00 175.26 177.42 2jqe h LYS 360 N 6.81 0.00 -0.56 4.30 2.10 -1.99 -3.33 116.57 123.91 2jqe h LYS 360 Ca -0.22 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.37 2jqe h LYS 360 Cb 1.23 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.53 2jqe h LYS 360 CO 0.48 0.41 0.12 1.98 -2.00 0.00 0.00 179.45 180.44 2jqe h MET 361 N 0.00 0.86 -0.39 0.07 4.05 -1.99 0.36 114.93 117.89 2jqe h MET 361 Ca -0.13 -0.18 -0.05 0.00 -0.28 0.00 0.00 59.70 59.06 2jqe h MET 361 Cb 1.60 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 32.26 2jqe h MET 361 CO 0.06 0.78 0.06 -0.22 0.23 0.00 0.00 176.91 177.82 2jqe h LYS 362 N 0.83 0.65 -0.00 0.39 3.11 -1.96 -2.78 116.57 116.81 2jqe h LYS 362 Ca 0.18 -0.17 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2jqe h LYS 362 Cb 0.32 -0.08 0.00 0.00 -1.00 0.00 0.00 32.23 31.47 2jqe h LYS 362 CO 0.00 0.70 -0.16 1.63 -2.81 0.00 0.00 179.45 178.82 2jqe n LYS 363 N -4.53 0.61 0.25 1.90 5.02 -1.04 -3.94 118.16 116.43 2jqe n LYS 363 Ca -0.01 -0.24 -0.10 0.00 -2.02 0.00 0.00 58.31 55.94 2jqe n LYS 363 Cb 0.23 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.70 2jqe n LYS 363 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2jqe h PHE 364 N 0.58 -0.63 0.00 2.13 -1.00 0.01 -3.19 116.94 114.85 2jqe h PHE 364 Ca 0.00 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.76 2jqe h PHE 364 Cb 0.40 0.21 -0.00 0.00 3.61 0.00 0.00 35.95 40.17 2jqe h PHE 364 CO 0.00 -0.39 -0.02 -0.09 -1.61 0.00 0.00 178.31 176.20 2jqe h ARG 365 N -0.99 0.00 0.38 1.51 2.43 -1.73 -2.80 114.38 113.18 2jqe h ARG 365 Ca -0.07 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2jqe h ARG 365 Cb 0.52 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 2jqe h ARG 365 CO 0.11 0.02 -0.37 0.28 -1.51 0.00 0.00 179.97 178.50 2jqe h VAL 366 N 0.00 0.24 0.17 0.20 2.07 -1.67 0.23 116.25 117.48 2jqe h VAL 366 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2jqe h VAL 366 Cb 0.03 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2jqe h VAL 366 CO 0.00 0.00 -0.08 0.40 0.02 0.00 0.00 177.57 177.91 2jqe h ILE 367 N -0.78 0.96 -1.02 4.57 2.04 -1.54 -2.77 117.51 118.98 2jqe h ILE 367 Ca -0.03 -0.70 0.25 0.00 1.00 0.00 0.00 64.86 65.38 2jqe h ILE 367 Cb 0.69 1.37 -0.10 0.00 -0.74 0.00 0.00 36.82 38.05 2jqe h ILE 367 CO -0.06 0.16 0.64 0.24 0.00 0.00 0.00 178.15 179.13 2jqe h MET 368 N -0.57 0.45 -0.33 2.37 2.86 -1.44 0.73 114.93 119.01 2jqe h MET 368 Ca -0.02 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.49 2jqe h MET 368 Cb 0.43 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 2jqe h MET 368 CO 0.04 0.30 -0.23 0.22 1.06 0.00 0.00 176.91 178.30 2jqe h ASP 369 N 