#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s26 s ILE 293 N 0.00 3.43 -0.80 5.15 1.01 -1.26 -4.88 121.20 123.86 1s26 s ILE 293 Ca 0.00 0.48 -0.25 0.00 0.00 0.00 0.00 60.65 60.88 1s26 s ILE 293 Cb 0.00 -3.46 -0.19 0.00 0.01 0.00 0.00 42.46 38.82 1s26 s ILE 293 CO 0.00 -0.20 1.89 -0.67 0.00 0.00 0.00 174.94 175.96 1s26 n ASP 294 N 9.12 2.20 -4.87 3.58 4.64 -1.26 -4.89 116.55 125.07 1s26 n ASP 294 Ca 0.21 -2.62 -0.21 0.00 -1.38 0.00 0.00 54.79 50.80 1s26 n ASP 294 Cb 0.45 -1.29 -0.03 0.00 -1.04 0.00 0.00 41.12 39.21 1s26 n ASP 294 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1s26 s VAL 295 N 9.34 3.15 0.32 5.18 0.11 -1.26 -4.59 120.40 132.65 1s26 s VAL 295 Ca 0.67 -1.35 0.04 0.00 -2.93 0.00 0.00 61.98 58.41 1s26 s VAL 295 Cb 0.07 -3.10 -0.02 0.00 -1.53 0.00 0.00 36.38 31.80 1s26 s VAL 295 CO 0.18 -0.10 0.48 -0.76 -3.33 0.00 0.00 175.10 171.58 1s26 s LEU 296 N -4.06 4.05 0.18 2.54 1.43 -0.66 -4.95 118.68 117.20 1s26 s LEU 296 Ca 0.44 0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 53.67 1s26 s LEU 296 Cb -0.05 -2.99 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 1s26 s LEU 296 CO 0.27 -0.32 0.07 -0.54 0.23 0.00 0.00 176.35 176.07 1s26 s LYS 297 N -4.20 1.11 0.00 1.70 1.02 -1.26 -2.54 119.74 115.57 1s26 s LYS 297 Ca 0.40 -1.56 0.00 0.00 0.02 0.00 0.00 55.97 54.84 1s26 s LYS 297 Cb -0.09 0.09 0.00 0.00 -0.52 0.00 0.00 37.83 37.30 1s26 s LYS 297 CO 0.33 -0.28 0.00 0.41 -0.92 0.00 0.00 175.35 174.89 1s26 n GLY 298 N -0.22 0.71 0.22 -3.33 0.00 -0.38 -2.05 105.19 100.14 1s26 n GLY 298 Ca -0.03 -0.34 0.02 0.00 0.00 0.00 0.00 46.02 45.68 1s26 n GLY 298 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1s26 n GLU 299 N 3.82 -0.08 0.17 1.61 4.07 -1.26 0.15 120.64 129.12 1s26 n GLU 299 Ca 0.00 0.94 0.06 0.00 -0.06 0.00 0.00 57.16 58.10 1s26 n GLU 299 Cb 0.00 -1.40 0.52 0.00 -0.06 0.00 0.00 31.44 30.50 1s26 n GLU 299 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1s26 h LYS 300 N 0.00 0.16 0.13 5.31 1.57 -1.92 -1.37 116.57 120.44 1s26 h LYS 300 Ca 0.27 -0.02 -0.26 0.00 -1.87 0.00 0.00 60.65 58.76 1s26 h LYS 300 Cb 0.42 -0.03 0.03 0.00 0.08 0.00 0.00 32.23 32.72 1s26 h LYS 300 CO -0.62 0.18 -1.11 0.00 -0.57 0.00 0.00 179.45 177.33 1s26 h ALA 301 N 1.85 -0.04 -0.27 3.86 0.00 0.20 -3.18 119.26 121.67 1s26 h ALA 301 Ca 0.04 -0.74 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 1s26 h ALA 301 Cb 0.11 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1s26 h ALA 301 CO 0.00 0.58 0.13 1.25 0.00 0.00 0.00 179.25 181.21 1s26 h LEU 302 N 0.07 0.32 -0.65 0.00 5.85 -0.90 -2.23 115.31 117.77 1s26 h LEU 302 Ca -0.18 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 1s26 h LEU 302 Cb 1.82 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.75 1s26 h LEU 302 CO 0.21 0.28 0.02 0.11 -0.34 0.00 0.00 178.44 178.72 1s26 h LYS 303 N 0.37 1.07 0.00 1.25 1.57 -1.30 -2.87 116.57 116.67 1s26 h LYS 303 Ca 0.10 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1s26 h LYS 303 Cb 0.04 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1s26 h LYS 303 CO -0.01 1.03 0.00 0.00 -0.57 0.00 0.00 179.45 179.90 1s26 h ALA 304 N 1.02 1.00 -0.20 3.86 0.00 -1.40 -3.32 119.26 120.22 1s26 h ALA 304 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.89 1s26 h ALA 304 Cb 0.54 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1s26 h ALA 304 CO 0.03 0.00 -0.66 0.66 0.00 0.00 0.00 179.25 179.28 1s26 h SER 305 N 0.00 0.93 0.00 0.00 4.64 -1.21 -3.46 113.55 114.45 1s26 h SER 305 Ca 0.00 -0.59 0.00 0.00 -0.47 0.00 0.00 61.79 60.73 1s26 h SER 305 Cb 0.59 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1s26 h SER 305 CO 0.00 1.36 0.00 0.61 -0.87 0.00 0.00 176.83 177.93 1s26 n GLY 306 N 0.58 0.70 3.83 -0.77 0.00 -1.25 -2.33 105.19 105.95 1s26 n GLY 306 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1s26 n GLY 306 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s26 s LEU 307 N 0.00 3.45 0.03 0.99 1.02 -1.26 -4.36 118.68 118.54 1s26 s LEU 307 Ca 0.00 1.65 -0.30 0.00 0.02 0.00 0.00 54.13 55.50 1s26 s LEU 307 Cb 0.00 -4.51 -0.05 0.00 0.02 0.00 0.00 46.19 41.65 1s26 s LEU 307 CO 0.00 -0.98 1.20 -0.69 0.02 0.00 0.00 176.35 175.89 1s26 s VAL 308 N -2.70 4.11 0.17 -1.59 1.01 -1.26 -4.92 120.40 115.23 1s26 s VAL 308 Ca 0.60 1.50 -0.22 0.00 0.00 0.00 0.00 61.98 63.87 1s26 s VAL 308 Cb -0.13 -3.96 0.08 0.00 0.00 0.00 0.00 36.38 32.37 1s26 s VAL 308 CO 0.40 0.09 1.60 -0.65 0.00 0.00 0.00 175.10 176.54 1s26 h PRO 309 N 6.98 -0.21 -0.64 2.72 0.11 -1.94 -0.70 132.00 138.32 1s26 h PRO 309 Ca -0.40 0.01 0.12 0.00 0.11 0.00 0.00 66.00 65.85 1s26 h PRO 309 Cb 1.20 0.05 -0.12 0.00 0.11 0.00 0.00 31.00 32.24 1s26 h PRO 309 CO 0.83 -0.14 -0.24 0.93 -0.21 0.00 0.00 178.00 179.17 1s26 h GLU 310 N -0.22 -0.07 -0.68 1.05 3.07 -1.99 0.26 114.58 116.00 1s26 h GLU 310 Ca 0.19 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.07 1s26 h GLU 310 Cb 0.52 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.41 1s26 h GLU 310 CO -0.55 -0.05 0.43 0.45 -1.40 0.00 0.00 179.01 177.90 1s26 h HIS 311 N -0.07 0.81 -0.23 4.33 3.86 -1.61 0.12 115.15 122.36 1s26 h HIS 311 Ca 0.29 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.45 1s26 h HIS 311 Cb 0.53 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.71 1s26 h HIS 311 CO -0.59 0.48 -0.17 0.00 0.86 0.00 0.00 177.93 178.52 1s26 h ALA 312 N 1.28 1.29 0.03 2.45 0.00 0.24 -1.53 119.26 123.02 1s26 h ALA 312 Ca 0.26 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1s26 h ALA 312 Cb -0.03 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1s26 h ALA 312 CO -0.09 0.47 -0.02 -0.44 0.00 0.00 0.00 179.25 179.18 1s26 h ASP 313 N 0.37 -0.04 -0.40 0.00 3.45 -0.34 -2.59 116.42 116.87 1s26 h ASP 313 Ca 0.07 -0.35 0.12 0.00 0.43 0.00 0.00 57.03 57.30 1s26 h ASP 313 Cb 0.51 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 39.28 1s26 h ASP 313 CO 0.03 0.33 0.35 0.00 -1.57 0.00 0.00 179.24 178.38 1s26 h ALA 314 N 0.54 2.22 0.00 3.45 0.00 -0.73 0.42 119.26 125.16 1s26 h ALA 314 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1s26 h ALA 314 Cb 0.38 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1s26 h ALA 314 CO 0.01 -0.55 -0.01 0.74 0.00 0.00 0.00 179.25 179.44 1s26 h PHE 315 N 0.00 0.00 -0.58 0.00 0.05 -0.92 -3.22 116.94 112.28 1s26 h PHE 315 Ca 0.19 0.00 -0.06 0.00 3.82 0.00 0.00 57.97 61.92 1s26 h PHE 315 Cb 0.88 0.00 -0.03 0.00 2.00 0.00 0.00 35.95 38.80 1s26 h PHE 315 CO 0.00 0.00 0.13 0.87 -0.18 0.00 0.00 178.31 179.13 1s26 h LYS 316 N 0.00 0.90 0.08 1.51 1.57 0.21 -2.78 116.57 118.06 1s26 h LYS 316 Ca 0.00 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1s26 h LYS 316 Cb 0.76 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1s26 h LYS 316 CO 0.00 0.81 -0.14 0.87 -0.57 0.00 0.00 179.45 180.43 1s26 h LYS 317 N 0.86 -0.23 -0.92 3.15 6.56 -1.63 -2.55 116.57 121.81 1s26 h LYS 317 Ca 0.18 0.02 0.22 0.00 -1.06 0.00 0.00 60.65 60.01 1s26 h LYS 317 Cb 0.33 0.05 -0.12 0.00 -0.57 0.00 0.00 32.23 31.92 1s26 h LYS 317 CO 0.00 -0.15 0.45 0.82 -2.06 0.00 0.00 179.45 178.51 1s26 h ILE 318 N -0.23 0.50 -0.75 1.86 5.03 -1.70 0.11 117.51 122.33 1s26 h ILE 318 Ca -0.01 -0.16 0.02 0.00 -0.12 0.00 0.00 64.86 64.59 1s26 h ILE 318 Cb 0.22 0.00 -0.04 0.00 -3.03 0.00 0.00 36.82 33.97 1s26 h ILE 318 CO -0.05 0.08 0.49 0.00 -0.68 0.00 0.00 178.15 178.00 1s26 h ALA 319 N 1.71 1.50 0.12 1.87 0.00 -1.29 -1.09 119.26 122.07 1s26 h ALA 319 Ca 0.58 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.44 1s26 h ALA 319 Cb 1.09 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1s26 h ALA 319 CO -0.51 0.45 -0.06 0.00 0.00 0.00 0.00 179.25 179.14 1s26 h ARG 320 N 0.98 -0.15 -0.31 0.00 -0.00 -0.53 -2.47 114.38 111.91 1s26 h ARG 320 Ca 0.28 0.01 0.03 0.00 -0.50 0.00 0.00 59.98 59.81 1s26 h ARG 320 Cb -0.06 0.03 -0.05 0.00 0.00 0.00 0.00 29.97 29.89 1s26 h ARG 320 CO -0.07 -0.10 -0.34 1.49 0.00 0.00 0.00 179.97 180.95 1s26 h GLU 321 N -0.85 -0.20 -6.84 0.04 4.81 -0.85 -3.36 114.58 107.33 1s26 h GLU 321 Ca -0.02 0.01 -0.48 0.00 -0.13 0.00 0.00 59.36 58.74 1s26 h GLU 321 Cb 0.12 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1s26 h GLU 321 CO 0.03 -0.13 0.38 -0.51 -0.73 0.00 0.00 179.01 178.04 1s26 s LEU 322 N -8.47 4.44 -0.85 1.64 1.43 -0.42 -4.92 118.68 111.53 1s26 s LEU 322 Ca -0.09 1.98 -0.14 0.00 -1.03 0.00 0.00 54.13 54.86 1s26 s LEU 322 Cb 0.05 -3.85 0.22 0.00 0.03 0.00 0.00 46.19 42.65 1s26 s LEU 322 CO 0.37 -0.07 0.79 0.21 0.23 0.00 0.00 176.35 177.88 1s26 s ASN 323 N -1.34 6.79 -0.19 2.29 3.04 -1.26 -4.53 114.94 119.74 1s26 s ASN 323 Ca 0.47 -2.76 -0.13 0.00 0.04 0.00 0.00 52.86 50.48 1s26 s ASN 323 Cb -0.24 -2.21 0.06 0.00 -1.54 0.00 0.00 41.25 37.32 1s26 s ASN 323 CO 0.30 -0.55 0.47 0.28 -3.04 0.00 0.00 177.10 174.56 1s26 s THR 324 N 0.05 -0.01 0.17 -5.21 -1.32 -0.93 -1.52 115.64 106.87 1s26 s THR 324 Ca 0.19 0.04 -0.30 0.00 -1.21 0.00 0.00 61.69 60.41 1s26 s THR 324 Cb -0.10 -0.68 -0.08 0.00 -1.51 0.00 0.00 72.50 70.13 1s26 s THR 324 CO -0.09 0.02 1.21 -0.31 -2.21 0.00 0.00 174.62 173.24 1s26 s TYR 325 N 0.99 3.41 -0.25 9.09 1.51 0.12 -4.37 117.35 127.83 1s26 s TYR 325 Ca -0.06 1.37 -0.02 0.00 -1.01 0.00 0.00 57.07 57.35 1s26 s TYR 325 Cb -0.06 -3.45 0.02 0.00 -0.11 0.00 0.00 41.96 38.36 1s26 s TYR 325 CO -0.09 -1.32 -0.05 0.42 -1.11 0.00 0.00 175.55 173.41 1s26 s ILE 326 N 0.13 2.97 -0.20 2.71 1.01 -0.57 -1.10 121.20 126.15 1s26 s ILE 326 Ca 0.54 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 60.17 1s26 s ILE 326 Cb -0.33 -2.51 -0.01 0.00 0.01 0.00 0.00 42.46 39.62 1s26 s ILE 326 CO 0.36 0.19 -0.05 -0.76 0.00 0.00 0.00 174.94 174.68 1s26 s LEU 327 N 1.34 2.94 0.24 2.97 1.02 -0.33 -1.03 118.68 125.83 1s26 s LEU 327 Ca 0.00 -0.34 0.07 0.00 0.02 0.00 0.00 54.13 53.88 1s26 s LEU 327 Cb -0.17 -1.73 -0.04 0.00 0.02 0.00 0.00 46.19 44.28 1s26 s LEU 327 CO -0.04 0.03 0.19 -0.36 0.02 0.00 0.00 176.35 176.20 1s26 s PHE 328 N 1.15 3.12 0.20 0.29 0.40 0.14 0.12 117.98 123.41 1s26 s PHE 328 Ca 0.02 -0.10 0.05 0.00 -0.60 0.00 0.00 56.93 56.30 1s26 s PHE 328 Cb -0.14 -1.42 -0.03 0.00 0.51 0.00 0.00 43.02 41.93 1s26 s PHE 328 CO -0.01 0.52 0.25 1.03 0.70 0.00 0.00 175.22 177.72 1s26 s ARG 329 N -3.75 3.21 0.41 0.44 0.52 -0.50 -1.72 118.95 117.57 1s26 s ARG 329 Ca 0.33 -0.80 -0.21 0.00 -0.52 0.00 0.00 55.73 54.52 1s26 s ARG 329 Cb -0.08 -2.79 -0.15 0.00 0.52 0.00 0.00 34.95 32.45 1s26 s ARG 329 CO 0.25 0.46 0.15 -2.30 0.02 0.00 0.00 175.30 173.87 1s26 n PRO 330 N -0.89 0.08 -4.49 3.54 -0.02 -1.25 -4.62 135.00 127.34 1s26 n PRO 330 Ca -0.08 0.03 -0.28 0.00 -2.02 0.00 0.00 63.50 61.15 1s26 n PRO 330 Cb 0.56 -1.08 -0.17 0.00 -0.02 0.00 0.00 33.50 32.80 1s26 n PRO 330 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1s26 s VAL 331 N -1.66 1.41 -0.49 -1.45 1.01 -0.98 -4.81 120.40 113.43 1s26 s VAL 331 Ca 0.60 -0.60 -0.44 0.00 0.00 0.00 0.00 61.98 61.53 1s26 s VAL 331 Cb -0.63 -1.30 -0.19 0.00 0.00 0.00 0.00 36.38 34.27 1s26 s VAL 331 CO 0.62 0.42 1.92 -3.20 0.00 0.00 0.00 175.10 174.86 1s26 n ASN 332 N 4.13 0.90 0.31 3.32 2.85 -1.26 -4.30 115.26 121.21 1s26 n ASN 332 Ca -0.19 0.85 0.19 0.00 -0.11 0.00 0.00 54.58 55.31 1s26 n ASN 332 Cb 0.51 -0.88 1.02 0.00 1.24 0.00 0.00 39.78 41.67 1s26 n ASN 332 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1s26 h LYS 333 N 7.47 0.00 -0.01 1.20 1.57 -1.93 0.71 116.57 125.59 1s26 h LYS 333 Ca -0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1s26 h LYS 333 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.69 1s26 h LYS 333 CO 1.03 0.02 -0.10 1.28 -0.57 0.00 0.00 179.45 181.12 1s26 n LEU 334 N -3.30 1.13 0.02 2.94 7.99 -1.26 -3.74 117.00 120.78 1s26 n LEU 334 Ca -0.02 -0.33 0.10 0.00 -0.01 0.00 0.00 56.01 55.75 1s26 n LEU 334 Cb 0.13 -0.06 -0.12 0.00 -0.11 0.00 0.00 43.42 43.26 1s26 n LEU 334 CO 0.24 0.20 -0.54 0.00 -1.51 0.00 0.00 177.39 175.77 1s26 n ALA 335 N -0.30 2.66 -0.13 -1.18 0.00 0.24 -4.22 120.51 117.57 1s26 n ALA 335 Ca 0.17 -0.47 -0.07 0.00 0.00 0.00 0.00 53.44 53.07 1s26 n ALA 335 Cb 0.33 -0.83 -0.00 0.00 0.00 0.00 0.00 19.45 18.94 1s26 n ALA 335 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1s26 h THR 336 N 0.00 0.26 -0.06 0.00 2.02 -1.63 0.13 112.91 113.63 1s26 h THR 336 Ca -0.03 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.10 1s26 h THR 336 Cb 1.06 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1s26 h THR 336 CO 0.00 0.00 -0.22 0.78 0.37 0.00 0.00 175.52 176.46 1s26 h ASN 337 N -0.21 0.10 -0.20 4.18 -0.26 -1.83 0.21 115.58 117.56 1s26 h ASN 337 Ca 0.19 -0.02 -0.08 0.00 -0.56 0.00 0.00 56.30 55.83 1s26 h ASN 337 Cb 0.52 -0.03 -0.00 0.00 -1.06 0.00 0.00 38.32 37.75 1s26 h ASN 337 CO -0.54 0.33 -0.17 -0.07 -1.06 0.00 0.00 177.43 175.91 1s26 h LEU 338 N 0.10 0.50 0.14 1.61 3.38 -1.40 -0.28 115.31 119.35 1s26 h LEU 338 Ca 0.02 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1s26 h LEU 338 Cb 0.44 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1s26 h LEU 338 CO 0.03 0.85 -0.10 0.40 0.09 0.00 0.00 178.44 179.72 1s26 h ILE 339 N 0.15 0.79 -0.83 1.22 2.04 -0.43 -0.31 117.51 120.13 1s26 h ILE 339 Ca 0.04 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.00 1s26 h ILE 339 Cb 0.70 0.79 -0.08 0.00 -0.74 0.00 0.00 36.82 37.49 1s26 h ILE 339 CO 0.04 0.00 0.46 0.50 0.00 0.00 0.00 178.15 179.16 1s26 h LYS 340 N -0.24 0.73 -0.01 2.37 3.64 -0.91 0.47 116.57 122.62 1s26 h LYS 340 Ca -0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1s26 h LYS 340 Cb 0.21 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1s26 h LYS 340 CO 0.00 0.48 0.00 -1.13 -2.27 0.00 0.00 179.45 176.53 1s26 n SER 341 N -4.77 0.01 0.00 4.20 3.41 -0.12 -4.83 113.62 111.51 1s26 n SER 341 Ca 0.14 -1.55 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 1s26 n SER 341 Cb 0.31 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1s26 n SER 341 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s26 n GLY 342 N 0.27 0.53 3.77 5.00 0.00 0.16 -4.94 105.19 109.98 1s26 n GLY 342 Ca 0.00 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.76 1s26 n GLY 342 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s26 s VAL 343 N -2.00 3.12 0.32 1.61 1.01 -0.16 -3.37 120.40 120.93 1s26 s VAL 343 Ca 0.00 1.07 -0.29 0.00 0.00 0.00 0.00 