0.47 0.64 0.45 1.22 3.58 -0.38 -3.25 116.42 119.15 2jqe h ASP 369 Ca 0.59 -0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.79 2jqe h ASP 369 Cb 1.35 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.23 2jqe h ASP 369 CO -0.32 0.86 -0.22 0.28 -2.88 0.00 0.00 179.24 176.96 2jqe h SER 370 N 0.56 -0.51 -1.05 2.28 0.02 0.71 -3.46 113.55 112.11 2jqe h SER 370 Ca 0.08 0.02 -0.31 0.00 -0.84 0.00 0.00 61.79 60.74 2jqe h SER 370 Cb 0.69 0.13 0.14 0.00 0.14 0.00 0.00 62.40 63.50 2jqe h SER 370 CO 0.05 -0.33 -1.18 0.80 -1.14 0.00 0.00 176.83 175.03 2jqe n MET 371 N -3.86 0.00 -3.24 3.45 0.00 -0.61 -4.88 117.12 107.97 2jqe n MET 371 Ca -0.08 0.00 -0.39 0.00 -0.00 0.00 0.00 57.70 57.24 2jqe n MET 371 Cb 0.24 -0.58 -0.06 0.00 0.00 0.00 0.00 33.22 32.82 2jqe n MET 371 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 2jqe s THR 372 N -1.16 4.95 0.26 1.12 2.01 -1.26 -4.96 115.64 116.61 2jqe s THR 372 Ca 0.23 1.17 -0.02 0.00 0.31 0.00 0.00 61.69 63.38 2jqe s THR 372 Cb -0.07 -3.90 0.26 0.00 0.01 0.00 0.00 72.50 68.80 2jqe s THR 372 CO 0.46 0.42 1.68 -0.08 -0.69 0.00 0.00 174.62 176.41 2jqe h GLU 373 N 5.70 0.29 -0.93 4.92 4.81 -1.94 0.45 114.58 127.88 2jqe h GLU 373 Ca -0.45 -0.02 0.16 0.00 -0.13 0.00 0.00 59.36 58.92 2jqe h GLU 373 Cb 1.20 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 30.44 2jqe h GLU 373 CO 0.70 0.19 0.59 1.49 -0.73 0.00 0.00 179.01 181.25 2jqe h GLU 374 N 0.30 0.67 -0.50 1.92 4.81 -1.99 0.27 114.58 120.06 2jqe h GLU 374 Ca 0.47 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.56 2jqe h GLU 374 Cb 0.85 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2jqe h GLU 374 CO -0.54 0.44 -0.11 0.93 -0.73 0.00 0.00 179.01 179.00 2jqe h GLU 375 N 0.69 0.93 -0.65 1.92 5.08 -0.40 -2.97 114.58 119.18 2jqe h GLU 375 Ca 0.48 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2jqe h GLU 375 Cb 0.81 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 2jqe h GLU 375 CO -0.24 0.99 0.37 -0.07 -1.00 0.00 0.00 179.01 179.05 2jqe h LEU 376 N 0.83 0.80 -0.99 1.33 3.38 0.19 -1.85 115.31 118.99 2jqe h LEU 376 Ca 0.13 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.09 2jqe h LEU 376 Cb 0.65 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 2jqe h LEU 376 CO 0.04 0.65 0.64 -0.07 0.09 0.00 0.00 178.44 179.80 2jqe h LEU 377 N 0.88 1.02 -6.71 1.67 -0.00 -1.18 -3.32 115.31 107.68 2jqe h LEU 377 Ca 0.23 0.01 -0.59 0.00 -0.00 0.00 0.00 57.88 57.53 2jqe h LEU 377 Cb 0.02 -0.21 -0.39 0.00 -0.00 0.00 0.00 40.66 40.08 2jqe h LEU 377 CO -0.04 0.65 -0.82 0.20 -0.00 0.00 0.00 178.44 178.43 2jqe s ASN 378 N -5.88 3.18 0.52 -0.43 -0.87 -0.88 -4.37 114.94 106.21 2jqe