61.98 62.77 1s26 s VAL 343 Cb 0.00 -3.66 -0.10 0.00 0.00 0.00 0.00 36.38 32.62 1s26 s VAL 343 CO 0.00 0.21 1.35 0.00 0.00 0.00 0.00 175.10 176.66 1s26 s ALA 344 N -1.23 3.53 0.58 5.51 0.00 -1.25 -4.65 121.76 124.25 1s26 s ALA 344 Ca 0.50 1.30 0.01 0.00 0.00 0.00 0.00 51.96 53.77 1s26 s ALA 344 Cb -0.34 -3.51 0.05 0.00 0.00 0.00 0.00 23.12 19.32 1s26 s ALA 344 CO 0.44 -0.70 0.81 0.95 0.00 0.00 0.00 175.76 177.27 1s26 s THR 345 N -0.94 2.56 0.01 0.00 -4.23 -1.26 -1.37 115.64 110.41 1s26 s THR 345 Ca 0.51 -0.66 0.02 0.00 -1.18 0.00 0.00 61.69 60.38 1s26 s THR 345 Cb -0.41 -2.90 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 1s26 s THR 345 CO 0.52 0.00 -0.01 -1.59 -0.54 0.00 0.00 174.62 173.01 1s26 s LYS 346 N -4.83 2.74 0.35 3.99 -2.85 -1.04 -4.75 119.74 113.34 1s26 s LYS 346 Ca 0.59 -0.65 0.06 0.00 -1.00 0.00 0.00 55.97 54.97 1s26 s LYS 346 Cb -0.09 -2.64 0.06 0.00 -2.06 0.00 0.00 37.83 33.09 1s26 s LYS 346 CO 0.39 0.61 0.46 0.41 0.10 0.00 0.00 175.35 177.33 1s26 n GLY 347 N 1.33 2.02 0.18 0.59 0.00 -1.26 -4.67 105.19 103.37 1s26 n GLY 347 Ca -0.14 -2.19 0.13 0.00 0.00 0.00 0.00 46.02 43.81 1s26 n GLY 347 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1s26 h LEU 348 N 0.00 0.00 0.00 0.99 3.38 -1.87 -1.70 115.31 116.11 1s26 h LEU 348 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1s26 h LEU 348 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1s26 h LEU 348 CO 0.24 0.00 0.00 -0.46 0.09 0.00 0.00 178.44 178.31 1s26 n ASN 349 N -2.37 0.00 -3.75 -0.43 2.04 -1.26 -4.44 115.26 105.05 1s26 n ASN 349 Ca -0.01 -0.81 -0.28 0.00 -0.44 0.00 0.00 54.58 53.04 1s26 n ASN 349 Cb 0.07 -0.00 -0.16 0.00 -2.53 0.00 0.00 39.78 37.16 1s26 n ASN 349 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1s26 s VAL 350 N -2.00 0.63 -1.10 3.53 1.01 -0.64 -4.63 120.40 117.19 1s26 s VAL 350 Ca 0.39 -0.67 0.17 0.00 0.00 0.00 0.00 61.98 61.86 1s26 s VAL 350 Cb 0.18 -1.14 -0.10 0.00 0.00 0.00 0.00 36.38 35.32 1s26 s VAL 350 CO 0.30 -0.23 0.77 1.41 0.00 0.00 0.00 175.10 177.35 1s26 n HIS 351 N 5.01 0.00 -1.63 5.22 8.25 -1.26 -4.72 115.22 126.08 1s26 n HIS 351 Ca -0.09 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.98 1s26 n HIS 351 Cb 0.46 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.61 1s26 n HIS 351 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1s26 n GLY 352 N 1.30 -0.12 3.88 -1.41 0.00 -1.26 -4.96 105.19 102.63 1s26 n GLY 352 Ca 0.05 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1s26 n GLY 352 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s26 s LYS 353 N -2.57 3.69 0.58 1.61 -0.14 -1.26 -5.01 119.74 116.64 1s26 s LYS 353 Ca 0.71 0.45 -0.07 0.00 -1.36 0.00 0.00 55.97 55.71 1s26 s LYS 353 Cb -0.45 -2.33 -0.00 0.00 -1.68 0.00 0.00 37.83 33.37 1s26 s LYS 353 CO 0.50 -0.18 0.90 -1.54 -0.76 0.00 0.00 175.35 174.28 1s26 s SER 354 N -3.59 5.74 0.33 2.83 1.04 -1.26 -4.23 113.70 114.57 1s26 s SER 354 Ca 0.51 0.83 0.01 0.00 0.48 0.00 0.00 55.95 57.78 1s26 s SER 354 Cb -0.10 -1.87 -0.03 0.00 0.10 0.00 0.00 66.02 64.11 1s26 s SER 354 CO 0.39 -0.98 0.53 -0.55 0.98 0.00 0.00 173.24 173.60 1s26 s SER 355 N -4.26 6.30 -0.02 7.02 0.15 0.05 -1.99 113.70 120.95 1s26 s SER 355 Ca 0.53 0.41 0.21 0.00 0.70 0.00 0.00 55.95 57.80 1s26 s SER 355 Cb -0.11 -2.01 0.36 0.00 -1.71 0.00 0.00 66.02 62.55 1s26 s SER 355 CO 0.46 -0.27 1.14 -0.90 1.20 0.00 0.00 173.24 174.88 1s26 n ASP 356 N -1.72 0.90 -3.48 5.45 3.85 -1.26 -0.66 116.55 119.62 1s26 n ASP 356 Ca -0.05 -2.14 -0.10 0.00 -0.71 0.00 0.00 54.79 51.79 1s26 n ASP 356 Cb 0.56 -0.30 -0.02 0.00 -1.35 0.00 0.00 41.12 40.01 1s26 n ASP 356 CO 0.00 0.00 0.00 -1.66 -1.01 0.00 0.00 177.20 174.53 1s26 s TRP 357 N -0.25 -0.41 0.19 2.11 1.48 -1.26 -4.97 118.94 115.83 1s26 s TRP 357 Ca 0.29 0.24 0.00 0.00 -1.06 0.00 0.00 56.10 55.56 1s26 s TRP 357 Cb 0.32 0.55 0.00 0.00 -1.16 0.00 0.00 33.47 33.18 1s26 s TRP 357 CO -0.13 -0.67 0.00 0.41 -4.06 0.00 0.00 176.95 172.50 1s26 n GLY 358 N -0.30 -1.66 0.27 3.67 0.00 -1.26 -3.11 105.19 102.80 1s26 n GLY 358 Ca -0.12 -1.33 0.16 0.00 0.00 0.00 0.00 46.02 44.73 1s26 n GLY 358 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s26 h PRO 359 N -0.72 0.00 -0.64 1.61 0.13 -1.95 -1.50 132.00 128.94 1s26 h PRO 359 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1s26 h PRO 359 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1s26 h PRO 359 CO 0.01 0.00 0.00 1.55 -0.23 0.00 0.00 178.00 179.33 1s26 n VAL 360 N -2.69 1.70 -1.67 1.56 3.14 -1.26 -4.98 118.33 114.14 1s26 n VAL 360 Ca -0.02 -1.19 -0.45 0.00 -2.96 0.00 0.00 64.34 59.72 1s26 n VAL 360 Cb 0.19 0.18 -0.03 0.00 -1.06 0.00 0.00 33.84 33.13 1s26 n VAL 360 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1s26 n ALA 361 N 1.12 1.11 0.00 1.55 0.00 -0.57 -1.88 120.51 121.84 1s26 n ALA 361 Ca 0.25 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.10 1s26 n ALA 361 Cb 0.84 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 18.02 1s26 n ALA 361 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s26 n GLY 362 N 2.08 2.87 3.99 0.00 0.00 0.16 -4.87 105.19 109.41 1s26 n GLY 362 Ca 0.11 -0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 1s26 n GLY 362 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s26 s TYR 363 N -2.19 2.04 -0.54 1.61 1.51 -0.79 -3.87 117.35 115.13 1s26 s TYR 363 Ca 0.00 -0.18 -0.11 0.00 -1.01 0.00 0.00 57.07 55.77 1s26 s TYR 363 Cb 0.00 -2.89 0.13 0.00 -0.11 0.00 0.00 41.96 39.10 1s26 s TYR 363 CO 0.00 -1.40 0.44 0.42 -1.11 0.00 0.00 175.55 173.89 1s26 s ILE 364 N -3.00 4.61 0.31 2.71 -1.09 -1.24 -0.77 121.20 122.74 1s26 s ILE 364 Ca 0.63 -1.84 -0.29 0.00 -2.23 0.00 0.00 60.65 56.92 1s26 s ILE 364 Cb -0.07 -3.99 -0.10 0.00 -1.58 0.00 0.00 42.46 36.72 1s26 s ILE 364 CO 0.42 -0.84 1.26 -2.16 -1.23 0.00 0.00 174.94 172.40 1s26 s PRO 365 N 1.23 4.42 0.14 2.79 0.04 -1.26 -0.84 135.00 141.52 1s26 s PRO 365 Ca 0.07 2.12 -0.16 0.00 0.04 0.00 0.00 61.00 63.07 1s26 s PRO 365 Cb -0.25 -3.10 0.01 0.00 0.04 0.00 0.00 34.50 31.19 1s26 s PRO 365 CO -0.01 -0.10 1.73 0.35 0.04 0.00 0.00 177.00 179.01 1s26 h PHE 366 N 3.58 0.60 -2.52 0.56 3.57 -1.20 -3.33 116.94 118.20 1s26 h PHE 366 Ca -0.48 -0.02 -0.55 0.00 3.53 0.00 0.00 57.97 60.44 1s26 h PHE 366 Cb 1.22 -0.19 -0.09 0.00 2.79 0.00 0.00 35.95 39.69 1s26 h PHE 366 CO 0.57 0.48 0.98 0.34 -2.23 0.00 0.00 178.31 178.45 1s26 s ASP 367 N -5.77 6.20 0.00 0.41 3.68 -1.26 -4.74 116.67 115.19 1s26 s ASP 367 Ca -0.13 -0.43 0.03 0.00 2.13 0.00 0.00 52.55 54.15 1s26 s ASP 367 Cb 0.11 -2.54 0.16 0.00 -1.45 0.00 0.00 42.92 39.20 1s26 s ASP 367 CO 0.75 -1.74 0.93 0.00 0.13 0.00 0.00 175.17 175.24 1s26 n GLN 368 N 9.04 0.04 0.00 4.34 1.13 -1.25 -1.65 117.38 129.03 1s26 n GLN 368 Ca 0.03 0.26 0.13 0.00 -1.94 0.00 0.00 57.00 55.48 1s26 n GLN 368 Cb 0.49 -1.50 0.59 0.00 0.11 0.00 0.00 30.24 29.92 1s26 n GLN 368 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1s26 n ASP 369 N -1.30 0.00 -0.13 1.08 2.03 -1.26 -1.97 116.55 115.00 1s26 n ASP 369 Ca 0.01 0.37 0.12 0.00 0.52 0.00 0.00 54.79 55.82 1s26 n ASP 369 Cb 0.03 -0.45 0.21 0.00 -0.72 0.00 0.00 41.12 40.18 1s26 n ASP 369 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1s26 n LEU 370 N -1.45 0.90 0.00 -2.67 4.77 -0.66 -4.33 117.00 113.56 1s26 n LEU 370 Ca 0.08 -0.24 -0.15 0.00 -0.03 0.00 0.00 56.01 55.67 1s26 n LEU 370 Cb 0.29 -0.14 0.10 0.00 -2.33 0.00 0.00 43.42 41.34 1s26 n LEU 370 CO 0.24 0.19 0.44 -1.54 -1.33 0.00 0.00 177.39 175.39 1s26 n SER 371 N -1.08 0.01 0.09 -1.43 3.41 -0.83 -4.65 113.62 109.14 1s26 n SER 371 Ca 0.08 -1.23 0.11 0.00 -0.26 0.00 0.00 58.87 57.57 1s26 n SER 371 Cb 0.35 -0.52 0.45 0.00 -0.26 0.00 0.00 64.21 64.24 1s26 n SER 371 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1s26 n LYS 372 N -2.45 0.16 -0.29 4.33 2.85 -0.84 -2.06 118.16 119.86 1s26 n LYS 372 Ca 0.08 0.32 0.02 0.00 -1.05 0.00 0.00 58.31 57.68 1s26 n LYS 372 Cb 0.29 -1.77 0.13 0.00 -0.65 0.00 0.00 35.03 33.03 1s26 n LYS 372 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1s26 n LYS 373 N -2.07 2.23 -1.61 -1.58 4.01 -1.26 -4.93 118.16 112.95 1s26 n LYS 373 Ca 0.03 -1.00 -0.44 0.00 -0.51 0.00 0.00 58.31 56.40 1s26 n LYS 373 Cb 0.27 -1.74 -0.01 0.00 -0.51 0.00 0.00 35.03 33.04 1s26 n LYS 373 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 1s26 n HIS 374 N 0.19 1.43 0.00 2.13 -0.00 -0.88 -2.14 115.22 115.96 1s26 n HIS 374 Ca 0.09 0.65 0.00 0.00 -0.00 0.00 0.00 57.72 58.46 1s26 n HIS 374 Cb 0.56 -2.28 0.00 0.00 -0.00 0.00 0.00 29.99 28.27 1s26 n HIS 374 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1s26 n GLY 375 N 1.13 2.96 3.33 1.57 0.00 -1.26 -4.97 105.19 107.95 1s26 n GLY 375 Ca 0.09 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.64 1s26 n GLY 375 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s26 s GLN 376 N -0.04 3.54 0.29 1.61 -0.21 -0.91 -4.97 119.66 118.97 1s26 s GLN 376 Ca 0.00 -2.36 -0.04 0.00 0.02 0.00 0.00 55.36 52.99 1s26 s GLN 376 Cb 0.00 -4.43 0.59 0.00 1.00 0.00 0.00 33.01 30.17 1s26 s GLN 376 CO 0.00 -1.31 1.57 0.37 -2.12 0.00 0.00 175.29 173.80 1s26 h GLN 377 N 7.94 0.01 -0.47 2.91 4.15 -1.91 -0.29 115.11 127.46 1s26 h GLN 377 Ca 0.06 -0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.40 1s26 h GLN 377 Cb 1.05 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.72 1s26 h GLN 377 CO 0.80 0.01 -0.04 1.25 -1.93 0.00 0.00 178.83 178.92 1s26 h LEU 378 N 0.01 0.84 -0.09 -2.39 5.85 -1.97 -1.85 115.31 115.72 1s26 h LEU 378 Ca 0.52 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 1s26 h LEU 378 Cb 0.95 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 1s26 h LEU 378 CO -0.94 0.97 0.01 0.00 -0.34 0.00 0.00 178.44 178.14 1s26 h ALA 379 N 0.90 0.12 -0.65 1.25 0.00 -1.57 -0.95 119.26 118.37 1s26 h ALA 379 Ca 0.13 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1s26 h ALA 379 Cb 0.56 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 1s26 h ALA 379 CO 0.03 -0.22 0.29 0.28 0.00 0.00 0.00 179.25 179.62 1s26 h VAL 380 N -0.10 0.81 -0.48 0.00 2.07 -1.08 0.51 116.25 117.99 1s26 h VAL 380 Ca 0.03 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1s26 h VAL 380 Cb 0.30 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1s26 h VAL 380 CO 0.00 0.09 0.24 -0.33 0.02 0.00 0.00 177.57 177.59 1s26 h GLU 381 N 0.50 0.69 -0.72 1.57 5.08 -1.19 0.47 114.58 120.98 1s26 h GLU 381 Ca 0.32 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.52 1s26 h GLU 381 Cb 0.36 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1s26 h GLU 381 CO -0.28 0.57 0.20 -0.22 -1.00 0.00 0.00 179.01 178.28 1s26 h LYS 382 N 0.63 1.12 0.54 2.33 1.63 -0.42 -0.47 116.57 121.94 1s26 h LYS 382 Ca 0.17 -0.25 -0.02 0.00 -0.85 0.00 0.00 60.65 59.69 1s26 h LYS 382 Cb 0.11 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 31.58 1s26 h LYS 382 CO -0.02 0.97 -0.31 0.78 -3.45 0.00 0.00 179.45 177.42 1s26 h GLY 383 N 1.10 -0.84 0.91 5.01 0.00 0.83 -0.70 103.07 109.37 1s26 h GLY 383 Ca 0.23 0.34 0.05 0.00 0.00 0.00 0.00 47.33 47.95 1s26 h GLY 383 CO -0.00 -0.31 0.59 3.43 0.00 0.00 0.00 176.54 180.25 1s26 h ASN 384 N -0.80 0.94 -0.10 0.19 2.35 0.05 -0.01 115.58 118.20 1s26 h ASN 384 Ca -0.07 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 1s26 h ASN 384 Cb 0.63 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 1s26 h ASN 384 CO 0.09 0.62 -0.07 0.25 -1.65 0.00 0.00 177.43 176.66 1s26 h LEU 385 N 1.07 0.36 0.16 1.61 7.12 -0.73 0.15 115.31 125.05 1s26 h LEU 385 Ca 0.38 -0.07 -0.01 0.00 0.13 0.00 0.00 57.88 58.31 1s26 h LEU 385 Cb 0.13 -0.10 0.00 0.00 -0.53 0.00 0.00 40.66 40.16 1s26 h LEU 385 CO -0.13 0.48 -0.07 -0.33 -0.13 0.00 0.00 178.44 178.26 1s26 h GLU 386 N 0.37 -0.20 -0.69 1.25 4.39 0.49 -1.86 114.58 118.33 1s26 h GLU 386 Ca 0.08 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.87 1s26 h GLU 386 Cb 0.36 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.99 1s26 h GLU 386 CO 0.02 0.11 0.35 -0.91 -1.16 0.00 0.00 179.01 177.42 1s26 h ASN 387 N -0.52 0.47 -0.85 1.42 2.35 -0.78 -0.65 115.58 117.02 1s26 h ASN 387 Ca -0.02 0.05 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 1s26 h ASN 387 Cb 0.40 -0.03 -0.05 0.00 0.05 0.00 0.00 38.32 38.69 1s26 h ASN 387 CO 0.03 0.28 0.54 0.11 -1.65 0.00 0.00 177.43 176.75 1s26 h LYS 388 N 0.61 1.00 -0.37 0.81 6.56 -0.84 -1.10 116.57 123.24 1s26 h LYS 388 Ca 0.33 -0.06 -0.11 0.00 -1.06 0.00 0.00 60.65 59.75 1s26 h LYS 388 Cb 0.32 -0.23 -0.01 0.00 -0.57 0.00 0.00 32.23 31.74 1s26 h LYS 388 CO -0.25 0.66 -0.21 0.87 -2.06 0.00 0.00 179.45 178.47 1s26 h LYS 389 N 1.03 0.79 -0.62 3.15 1.57 -0.44 -2.69 116.57 119.36 1s26 h LYS 389 Ca 0.35 -0.36 0.06 0.00 -1.87 0.00 0.00 60.65 58.83 1s26 h LYS 389 Cb 0.06 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 1s26 h LYS 389 CO -0.14 0.99 0.33 0.77 -0.57 0.00 0.00 179.45 180.83 1s26 h SER 390 N 0.59 0.47 0.23 0.86 0.02 -0.44 0.63 113.55 115.91 1s26 h SER 390 Ca 0.08 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1s26 h SER 390 Cb 0.77 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 1s26 h SER 390 CO 0.06 0.30 -0.20 0.40 -1.14 0.00 0.00 176.83 176.25 1s26 h ILE 391 N 0.61 1.08 0.00 3.27 1.08 -1.12 -3.01 117.51 119.42 1s26 h ILE 391 Ca 0.28 -0.71 -0.24 0.00 -0.39 0.00 0.00 64.86 63.80 1s26 h ILE 391 Cb 0.20 1.39 -0.04 0.00 -3.07 0.00 0.00 36.82 35.30 1s26 h ILE 391 CO -0.19 0.20 -1.72 0.35 -0.69 0.00 0.00 178.15 176.10 1s26 n THR 392 N -4.20 1.26 0.17 -0.27 -2.24 -0.77 -3.76 114.28 104.47 1s26 n THR 392 Ca -0.02 -0.13 0.04 0.00 -2.27 0.00 0.00 64.05 61.66 1s26 n THR 392 Cb 0.27 -1.92 0.18 0.00 -2.10 0.00 0.00 70.33 66.76 1s26 n THR 392 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1s26 n GLU 393 N -4.05 0.03 -1.75 -0.78 1.02 0.21 -1.58 120.64 113.74 1s26 n GLU 393 Ca -0.32 0.45 -0.01 0.00 -0.02 0.00 0.00 57.16 57.27 1s26 n GLU 393 Cb 0.67 -1.58 0.07 0.00 -0.02 0.00 0.00 31.44 30.58 1s26 n GLU 393 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1s26 n HIS 394 N -1.63 0.72 -1.57 -0.32 8.25 -1.13 -5.03 115.22 114.50 1s26 n HIS 394 Ca 0.01 -1.38 -0.55 0.00 -0.26 0.00 0.00 57.72 55.54 1s26 n HIS 394 Cb 0.06 -0.22 -0.07 0.00 1.12 0.00 0.00 29.99 30.88 1s26 n HIS 394 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1s26 n GLU 395 N -0.29 0.73 