s ASN 378 Ca -0.12 -2.27 0.29 0.00 -1.57 0.00 0.00 52.86 49.19 2jqe s ASN 378 Cb 0.20 -0.57 1.42 0.00 -0.02 0.00 0.00 41.25 42.28 2jqe s ASN 378 CO 0.81 -0.30 2.04 1.55 -2.57 0.00 0.00 177.10 178.63 2jqe h PRO 379 N 6.99 0.00 -0.18 -0.60 0.13 -1.49 -2.18 132.00 134.67 2jqe h PRO 379 Ca 0.03 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.12 2jqe h PRO 379 Cb 0.96 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 2jqe h PRO 379 CO 0.33 0.11 -0.05 0.87 -0.23 0.00 0.00 178.00 179.03 2jqe h LYS 380 N 0.00 0.27 -0.18 0.86 1.57 -1.93 -2.33 116.57 114.83 2jqe h LYS 380 Ca -0.00 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 2jqe h LYS 380 Cb 0.42 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2jqe h LYS 380 CO 0.01 0.34 -0.25 0.82 -0.57 0.00 0.00 179.45 179.81 2jqe h ILE 381 N 0.27 1.25 -1.35 1.86 2.04 -1.73 -3.44 117.51 116.41 2jqe h ILE 381 Ca 0.06 -1.17 -0.78 0.00 1.00 0.00 0.00 64.86 63.97 2jqe h ILE 381 Cb 0.27 1.39 0.02 0.00 -0.74 0.00 0.00 36.82 37.76 2jqe h ILE 381 CO 0.01 0.36 0.69 0.00 0.00 0.00 0.00 178.15 179.22 2jqe n ILE 382 N -4.15 0.14 -3.58 -0.67 3.06 -0.88 -4.93 119.36 108.36 2jqe n ILE 382 Ca -0.01 -0.03 -0.25 0.00 -2.50 0.00 0.00 62.75 59.97 2jqe n ILE 382 Cb 0.38 -0.83 -0.02 0.00 0.54 0.00 0.00 39.64 39.70 2jqe n ILE 382 CO 0.00 0.00 0.00 -1.81 -2.50 0.00 0.00 176.55 172.24 2jqe s ASP 383 N 2.60 6.34 0.33 9.51 1.01 -1.26 -4.93 116.67 130.27 2jqe s ASP 383 Ca 0.98 0.39 0.05 0.00 0.71 0.00 0.00 52.55 54.68 2jqe s ASP 383 Cb -1.20 -2.00 0.70 0.00 1.01 0.00 0.00 42.92 41.42 2jqe s ASP 383 CO 0.67 -0.17 1.89 0.28 0.21 0.00 0.00 175.17 178.06 2jqe h SER 384 N 1.30 0.75 -0.09 0.27 0.02 -1.99 -1.10 113.55 112.71 2jqe h SER 384 Ca -0.49 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.45 2jqe h SER 384 Cb 1.21 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 2jqe h SER 384 CO 0.64 0.43 -0.07 0.77 -1.14 0.00 0.00 176.83 177.46 2jqe h SER 385 N 0.83 0.21 -0.27 3.07 4.64 -1.99 -1.26 113.55 118.77 2jqe h SER 385 Ca 0.41 -0.46 -0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2jqe h SER 385 Cb 0.46 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2jqe h SER 385 CO -0.18 0.62 0.17 0.03 -0.87 0.00 0.00 176.83 176.61 2jqe h ARG 386 N -0.21 0.37 -0.38 4.77 3.08 -1.83 -2.45 114.38 117.74 2jqe h ARG 386 Ca 0.02 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 2jqe h ARG 386 Cb 0.56 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 2jqe h ARG 386 CO 0.02 0.29 -0.07 0.97 -1.07 0.00 0.00 179.97 180.10 2jqe h ILE 387 N 0.35 1.24 0.18 2.04 2.10 -1.26 -1.51 117.51 120.65 2jqe h ILE 387 Ca 0.10 -1.03 0.01 0.00 1.08 0.00 0.00 64.86 