0.00 -0.41 2.13 -0.62 -0.85 120.64 121.34 1s26 n GLU 395 Ca 0.14 0.26 0.00 0.00 0.66 0.00 0.00 57.16 58.23 1s26 n GLU 395 Cb 0.94 -1.86 0.00 0.00 0.27 0.00 0.00 31.44 30.79 1s26 n GLU 395 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1s26 n GLY 396 N 2.33 3.03 0.12 8.31 0.00 -1.26 -4.78 105.19 112.93 1s26 n GLY 396 Ca 0.20 -0.57 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 1s26 n GLY 396 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1s26 n GLU 397 N 0.00 0.71 -4.80 1.61 4.07 -0.03 -4.49 120.64 117.70 1s26 n GLU 397 Ca 0.00 0.25 -0.27 0.00 -0.06 0.00 0.00 57.16 57.09 1s26 n GLU 397 Cb 0.00 -1.72 -0.16 0.00 -0.06 0.00 0.00 31.44 29.50 1s26 n GLU 397 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1s26 s ILE 398 N -2.57 1.43 0.00 6.31 -1.09 -1.02 -0.85 121.20 123.41 1s26 s ILE 398 Ca -0.16 -0.67 0.00 0.00 -2.23 0.00 0.00 60.65 57.58 1s26 s ILE 398 Cb 0.07 -1.26 0.00 0.00 -1.58 0.00 0.00 42.46 39.70 1s26 s ILE 398 CO 0.78 0.42 0.00 0.61 -1.23 0.00 0.00 174.94 175.52 1s26 n GLY 399 N 3.51 5.41 3.10 6.18 0.00 0.14 -4.49 105.19 119.04 1s26 n GLY 399 Ca -0.20 -1.46 -0.12 0.00 0.00 0.00 0.00 46.02 44.23 1s26 n GLY 399 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s26 s LYS 400 N 1.03 0.35 0.08 1.61 -2.85 -1.26 -0.74 119.74 117.96 1s26 s LYS 400 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 55.97 54.92 1s26 s LYS 400 Cb 0.00 0.16 -0.02 0.00 -2.06 0.00 0.00 37.83 35.91 1s26 s LYS 400 CO 0.00 -0.07 0.10 0.96 0.10 0.00 0.00 175.35 176.44 1s26 s ILE 401 N -0.52 0.17 0.28 3.79 -4.36 -0.42 -4.91 121.20 115.22 1s26 s ILE 401 Ca -0.06 -1.48 -0.30 0.00 -0.26 0.00 0.00 60.65 58.56 1s26 s ILE 401 Cb -0.04 -1.47 -0.11 0.00 1.25 0.00 0.00 42.46 42.10 1s26 s ILE 401 CO 0.01 -0.77 1.49 -2.84 0.24 0.00 0.00 174.94 173.08 1s26 s PRO 402 N -3.90 4.21 0.27 0.37 0.02 -1.26 -0.12 135.00 134.59 1s26 s PRO 402 Ca 0.07 2.42 -0.29 0.00 0.02 0.00 0.00 61.00 63.22 1s26 s PRO 402 Cb 0.06 -3.07 -0.10 0.00 0.02 0.00 0.00 34.50 31.42 1s26 s PRO 402 CO -0.10 -0.49 1.27 -1.17 -0.33 0.00 0.00 177.00 176.19 1s26 s LEU 403 N -0.62 4.45 -0.18 -5.54 2.96 0.06 -4.82 118.68 114.98 1s26 s LEU 403 Ca 0.60 2.51 0.00 0.00 -0.22 0.00 0.00 54.13 57.02 1s26 s LEU 403 Cb -0.44 -3.63 0.04 0.00 0.50 0.00 0.00 46.19 42.66 1s26 s LEU 403 CO 0.47 -0.47 -0.08 -0.54 -1.32 0.00 0.00 176.35 174.41 1s26 s LYS 404 N -1.11 1.74 -0.37 1.98 1.02 -1.26 -2.53 119.74 119.22 1s26 s LYS 404 Ca 0.51 -0.67 -0.13 0.00 0.02 0.00 0.00 55.97 55.69 1s26 s LYS 404 Cb -0.37 -2.21 -0.00 0.00 -0.52 0.00 0.00 37.83 34.73 1s26 s LYS 404 CO 0.45 -0.43 0.26 -0.51 -0.92 0.00 0.00 175.35 174.21 1s26 s LEU 405 N 1.52 4.73 0.65 3.17 1.43 -0.94 -5.03 118.68 124.20 1s26 s LEU 405 Ca -0.00 -0.62 -0.07 0.00 -1.03 0.00 0.00 54.13 52.40 1s26 s LEU 405 Cb -0.16 -2.14 0.03 0.00 0.03 0.00 0.00 46.19 43.95 1s26 s LEU 405 CO -0.08 -0.32 0.98 1.51 0.23 0.00 0.00 176.35 178.67 1s26 s ASP 406 N 1.70 5.30 0.26 2.29 -4.77 -1.26 -4.85 116.67 115.34 1s26 s ASP 406 Ca 0.05 0.71 -0.10 0.00 -3.30 0.00 0.00 52.55 49.91 1s26 s ASP 406 Cb -0.18 -1.55 0.39 0.00 -1.09 0.00 0.00 42.92 40.49 1s26 s ASP 406 CO 0.10 -1.29 1.57 0.45 0.70 0.00 0.00 175.17 176.69 1s26 h HIS 407 N -0.41 -0.62 -0.30 2.11 3.86 -1.99 -1.38 115.15 116.42 1s26 h HIS 407 Ca -0.45 0.09 -0.13 0.00 -1.16 0.00 0.00 60.37 58.72 1s26 h HIS 407 Cb 1.28 0.42 -0.01 0.00 1.06 0.00 0.00 27.41 30.16 1s26 h HIS 407 CO 0.43 -0.41 -0.34 -0.07 0.86 0.00 0.00 177.93 178.40 1s26 h LEU 408 N -0.00 0.68 -0.44 2.43 3.38 -2.01 -3.13 115.31 116.22 1s26 h LEU 408 Ca 0.44 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1s26 h LEU 408 Cb 0.68 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1s26 h LEU 408 CO -0.98 0.97 -0.00 -0.09 0.09 0.00 0.00 178.44 178.42 1s26 h ARG 409 N 0.55 0.79 -0.85 1.13 9.65 -1.65 -2.24 114.38 121.75 1s26 h ARG 409 Ca 0.06 -0.25 0.12 0.00 -1.10 0.00 0.00 59.98 58.80 1s26 h ARG 409 Cb 0.85 -0.07 -0.08 0.00 -1.39 0.00 0.00 29.97 29.28 1s26 h ARG 409 CO 0.07 0.85 0.48 0.82 2.80 0.00 0.00 179.97 184.99 1s26 h ILE 410 N 0.63 0.85 -0.00 1.20 1.08 -1.36 0.79 117.51 120.69 1s26 h ILE 410 Ca 0.13 -0.26 -0.00 0.00 -0.39 0.00 0.00 64.86 64.34 1s26 h ILE 410 Cb 0.50 0.03 -0.00 0.00 -3.07 0.00 0.00 36.82 34.28 1s26 h ILE 410 CO 0.02 0.14 0.00 -0.08 -0.69 0.00 0.00 178.15 177.54 1s26 h GLU 411 N 0.75 0.00 -0.99 2.37 4.57 -1.44 -1.05 114.58 118.79 1s26 h GLU 411 Ca 0.43 -0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.72 1s26 h GLU 411 Cb 0.48 -0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 28.99 1s26 h GLU 411 CO -0.29 0.12 0.63 0.93 -1.18 0.00 0.00 179.01 179.22 1s26 h GLU 412 N -0.12 1.00 -0.13 1.92 5.08 -0.62 -0.07 114.58 121.64 1s26 h GLU 412 Ca 0.00 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 1s26 h GLU 412 Cb 0.12 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1s26 h GLU 412 CO -0.00 0.66 -0.33 -0.07 -1.00 0.00 0.00 179.01 178.27 1s26 h LEU 413 N 1.03 0.27 -0.15 1.33 3.38 -0.43 -1.01 115.31 119.72 1s26 h LEU 413 Ca 0.47 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.30 1s26 h LEU 413 Cb 0.41 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1s26 h LEU 413 CO -0.23 0.60 -0.07 0.50 0.09 0.00 0.00 178.44 179.33 1s26 h LYS 414 N 0.23 0.32 -0.62 1.13 3.64 0.23 -0.23 116.57 121.28 1s26 h LYS 414 Ca 0.03 -0.14 0.06 0.00 -1.27 0.00 0.00 60.65 59.33 1s26 h LYS 414 Cb 0.71 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.48 1s26 h LYS 414 CO 0.05 0.63 0.41 0.93 -2.27 0.00 0.00 179.45 179.20 1s26 h GLU 415 N -0.00 0.60 -0.00 1.90 4.39 -0.76 0.24 114.58 120.95 1s26 h GLU 415 Ca 0.04 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1s26 h GLU 415 Cb 0.53 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1s26 h GLU 415 CO 0.02 0.40 -0.01 0.09 -1.16 0.00 0.00 179.01 178.35 1s26 n ASN 416 N -4.47 0.33 -3.75 1.42 5.03 -0.41 -4.91 115.26 108.49 1s26 n ASN 416 Ca 0.08 -1.00 -0.24 0.00 0.87 0.00 0.00 54.58 54.30 1s26 n ASN 416 Cb 0.22 -0.03 0.04 0.00 -1.02 0.00 0.00 39.78 38.99 1s26 n ASN 416 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1s26 n GLY 417 N 1.08 -0.37 0.10 7.41 0.00 0.83 -4.90 105.19 109.34 1s26 n GLY 417 Ca 0.21 0.15 -0.12 0.00 0.00 0.00 0.00 46.02 46.27 1s26 n GLY 417 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1s26 n ILE 418 N -4.44 1.22 -3.66 -0.61 2.08 -0.17 -5.03 119.36 108.75 1s26 n ILE 418 Ca -0.17 -0.60 -0.11 0.00 0.56 0.00 0.00 62.75 62.43 1s26 n ILE 418 Cb 0.62 -0.93 -0.05 0.00 -0.75 0.00 0.00 39.64 38.53 1s26 n ILE 418 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 1s26 s ILE 419 N -2.43 0.07 -0.04 1.39 -4.36 -1.23 -4.24 121.20 110.36 1s26 s ILE 419 Ca -0.20 -0.60 0.02 0.00 -0.26 0.00 0.00 60.65 59.62 1s26 s ILE 419 Cb 0.06 -1.13 0.01 0.00 1.25 0.00 0.00 42.46 42.65 1s26 s ILE 419 CO 0.60 -0.33 -0.10 -0.76 0.24 0.00 0.00 174.94 174.59 1s26 s LEU 420 N -2.63 1.71 -0.29 0.37 1.43 -1.04 -3.93 118.68 114.30 1s26 s LEU 420 Ca 0.01 -0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 52.61 1s26 s LEU 420 Cb 0.02 -0.64 -0.02 0.00 0.03 0.00 0.00 46.19 45.58 1s26 s LEU 420 CO -0.10 0.05 1.70 -0.75 0.23 0.00 0.00 176.35 177.48 1s26 s LYS 421 N 0.36 3.55 0.00 1.70 2.47 -1.26 -1.71 119.74 124.85 1s26 s LYS 421 Ca -0.07 1.50 0.00 0.00 -1.56 0.00 0.00 55.97 55.85 1s26 s LYS 421 Cb -0.11 -4.12 0.00 0.00 -1.46 0.00 0.00 37.83 32.14 1s26 s LYS 421 CO 0.01 -1.59 0.00 0.41 0.16 0.00 0.00 175.35 174.34 1s26 n GLY 422 N 5.08 1.19 3.82 5.54 0.00 0.23 -4.97 105.19 116.08 1s26 n GLY 422 Ca 0.21 -1.73 -0.31 0.00 0.00 0.00 0.00 46.02 44.19 1s26 n GLY 422 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s26 s LYS 423 N 1.85 2.74 0.77 1.61 -2.85 -1.26 -4.40 119.74 118.21 1s26 s LYS 423 Ca 0.00 0.83 -0.11 0.00 -1.00 0.00 0.00 55.97 55.69 1s26 s LYS 423 Cb 0.00 -1.98 0.06 0.00 -2.06 0.00 0.00 37.83 33.85 1s26 s LYS 423 CO 0.00 -1.21 1.10 0.21 0.10 0.00 0.00 175.35 175.55 1s26 s LYS 424 N -5.10 2.28 -0.16 1.78 2.20 -1.26 -1.14 119.74 118.34 1s26 s LYS 424 Ca 0.59 0.58 -0.29 0.00 -0.36 0.00 0.00 55.97 56.49 1s26 s LYS 424 Cb -0.14 -1.95 0.09 0.00 -1.51 0.00 0.00 37.83 34.33 1s26 s LYS 424 CO 0.55 -1.47 0.82 -2.00 -0.36 0.00 0.00 175.35 172.89 1s26 s GLU 425 N -5.22 0.81 -0.02 4.03 2.12 0.70 -4.86 118.70 116.26 1s26 s GLU 425 Ca 0.60 0.44 0.08 0.00 0.36 0.00 0.00 54.97 56.45 1s26 s GLU 425 Cb -0.13 0.38 -0.02 0.00 0.26 0.00 0.00 34.13 34.62 1s26 s GLU 425 CO 0.53 -0.20 -0.24 0.42 -0.54 0.00 0.00 175.26 175.23 1s26 s ILE 426 N -0.60 1.92 -0.11 -3.70 1.01 -1.26 -0.02 121.20 118.44 1s26 s ILE 426 Ca -0.04 -1.05 -0.04 0.00 0.00 0.00 0.00 60.65 59.52 1s26 s ILE 426 Cb -0.02 -1.59 0.05 0.00 0.01 0.00 0.00 42.46 40.91 1s26 s ILE 426 CO 0.03 0.53 0.21 -0.62 0.00 0.00 0.00 174.94 175.10 1s26 s ASP 427 N -0.60 0.48 -1.55 3.58 3.68 -0.64 -4.88 116.67 116.75 1s26 s ASP 427 Ca 0.09 0.47 -0.07 0.00 2.13 0.00 0.00 52.55 55.17 1s26 s ASP 427 Cb -0.09 0.48 0.06 0.00 -1.45 0.00 0.00 42.92 41.92 1s26 s ASP 427 CO -0.01 -0.24 0.44 -3.20 0.13 0.00 0.00 175.17 172.30 1s26 n ASN 428 N 5.24 -0.95 -1.95 -0.34 5.15 -1.26 -1.00 115.26 120.15 1s26 n ASN 428 Ca -0.07 -1.08 -0.14 0.00 -0.60 0.00 0.00 54.58 52.69 1s26 n ASN 428 Cb 0.50 -2.56 0.02 0.00 -0.53 0.00 0.00 39.78 37.21 1s26 n ASN 428 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1s26 n GLY 429 N -1.90 -0.08 2.96 8.20 0.00 -1.26 -5.03 105.19 108.07 1s26 n GLY 429 Ca -0.18 -0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 1s26 n GLY 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s26 s LYS 430 N -5.22 1.04 -0.11 1.61 -0.14 -0.17 -5.13 119.74 111.62 1s26 s LYS 430 Ca 0.18 -0.23 -0.24 0.00 -1.36 0.00 0.00 55.97 54.31 1s26 s LYS 430 Cb -0.08 -0.96 -0.03 0.00 -1.68 0.00 0.00 37.83 35.09 1s26 s LYS 430 CO 0.22 0.01 0.75 0.21 -0.76 0.00 0.00 175.35 175.78 1s26 s LYS 431 N 0.60 4.37 0.13 1.68 2.20 -1.26 -1.62 119.74 125.83 1s26 s LYS 431 Ca -0.09 0.92 0.06 0.00 -0.36 0.00 0.00 55.97 56.49 1s26 s LYS 431 Cb -0.13 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 1s26 s LYS 431 CO 0.01 -0.11 -0.13 0.71 -0.36 0.00 0.00 175.35 175.47 1s26 s TYR 432 N 1.39 1.40 -0.08 4.03 1.51 0.97 -1.14 117.35 125.43 1s26 s TYR 432 Ca 0.37 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.88 1s26 s TYR 432 Cb -0.17 -0.72 0.01 0.00 -0.11 0.00 0.00 41.96 40.97 1s26 s TYR 432 CO 0.16 0.15 -0.15 0.71 -1.11 0.00 0.00 175.55 175.31 1s26 s TYR 433 N -2.36 1.77 0.70 2.71 1.51 -0.75 -0.21 117.35 120.72 1s26 s TYR 433 Ca 0.11 -0.70 -0.13 0.00 -1.01 0.00 0.00 57.07 55.33 1s26 s TYR 433 Cb -0.04 -1.26 0.02 0.00 -0.11 0.00 0.00 41.96 40.57 1s26 s TYR 433 CO 0.03 -0.34 1.10 -0.51 -1.11 0.00 0.00 175.55 174.72 1s26 s LEU 434 N 0.64 3.26 -0.21 -1.29 1.02 -0.30 -0.93 118.68 120.87 1s26 s LEU 434 Ca -0.14 1.92 0.00 0.00 0.02 0.00 0.00 54.13 55.93 1s26 s LEU 434 Cb -0.16 -4.54 0.05 0.00 0.02 0.00 0.00 46.19 41.56 1s26 s LEU 434 CO 0.04 -1.75 -0.06 -0.76 0.02 0.00 0.00 176.35 173.85 1s26 s LEU 435 N -5.24 2.22 0.31 1.79 1.43 -0.71 0.76 118.68 119.23 1s26 s LEU 435 Ca 0.65 -0.99 -0.09 0.00 -1.03 0.00 0.00 54.13 52.66 1s26 s LEU 435 Cb -0.19 -1.09 -0.07 0.00 0.03 0.00 0.00 46.19 44.87 1s26 s LEU 435 CO 0.47 -0.21 0.64 -1.61 0.23 0.00 0.00 176.35 175.86 1s26 s GLU 436 N 1.48 3.78 -0.07 1.70 8.01 -0.69 -3.85 118.70 129.06 1s26 s GLU 436 Ca -0.03 0.32 -0.24 0.00 0.01 0.00 0.00 54.97 55.02 1s26 s GLU 436 Cb -0.17 -2.54 0.05 0.00 -4.31 0.00 0.00 34.13 27.15 1s26 s GLU 436 CO -0.07 0.17 0.54 -1.54 0.01 0.00 0.00 175.26 174.37 1s26 s SER 437 N -2.77 -0.50 0.00 -0.19 1.04 -1.26 -2.49 113.70 107.53 1s26 s SER 437 Ca 0.49 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.50 1s26 s SER 437 Cb -0.11 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1s26 s SER 437 CO 0.26 -0.48 0.28 -0.46 0.98 0.00 0.00 173.24 173.81 1s26 n ASN 438 N 1.36 0.41 -4.79 7.02 2.04 -1.26 -4.77 115.26 115.27 1s26 n ASN 438 Ca -0.19 -0.98 -0.36 0.00 -0.44 0.00 0.00 54.58 52.61 1s26 n ASN 438 Cb 0.56 -0.21 -0.05 0.00 -2.53 0.00 0.00 39.78 37.56 1s26 n ASN 438 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 1s26 s ASN 439 N -0.67 6.96 -0.16 0.53 3.84 -1.26 -5.00 114.94 119.18 1s26 s ASN 439 Ca 0.00 1.91 0.05 0.00 0.21 0.00 0.00 52.86 55.03 1s26 s ASN 439 Cb 0.00 -2.57 -0.23 0.00 -0.55 0.00 0.00 41.25 37.90 1s26 s ASN 439 CO 0.00 -0.34 0.19 0.00 -2.79 0.00 0.00 177.10 174.15 1s26 n GLN 440 N 0.00 0.69 0.11 0.43 0.00 -1.26 -4.60 117.38 112.75 1s26 n GLN 440 Ca 0.04 0.18 -0.22 0.00 0.00 0.00 0.00 57.00 57.01 1s26 n GLN 440 Cb 0.51 -1.63 -0.13 0.00 0.00 0.00 0.00 30.24 28.98 1s26 n GLN 440 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1s26 h VAL 441 N 0.02 1.32 -1.75 -0.39 2.07 -1.94 -3.45 116.25 112.13 1s26 h VAL 441 Ca -0.47 -2.61 -0.55 0.00 0.82 0.00 0.00 66.70 63.90 1s26 h VAL 441 Cb 2.03 2.81 -0.07 0.00 -1.52 0.00 0.00 31.29 34.54 1s26 h VAL 441 CO 0.02 0.79 -0.51 -0.31 0.02 0.00 0.00 177.57 177.58 1s26 s TYR 442 N -2.85 2.67 -0.01 1.57 1.51 -1.26 -1.27 117.35 117.72 1s26 s TYR 442 Ca -0.08 -0.46 0.01 0.00 -1.01 0.00 0.00 57.07 55.53 1s26 s TYR 442 Cb 0.06 -1.80 0.00 0.00 -0.11 0.00 0.00 41.96 40.11 1s26 s TYR 442 CO 0.93 0.24 -0.04 -2.00 -1.11 0.00 0.00 175.55 173.56 1s26 s GLU 443 N -3.89 0.42 0.27 -0.62 2.12 -0.64 -4.85 118.70 111.51 1s26 s GLU 443 Ca 0.40 -0.14 0.07 0.00 0.36 0.00 0.00 54.97 55.66 1s26 s GLU 443 Cb -0.01 -0.43 -0.06 0.00 0.26 0.00 0.00 34.13 33.90 1s26 s GLU 443 CO 0.23 0.06 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.87 1s26 s PHE 444 N 0.09 1.94 0.13 5.30 0.40 -1.25 -1.87 117.98 122.72 1s26 s PHE 444 Ca -0.01 -0.65 -0.24 0.00 -0.60 0.00 0.00 56.93 55.43 1s26 s PHE 444 Cb -0.04 -1.06 0.07 0.00 0.51 0.00 0.00 43.02 42.50 1s26 s PHE 444 CO -0.00 0.32 0.61 -0.98 0.70 0.00 0.00 175.22 175.87 1s26 s ARG 445 N -3.70 1.25 0.03 0.44 1.70 -0.84 -1.75 118.95 116.07 1s26 s ARG 445 Ca 0.28 -0.38 0.07 0.00 -0.47 0.00 0.00 55.73 55.23 1s26 s ARG 445 Cb 0.03 0.58 -0.02 0.00 -0.57 0.00 0.00 34.95 34.96 1s26 s ARG 445 CO 0.11 -0.53 -0.20 -1.50 -1.08 0.00 0.00 175.30 172.10 1s26 s ILE 446 N -3.41 1.62 0.25 4.99 2.07 -0.11 -0.18 121.20 126.43 1s26 s ILE 446 Ca -0.01 -1.08 -0.30 0.00 -1.41 0.00 0.00 60.65 57.85 1s26 s ILE 446 Cb -0.01 -1.39 -0.09 0.00 