65.03 2jqe h ILE 387 Cb 0.01 1.03 -0.04 0.00 -1.09 0.00 0.00 36.82 36.73 2jqe h ILE 387 CO -0.02 0.35 -0.36 -0.09 -1.08 0.00 0.00 178.15 176.94 2jqe h ARG 388 N 0.59 -0.61 -0.84 2.19 2.43 -0.83 -1.19 114.38 116.12 2jqe h ARG 388 Ca 0.11 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.39 2jqe h ARG 388 Cb 0.49 0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 30.11 2jqe h ARG 388 CO 0.03 -0.41 0.51 -0.09 -1.51 0.00 0.00 179.97 178.50 2jqe h ARG 389 N -0.64 0.90 -0.28 0.20 2.43 -1.26 -2.61 114.38 113.12 2jqe h ARG 389 Ca 0.01 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.16 2jqe h ARG 389 Cb 0.64 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 2jqe h ARG 389 CO -0.17 0.59 0.09 0.82 -1.51 0.00 0.00 179.97 179.79 2jqe h ILE 390 N 0.92 0.92 -0.95 1.20 5.03 -0.34 -1.64 117.51 122.65 2jqe h ILE 390 Ca 0.37 -0.07 0.15 0.00 -0.12 0.00 0.00 64.86 65.19 2jqe h ILE 390 Cb 0.20 0.69 -0.09 0.00 -3.03 0.00 0.00 36.82 34.58 2jqe h ILE 390 CO -0.18 0.04 0.57 0.00 -0.68 0.00 0.00 178.15 177.89 2jqe h ALA 391 N 1.18 1.49 -0.80 1.87 0.00 -0.86 0.12 119.26 122.25 2jqe h ALA 391 Ca 0.12 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2jqe h ALA 391 Cb 0.09 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2jqe h ALA 391 CO -0.13 0.05 0.52 0.82 0.00 0.00 0.00 179.25 180.50 2jqe h ILE 392 N 0.81 1.21 -0.63 0.00 1.08 -1.21 0.45 117.51 119.23 2jqe h ILE 392 Ca 0.51 -0.42 -0.09 0.00 -0.39 0.00 0.00 64.86 64.48 2jqe h ILE 392 Cb 0.66 0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 2jqe h ILE 392 CO -0.33 0.21 0.05 1.23 -0.69 0.00 0.00 178.15 178.62 2jqe h GLY 393 N 1.09 1.15 2.00 5.37 0.00 -0.32 -2.56 103.07 109.81 2jqe h GLY 393 Ca 0.29 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 2jqe h GLY 393 CO -0.06 0.74 -0.01 1.48 0.00 0.00 0.00 176.54 178.69 2jqe h SER 394 N 0.99 0.00 -1.55 0.19 4.64 -0.45 -3.48 113.55 113.90 2jqe h SER 394 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2jqe h SER 394 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2jqe h SER 394 CO 0.02 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 2jqe n GLY 395 N 0.85 0.46 0.00 -0.77 0.00 0.15 -4.78 105.19 101.08 2jqe n GLY 395 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2jqe n GLY 395 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jqe n THR 396 N -0.78 0.00 -3.62 2.61 -2.24 -0.55 -5.02 114.28 104.67 2jqe n THR 396 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 2jqe n THR 396 Cb 0.39 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.61 2jqe n THR 396 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2jqe s SER 397 N 1.51 -0.11 0.26 3.42 0.01 -1.26 -4.76 113.70 112.76 2jqe s SER 397 Ca 0.00 -0.12 -0.05 0.00 1.31 0.00 0.00 55.95 57.09 2jqe s SER 397 Cb 0.00 0.21 0.30 0.00 0.21 0.00 0.00 66.02 66.74 2jqe s SER 397 CO 0.00 -0.36 1.91 1.55 0.41 0.00 0.00 173.24 176.74 2jqe h PRO 398 N 2.00 1.20 -0.80 12.44 0.13 -1.86 -2.52 132.00 142.59 2jqe h PRO 398 Ca -0.23 -0.11 0.11 0.00 -0.87 0.00 0.00 66.00 64.90 2jqe h PRO 398 Cb 1.20 -0.25 -0.08 0.00 0.13 0.00 0.00 31.00 32.00 2jqe h PRO 398 CO 0.27 0.84 0.42 1.96 -0.23 0.00 0.00 178.00 181.26 2jqe h GLN 399 N 1.22 0.66 0.00 0.86 4.20 -1.98 0.33 115.11 120.40 2jqe h GLN 399 Ca 0.32 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.89 2jqe h GLN 399 Cb -0.05 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 2jqe h GLN 399 CO -0.06 0.43 -0.46 1.49 -0.67 0.00 0.00 178.83 179.56 2jqe h GLU 400 N 0.68 0.00 0.09 1.46 4.57 -1.85 -0.84 114.58 118.68 2jqe h GLU 400 Ca 0.40 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 58.29 2jqe h GLU 400 Cb 0.45 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 2jqe h GLU 400 CO -0.29 0.46 -1.45 -0.39 -1.18 0.00 0.00 179.01 176.16 2jqe h VAL 401 N 0.00 1.23 -0.60 0.32 -1.51 -1.18 -2.64 116.25 111.87 2jqe h VAL 401 Ca -0.00 -2.90 -0.07 0.00 -1.23 0.00 0.00 66.70 62.50 2jqe h VAL 401 Cb 0.82 2.76 -0.03 0.00 -2.13 0.00 0.00 31.29 32.71 2jqe h VAL 401 CO 0.06 0.81 0.10 0.11 -1.23 0.00 0.00 177.57 177.42 2jqe h LYS 402 N 0.05 0.97 -0.23 5.19 1.57 -0.20 -2.15 116.57 121.77 2jqe h LYS 402 Ca -0.20 -0.24 -0.04 0.00 -1.87 0.00 0.00 60.65 58.29 2jqe h LYS 402 Cb 1.98 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 34.16 2jqe h LYS 402 CO 0.15 0.90 -0.03 1.49 -0.57 0.00 0.00 179.45 181.39 2jqe h GLU 403 N 0.92 0.42 -0.92 3.15 4.81 -1.21 -1.60 114.58 120.14 2jqe h GLU 403 Ca 0.19 -0.15 0.15 0.00 -0.13 0.00 0.00 59.36 59.42 2jqe h GLU 403 Cb 0.40 -0.03 -0.08 0.00 0.63 0.00 0.00 28.75 29.67 2jqe h GLU 403 CO 0.01 0.64 0.59 -0.07 -0.73 0.00 0.00 179.01 179.45 2jqe h LEU 404 N 0.17 0.69 -0.36 1.64 -0.00 -1.12 0.17 115.31 116.50 2jqe h LEU 404 Ca 0.06 0.05 -0.13 0.00 -0.00 0.00 0.00 57.88 57.85 2jqe h LEU 404 Cb 0.47 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 41.03 2jqe h LEU 404 CO 0.02 0.34 -0.30 -0.07 -0.00 0.00 0.00 178.44 178.43 2jqe h LEU 405 N 0.72 0.89 -1.49 1.67 3.38 -1.12 -2.62 115.31 116.73 2jqe h LEU 405 Ca 0.47 -0.45 0.22 0.00 0.09 0.00 0.00 57.88 58.21 2jqe h LEU 405 Cb 0.74 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 2jqe h LEU 405 CO -0.23 1.15 0.62 -1.13 0.09 0.00 0.00 178.44 178.94 2jqe h ASN 406 N 0.63 0.41 0.21 -0.43 -1.24 0.27 -1.10 115.58 114.33 2jqe h ASN 406 Ca 0.06 0.05 -0.01 0.00 0.71 0.00 