0.13 0.00 0.00 42.46 41.10 1s26 s ILE 446 CO -0.10 0.27 1.16 -0.55 -1.91 0.00 0.00 174.94 173.82 1s26 s SER 447 N -0.96 7.14 0.18 4.50 0.15 0.76 -1.80 113.70 123.67 1s26 s SER 447 Ca 0.07 2.31 0.12 0.00 0.70 0.00 0.00 55.95 59.15 1s26 s SER 447 Cb -0.08 -2.62 -0.07 0.00 -1.71 0.00 0.00 66.02 61.53 1s26 s SER 447 CO 0.01 -0.28 1.27 -0.78 1.20 0.00 0.00 173.24 174.66 1s26 h ASP 448 N 4.32 0.00 0.33 5.45 1.82 -1.47 -2.28 116.42 124.58 1s26 h ASP 448 Ca -0.46 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.16 1s26 h ASP 448 Cb 1.21 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.23 1s26 h ASP 448 CO 0.70 0.71 -0.16 -0.33 -1.61 0.00 0.00 179.24 178.55 1s26 h GLU 449 N 0.00 -0.42 -0.12 0.28 5.08 -1.92 -3.40 114.58 114.07 1s26 h GLU 449 Ca -0.04 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1s26 h GLU 449 Cb 1.58 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.92 1s26 h GLU 449 CO 0.09 -0.21 0.00 0.27 -1.00 0.00 0.00 179.01 178.16 1s26 n ASN 450 N -5.07 2.12 -1.22 1.42 6.94 -1.26 -5.01 115.26 113.18 1s26 n ASN 450 Ca -0.06 -1.66 -0.12 0.00 -0.02 0.00 0.00 54.58 52.72 1s26 n ASN 450 Cb 0.21 -0.08 -0.02 0.00 -2.36 0.00 0.00 39.78 37.53 1s26 n ASN 450 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1s26 n ASN 451 N 0.27 -3.94 -4.76 0.53 3.02 -0.86 -4.92 115.26 104.61 1s26 n ASN 451 Ca 0.06 0.07 -0.39 0.00 -0.03 0.00 0.00 54.58 54.28 1s26 n ASN 451 Cb 0.27 -2.97 -0.05 0.00 -0.61 0.00 0.00 39.78 36.42 1s26 n ASN 451 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1s26 s GLU 452 N -4.16 4.45 -0.09 3.52 2.02 -1.26 -2.21 118.70 120.97 1s26 s GLU 452 Ca 0.00 1.00 -0.12 0.00 0.02 0.00 0.00 54.97 55.87 1s26 s GLU 452 Cb 0.00 -3.32 -0.05 0.00 0.10 0.00 0.00 34.13 30.86 1s26 s GLU 452 CO 0.00 0.41 0.29 0.08 0.02 0.00 0.00 175.26 176.06 1s26 s VAL 453 N -0.47 5.26 0.29 2.63 1.01 -1.05 -0.17 120.40 127.91 1s26 s VAL 453 Ca 0.36 0.56 0.09 0.00 0.00 0.00 0.00 61.98 62.98 1s26 s VAL 453 Cb -0.21 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 1s26 s VAL 453 CO 0.22 0.52 -0.12 -1.10 0.00 0.00 0.00 175.10 174.62 1s26 s GLN 454 N -0.48 1.64 0.12 2.72 -0.21 0.74 -1.94 119.66 122.25 1s26 s GLN 454 Ca 0.19 -1.80 -0.06 0.00 0.02 0.00 0.00 55.36 53.70 1s26 s GLN 454 Cb -0.14 -1.50 -0.02 0.00 1.00 0.00 0.00 33.01 32.35 1s26 s GLN 454 CO 0.07 0.18 0.16 1.52 -2.12 0.00 0.00 175.29 175.10 1s26 s TYR 455 N -2.73 0.43 0.13 0.91 -0.00 0.43 -1.99 117.35 114.53 1s26 s TYR 455 Ca 0.30 -0.84 -0.22 0.00 -0.00 0.00 0.00 57.07 56.30 1s26 s TYR 455 Cb 0.00 -0.19 0.06 0.00 -0.00 0.00 0.00 41.96 41.83 1s26 s TYR 455 CO 0.14 -0.57 0.55 -1.59 -0.00 0.00 0.00 175.55 174.08 1s26 s LYS 456 N -3.94 1.20 0.68 -3.49 -2.85 -0.78 -1.68 119.74 108.88 1s26 s LYS 456 Ca 0.13 -0.47 -0.11 0.00 -1.00 0.00 0.00 55.97 54.51 1s26 s LYS 456 Cb 0.05 0.55 0.00 0.00 -2.06 0.00 0.00 37.83 36.38 1s26 s LYS 456 CO -0.05 -0.50 1.06 0.95 0.10 0.00 0.00 175.35 176.91 1s26 s THR 457 N -3.54 3.99 0.40 3.79 -4.23 -0.79 -1.62 115.64 113.64 1s26 s THR 457 Ca 0.00 0.68 -0.04 0.00 -1.18 0.00 0.00 61.69 61.16 1s26 s THR 457 Cb -0.00 -3.39 -0.04 0.00 1.34 0.00 0.00 72.50 70.41 1s26 s THR 457 CO -0.11 -0.81 0.68 -0.54 -0.54 0.00 0.00 174.62 173.30 1s26 s LYS 458 N -4.92 3.56 -0.12 3.99 1.02 -0.39 -4.77 119.74 118.11 1s26 s LYS 458 Ca 0.59 0.04 -0.35 0.00 0.02 0.00 0.00 55.97 56.27 1s26 s LYS 458 Cb -0.14 -2.50 -0.12 0.00 -0.52 0.00 0.00 37.83 34.54 1s26 s LYS 458 CO 0.53 -0.02 1.88 -1.91 -0.92 0.00 0.00 175.35 174.91 1s26 n GLU 459 N -1.82 2.02 0.00 1.68 4.07 -1.26 -0.83 120.64 124.50 1s26 n GLU 459 Ca -0.01 0.74 0.00 0.00 -0.06 0.00 0.00 57.16 57.83 1s26 n GLU 459 Cb 0.55 -2.58 0.00 0.00 -0.06 0.00 0.00 31.44 29.35 1s26 n GLU 459 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1s26 n GLY 460 N 4.46 2.96 3.82 8.31 0.00 -1.26 -5.01 105.19 118.48 1s26 n GLY 460 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1s26 n GLY 460 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s26 s LYS 461 N -0.16 4.25 0.15 1.61 -0.14 -0.01 -5.09 119.74 120.35 1s26 s LYS 461 Ca 0.00 1.08 0.08 0.00 -1.36 0.00 0.00 55.97 55.78 1s26 s LYS 461 Cb 0.00 -2.31 -0.04 0.00 -1.68 0.00 0.00 37.83 33.80 1s26 s LYS 461 CO 0.00 0.04 -0.19 -1.50 -0.76 0.00 0.00 175.35 172.95 1s26 s ILE 462 N -2.07 1.79 0.63 2.17 1.10 -1.26 -4.60 121.20 118.96 1s26 s ILE 462 Ca 0.59 -1.85 -0.10 0.00 -0.51 0.00 0.00 60.65 58.78 1s26 s ILE 462 Cb -0.11 -1.79 -0.01 0.00 0.15 0.00 0.00 42.46 40.70 1s26 s ILE 462 CO 0.15 -0.28 1.02 -0.89 -2.11 0.00 0.00 174.94 172.83 1s26 s THR 463 N -1.91 4.18 0.27 4.00 2.01 -0.18 -4.86 115.64 119.15 1s26 s THR 463 Ca 0.14 0.57 -0.01 0.00 0.31 0.00 0.00 61.69 62.71 1s26 s THR 463 Cb -0.06 -3.68 0.27 0.00 0.01 0.00 0.00 72.50 69.03 1s26 s THR 463 CO 0.06 -0.86 1.85 0.58 -0.69 0.00 0.00 174.62 175.56 1s26 h VAL 464 N -0.37 0.99 -0.04 3.82 2.07 -1.93 0.78 116.25 121.56 1s26 h VAL 464 Ca -0.45 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 66.71 1s26 h VAL 464 Cb 1.22 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1s26 h VAL 464 CO 0.62 0.19 0.00 0.18 0.02 0.00 0.00 177.57 178.59 1s26 n LEU 465 N -4.58 0.68 -1.71 2.57 4.77 -1.26 -4.86 117.00 112.61 1s26 n LEU 465 Ca 0.17 -0.34 -0.14 0.00 -0.03 0.00 0.00 56.01 55.67 1s26 n LEU 465 Cb 0.28 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1s26 n LEU 465 CO 0.29 0.15 -0.11 0.61 -1.33 0.00 0.00 177.39 177.00 1s26 n GLY 466 N 0.36 -0.15 3.88 -0.72 0.00 0.27 -5.03 105.19 103.80 1s26 n GLY 466 Ca 0.02 -0.28 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 1s26 n GLY 466 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s26 s GLU 467 N -4.88 2.65 -0.07 1.61 2.02 -1.25 -4.69 118.70 114.09 1s26 s GLU 467 Ca 0.07 -1.40 -0.14 0.00 0.02 0.00 0.00 54.97 53.53 1s26 s GLU 467 Cb -0.03 -2.46 0.03 0.00 0.10 0.00 0.00 34.13 31.77 1s26 s GLU 467 CO 0.09 -0.07 0.33 -1.59 0.02 0.00 0.00 175.26 174.04 1s26 s LYS 468 N -4.09 0.54 -0.09 1.61 -2.85 -1.26 -1.01 119.74 112.59 1s26 s LYS 468 Ca 0.45 0.14 -0.31 0.00 -1.00 0.00 0.00 55.97 55.25 1s26 s LYS 468 Cb -0.05 0.25 0.12 0.00 -2.06 0.00 0.00 37.83 36.09 1s26 s LYS 468 CO 0.28 -0.12 1.03 -0.59 0.10 0.00 0.00 175.35 176.05 1s26 s PHE 469 N -0.58 -0.26 0.31 1.78 -0.12 -1.26 -5.01 117.98 112.84 1s26 s PHE 469 Ca -0.07 0.17 0.01 0.00 -0.05 0.00 0.00 56.93 56.99 1s26 s PHE 469 Cb -0.04 0.52 0.06 0.00 -0.63 0.00 0.00 43.02 42.94 1s26 s PHE 469 CO 0.02 -0.39 0.43 -1.71 -0.05 0.00 0.00 175.22 173.52 1s26 n ASN 470 N -0.13 0.65 -4.52 1.98 5.15 -1.26 -1.88 115.26 115.24 1s26 n ASN 470 Ca -0.05 -1.53 -0.57 0.00 -0.60 0.00 0.00 54.58 51.83 1s26 n ASN 470 Cb 0.60 -0.27 -0.07 0.00 -0.53 0.00 0.00 39.78 39.51 1s26 n ASN 470 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 1s26 n TRP 471 N -1.95 0.88 -3.55 1.20 7.02 -1.26 -4.57 117.44 115.21 1s26 n TRP 471 Ca 0.07 0.94 -0.16 0.00 -1.02 0.00 0.00 57.50 57.34 1s26 n TRP 471 Cb 0.26 -2.16 -0.06 0.00 -2.42 0.00 0.00 31.31 26.93 1s26 n TRP 471 CO 0.00 0.00 0.00 -0.98 -2.02 0.00 0.00 177.69 174.69 1s26 s ARG 472 N 0.13 0.91 0.76 -0.99 1.70 -0.68 -4.94 118.95 115.84 1s26 s ARG 472 Ca 