0.00 56.30 57.11 2jqe h ASN 406 Cb 0.88 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.90 2jqe h ASN 406 CO 0.08 0.15 -0.10 0.22 -1.29 0.00 0.00 177.43 176.48 2jqe h TYR 407 N 0.40 -0.26 -0.09 0.67 3.20 -0.81 -2.35 116.97 117.72 2jqe h TYR 407 Ca 0.50 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.39 2jqe h TYR 407 Cb 1.26 0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.61 2jqe h TYR 407 CO -0.00 0.07 0.17 -0.92 -1.64 0.00 0.00 178.16 175.84 2jqe h TYR 408 N -0.62 0.00 -0.43 -3.82 3.20 -1.17 1.39 116.97 115.52 2jqe h TYR 408 Ca -0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2jqe h TYR 408 Cb 0.45 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 2jqe h TYR 408 CO 0.03 0.00 0.29 0.87 -1.64 0.00 0.00 178.16 177.71 2jqe h LYS 409 N 0.00 0.57 -1.11 1.82 6.56 -0.83 1.27 116.57 124.86 2jqe h LYS 409 Ca 0.04 -0.03 0.31 0.00 -1.06 0.00 0.00 60.65 59.91 2jqe h LYS 409 Cb 0.38 -0.13 -0.09 0.00 -0.57 0.00 0.00 32.23 31.82 2jqe h LYS 409 CO -0.00 0.38 0.73 1.15 -2.06 0.00 0.00 179.45 179.64 2jqe h THR 410 N 0.59 0.43 -1.03 -0.16 2.02 0.19 2.03 112.91 116.98 2jqe h THR 410 Ca 0.16 -0.10 0.26 0.00 0.77 0.00 0.00 66.41 67.50 2jqe h THR 410 Cb -0.07 0.13 -0.11 0.00 -1.74 0.00 0.00 68.15 66.36 2jqe h THR 410 CO -0.03 0.05 0.64 -0.03 0.37 0.00 0.00 175.52 176.52 2jqe h MET 411 N 0.28 0.45 -0.98 6.66 -1.53 0.16 2.62 114.93 122.60 2jqe h MET 411 Ca 0.63 -0.03 0.19 0.00 -3.44 0.00 0.00 59.70 57.05 2jqe h MET 411 Cb 1.81 -0.10 -0.09 0.00 -0.55 0.00 0.00 31.60 32.66 2jqe h MET 411 CO -0.28 0.30 0.61 -0.22 0.14 0.00 0.00 176.91 177.47 2jqe h LYS 412 N 0.47 0.65 -1.06 0.39 1.63 0.32 1.38 116.57 120.35 2jqe h LYS 412 Ca 0.62 -0.04 0.30 0.00 -0.85 0.00 0.00 60.65 60.69 2jqe h LYS 412 Cb 1.41 -0.15 -0.04 0.00 -0.60 0.00 0.00 32.23 32.85 2jqe h LYS 412 CO -0.38 0.43 0.76 -0.97 -3.45 0.00 0.00 179.45 175.84 2jqe h ASN 413 N 0.67 0.02 -0.84 4.20 -1.24 0.46 1.03 115.58 119.87 2jqe h ASN 413 Ca 0.54 0.00 0.21 0.00 0.71 0.00 0.00 56.30 57.77 2jqe h ASN 413 Cb 0.96 0.00 -0.13 0.00 0.73 0.00 0.00 38.32 39.88 2jqe h ASN 413 CO -0.31 0.00 0.23 0.25 -1.29 0.00 0.00 177.43 176.32 2jqe h LEU 414 N 0.02 0.03 -1.58 0.34 7.12 0.19 1.54 115.31 122.96 2jqe h LEU 414 Ca 0.51 0.18 -0.02 0.00 0.13 0.00 0.00 57.88 58.68 2jqe h LEU 414 Cb 2.00 0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 42.35 2jqe h LEU 414 CO -0.02 -0.11 0.08 -0.03 -0.13 0.00 0.00 178.44 178.24 2jqe h MET 415 N 0.25 0.35 -0.18 1.25 4.05 0.10 0.26 114.93 121.01 2jqe h MET 415 Ca 0.51 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.88 2jqe h MET 415 Cb 0.99 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.71 2jqe h MET 415 CO -0.60 0.31 0.07 0.87 0.23 0.00 0.00 176.91 177.79 2jqe h LYS 416 N 0.35 0.28 0.00 0.39 1.57 0.21 -0.20 116.57 119.17 2jqe h LYS 416 Ca 0.09 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2jqe h LYS 416 Cb 0.11 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 2jqe h LYS 416 CO -0.01 0.36 -0.01 -0.22 -0.57 0.00 0.00 179.45 179.00 2jqe h LYS 417 N 0.14 0.00 -0.21 3.15 3.64 0.98 -3.40 116.57 120.87 2jqe h LYS 417 Ca 0.06 0.00 0.23 0.00 -1.27 0.00 0.00 60.65 59.67 2jqe h LYS 417 Cb 0.19 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 31.82 2jqe h LYS 417 CO -0.00 0.01 0.01 1.41 -2.27 0.00 0.00 179.45 178.61 2jqe s MET 418 N -4.10 0.11 -0.86 1.90 0.00 0.74 -5.08 119.30 112.01 2jqe s MET 418 Ca -0.04 0.11 -0.19 0.00 0.00 0.00 0.00 55.69 55.58 2jqe s MET 418 Cb 0.12 0.05 0.13 0.00 0.00 0.00 0.00 34.83 35.13 2jqe s MET 418 CO 0.47 -0.21 1.04 -1.59 0.00 0.00 0.00 175.02 174.73 2jqe s LYS 419 N 2.97 3.49 0.15 4.11 -2.85 -0.19 -4.23 119.74 123.19 2jqe s LYS 419 Ca 0.29 -1.67 -0.14 0.00 -1.00 0.00 0.00 55.97 53.45 2jqe s LYS 419 Cb -0.01 -4.74 0.04 0.00 -2.06 0.00 0.00 37.83 31.05 2jqe s LYS 419 CO -0.23 -1.72 1.73 -0.22 0.10 0.00 0.00 175.35 175.02 2jqe h LYS 420 N 8.87 0.71 -0.29 1.78 3.64 -1.95 -3.04 116.57 126.29 2jqe h LYS 420 Ca 0.06 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 2jqe h LYS 420 Cb 1.04 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 2jqe h LYS 420 CO 1.09 0.60 0.11 -0.91 -2.27 0.00 0.00 179.45 178.06 2jqe h ASN 421 N 0.65 0.40 -4.70 4.20 -0.26 -1.99 -3.45 115.58 110.43 2jqe h ASN 421 Ca 0.17 -0.17 -0.13 0.00 -0.56 0.00 0.00 56.30 55.61 2jqe h ASN 421 Cb 0.13 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 37.26 2jqe h ASN 421 CO -0.02 0.46 -0.17 1.17 -1.06 0.00 0.00 177.43 177.81 2jqe n LYS 422 N -4.74 -2.68 -2.60 0.81 4.81 -1.15 -4.86 118.16 107.75 2jqe n LYS 422 Ca -0.02 0.24 -0.41 0.00 -0.87 0.00 0.00 58.31 57.24 2jqe n LYS 422 Cb 0.14 -4.79 -0.04 0.00 0.02 0.00 0.00 35.03 30.36 2jqe n LYS 422 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2jqe s LEU 423 N -5.38 4.46 -1.22 3.14 2.96 -1.26 -4.92 118.68 116.47 2jqe s LEU 423 Ca 0.05 1.93 -0.09 0.00 -0.22 0.00 0.00 54.13 55.80 2jqe s LEU 423 Cb -0.03 -3.59 -0.12 0.00 0.50 0.00 0.00 46.19 42.95 2jqe s LEU 423 CO 0.06 -0.20 3.00 -0.81 -1.32 0.00 0.00 176.35 177.08 2jqe n PRO 424 N 2.90 3.18 0.00 0.98 -0.04 -1.26 -5.24 135.00 135.52 2jqe n PRO 424 Ca 0.04 -1.87 0.00 0.00 -0.04 0.00 0.00 63.50 61.63 2jqe n PRO 424 Cb 0.48 -2.59 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 2jqe n PRO 424 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97