0.89 0.33 -0.15 0.00 -0.47 0.00 0.00 55.73 56.33 1s26 s ARG 472 Cb -1.18 0.43 0.04 0.00 -0.57 0.00 0.00 34.95 33.67 1s26 s ARG 472 CO 0.54 -0.26 1.07 0.09 -1.08 0.00 0.00 175.30 175.66 1s26 n ASN 473 N 1.11 0.73 -4.56 -2.89 4.13 -1.26 -0.43 115.26 112.09 1s26 n ASN 473 Ca -0.16 0.63 -0.39 0.00 1.68 0.00 0.00 54.58 56.34 1s26 n ASN 473 Cb 0.57 -1.45 -0.11 0.00 -1.54 0.00 0.00 39.78 37.25 1s26 n ASN 473 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1s26 s ILE 474 N -1.93 5.28 -0.02 2.41 1.01 -0.82 -4.70 121.20 122.43 1s26 s ILE 474 Ca 0.73 0.02 -0.09 0.00 0.00 0.00 0.00 60.65 61.31 1s26 s ILE 474 Cb -0.32 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 38.45 1s26 s ILE 474 CO 0.50 0.10 0.28 -1.61 0.00 0.00 0.00 174.94 174.22 1s26 s GLU 475 N 1.79 3.64 0.14 2.79 2.02 -1.26 -0.76 118.70 127.06 1s26 s GLU 475 Ca 0.08 0.05 0.10 0.00 0.02 0.00 0.00 54.97 55.21 1s26 s GLU 475 Cb -0.17 -3.13 -0.04 0.00 0.10 0.00 0.00 34.13 30.90 1s26 s GLU 475 CO 0.11 0.68 -0.24 0.14 0.02 0.00 0.00 175.26 175.97 1s26 s VAL 476 N -1.20 2.11 0.18 2.63 -7.23 0.83 -0.65 120.40 117.07 1s26 s VAL 476 Ca 0.24 -1.80 -0.30 0.00 -1.81 0.00 0.00 61.98 58.31 1s26 s VAL 476 Cb -0.14 -1.91 -0.09 0.00 0.56 0.00 0.00 36.38 34.80 1s26 s VAL 476 CO 0.13 -0.04 1.35 -0.04 -0.31 0.00 0.00 175.10 176.19 1s26 s MET 477 N -2.26 4.35 0.11 4.82 1.00 -0.02 -1.31 119.30 125.99 1s26 s MET 477 Ca 0.14 2.09 0.04 0.00 0.00 0.00 0.00 55.69 57.96 1s26 s MET 477 Cb -0.09 -3.20 -0.04 0.00 0.00 0.00 0.00 34.83 31.50 1s26 s MET 477 CO 0.07 -0.33 -0.10 0.00 0.00 0.00 0.00 175.02 174.66 1s26 s ALA 478 N 0.40 1.21 0.21 3.03 0.00 0.09 -2.09 121.76 124.60 1s26 s ALA 478 Ca 0.59 -1.31 0.09 0.00 0.00 0.00 0.00 51.96 51.33 1s26 s ALA 478 Cb -0.37 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 1s26 s ALA 478 CO 0.36 -0.08 -0.05 -1.59 0.00 0.00 0.00 175.76 174.41 1s26 s LYS 479 N -3.24 2.20 -0.12 0.00 -2.85 -0.51 0.23 119.74 115.45 1s26 s LYS 479 Ca 0.10 -1.29 -0.23 0.00 -1.00 0.00 0.00 55.97 53.55 1s26 s LYS 479 Cb -0.00 -2.20 -0.03 0.00 -2.06 0.00 0.00 37.83 33.55 1s26 s LYS 479 CO -0.00 0.41 0.71 1.21 0.10 0.00 0.00 175.35 177.78 1s26 s ASN 480 N -3.14 6.91 -0.22 0.03 3.84 -0.03 -0.93 114.94 121.40 1s26 s ASN 480 Ca 0.28 1.10 -0.03 0.00 0.21 0.00 0.00 52.86 54.43 1s26 s ASN 480 Cb -0.08 -2.41 0.07 0.00 -0.55 0.00 0.00 41.25 38.28 1s26 s ASN 480 CO 0.17 -0.21 0.05 -0.69 -2.79 0.00 0.00 177.10 173.64 1s26 s VAL 481 N 1.34 0.55 -1.35 -5.21 1.01 0.73 -4.82 120.40 112.65 1s26 s VAL 481 Ca 0.36 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.57 1s26 s VAL 481 Cb -0.17 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.08 1s26 s VAL 481 CO 0.15 -0.33 0.83 -0.62 0.00 0.00 0.00 175.10 175.12 1s26 n GLU 482 N 5.03 -5.45 -1.04 2.72 -0.58 -1.26 -1.62 120.64 118.43 1s26 n GLU 482 Ca -0.07 0.66 -0.01 0.00 -0.42 0.00 0.00 57.16 57.31 1s26 n GLU 482 Cb 0.46 -5.37 -0.01 0.00 -0.57 0.00 0.00 31.44 25.95 1s26 n GLU 482 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s26 n GLY 483 N -1.58 0.44 3.10 0.62 0.00 -1.26 -5.01 105.19 101.50 1s26 n GLY 483 Ca -0.21 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.43 1s26 n GLY 483 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s26 s VAL 484 N -1.76 1.28 -0.24 1.61 1.01 -0.64 -5.11 120.40 116.55 1s26 s VAL 484 Ca 0.00 -0.62 -0.29 0.00 0.00 0.00 0.00 61.98 61.07 1s26 s VAL 484 Cb 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1s26 s VAL 484 CO 0.00 0.38 1.13 -0.76 0.00 0.00 0.00 175.10 175.85 1s26 s LEU 485 N 0.16 4.06 -0.10 3.92 1.02 -1.26 -0.19 118.68 126.29 1s26 s LEU 485 Ca -0.06 1.37 0.03 0.00 0.02 0.00 0.00 54.13 55.49 1s26 s LEU 485 Cb -0.12 -3.54 -0.01 0.00 0.02 0.00 0.00 46.19 42.54 1s26 s LEU 485 CO 0.02 -0.78 -0.19 -0.54 0.02 0.00 0.00 176.35 174.88 1s26 s LYS 486 N 3.48 3.04 0.55 1.70 1.02 -0.11 -4.91 119.74 124.52 1s26 s LYS 486 Ca 0.48 -0.79 -0.21 0.00 0.02 0.00 0.00 55.97 55.48 1s26 s LYS 486 Cb -0.16 -2.42 -0.05 0.00 -0.52 0.00 0.00 37.83 34.68 1s26 s LYS 486 CO 0.12 0.27 1.20 -0.35 -0.92 0.00 0.00 175.35 175.67 1s26 n PRO 487 N 3.30 1.39 -4.20 -1.68 -0.04 -1.26 -1.43 135.00 131.08 1s26 n PRO 487 Ca -0.18 0.52 -0.23 0.00 -0.04 0.00 0.00 63.50 63.57 1s26 n PRO 487 Cb 0.53 -2.39 -0.06 0.00 -0.04 0.00 0.00 33.50 31.54 1s26 n PRO 487 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1s26 s LEU 488 N -2.69 3.52 0.00 1.53 1.43 -0.89 -3.80 118.68 117.78 1s26 s LEU 488 Ca 0.72 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 53.45 1s26 s LEU 488 Cb -0.43 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 43.71 1s26 s LEU 488 CO 0.49 -0.01 0.18 1.07 0.23 0.00 0.00 176.35 178.32 1s26 n THR 489 N -0.95 0.00 -1.09 5.49 5.66 -0.47 -3.59 114.28 119.33 1s26 n THR 489 Ca -0.07 -1.49 -0.32 0.00 -3.05 0.00 0.00 64.05 59.12 1s26 n THR 489 Cb 0.58 0.75 0.12 0.00 -1.55 0.00 0.00 70.33 70.23 1s26 n THR 489 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1s26 s ALA 490 N -2.81 1.89 0.14 1.79 0.00 -1.25 -2.50 121.76 119.02 1s26 s ALA 490 Ca 0.24 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.80 1s26 s ALA 490 Cb 0.01 -3.41 -0.00 0.00 0.00 0.00 0.00 23.12 19.72 1s26 s ALA 490 CO 0.17 -2.21 0.00 -0.40 0.00 0.00 0.00 175.76 173.33 1s26 n ASP 491 N -3.55 2.30 -4.65 0.00 3.85 -1.26 -4.53 116.55 108.70 1s26 n ASP 491 Ca 0.12 -1.61 -0.37 0.00 -0.71 0.00 0.00 54.79 52.21 1s26 n ASP 491 Cb 0.52 0.11 -0.10 0.00 -1.35 0.00 0.00 41.12 40.30 1s26 n ASP 491 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1s26 s TYR 492 N -1.54 3.30 -0.32 2.11 2.02 0.53 -4.91 117.35 118.55 1s26 s TYR 492 Ca 0.00 0.20 -0.10 0.00 -0.37 0.00 0.00 57.07 56.81 1s26 s TYR 492 Cb 0.00 -2.28 -0.01 0.00 -0.40 0.00 0.00 41.96 39.28 1s26 s TYR 492 CO 0.00 0.04 0.17 -0.51 -1.57 0.00 0.00 175.55 173.68 1s26 s ASP 493 N 1.12 5.64 0.12 2.29 1.11 -1.26 -4.41 116.67 121.27 1s26 s ASP 493 Ca 0.07 -0.50 -0.31 0.00 0.18 0.00 0.00 52.55 51.99 1s26 s ASP 493 Cb -0.14 -2.03 -0.08 0.00 1.07 0.00 0.00 42.92 41.74 1s26 s ASP 493 CO 0.05 -0.20 1.43 -0.76 1.18 0.00 0.00 175.17 176.87 1s26 s LEU 494 N 1.63 4.37 -0.14 1.23 1.02 -1.26 -1.41 118.68 124.12 1s26 s LEU 494 Ca 0.05 2.39 -0.22 0.00 0.02 0.00 0.00 54.13 56.37 1s26 s LEU 494 Cb -0.17 -3.59 -0.25 0.00 0.02 0.00 0.00 46.19 42.20 1s26 s LEU 494 CO 0.07 -0.69 0.56 0.15 0.02 0.00 0.00 176.35 176.45 1s26 h PHE 495 N 6.81 0.21 -3.24 0.29 3.04 0.73 -0.76 116.94 124.02 1s26 h PHE 495 Ca -0.42 -0.15 -0.01 0.00 3.98 0.00 0.00 57.97 61.36 1s26 h PHE 495 Cb 1.21 -0.01 -0.10 0.00 2.56 0.00 0.00 35.95 39.61 1s26 h PHE 495 CO 0.66 1.36 0.07 0.00 -2.02 0.00 0.00 178.31 178.37 1s26 s ALA 496 N -2.37 -1.06 -0.07 2.41 0.00 -0.82 -2.36 121.76 117.50 1s26 s ALA 496 Ca -0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.61 1s26 s ALA 496 Cb 0.02 0.85 0.03 0.00 0.00 0.00 0.00 23.12 24.02 1s26 s ALA 496 CO 0.70 -0.82 0.00 -0.51 0.00 0.00 0.00 175.76 175.14 1s26 s LEU 497 N -2.86 0.64 -0.40 0.00 1.43 -1.26 -1.18 118.68 115.05 1s26 s LEU 497 Ca 0.08 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 1s26 s LEU 497 Cb -0.01 -0.41 0.11 0.00 0.03 0.00 0.00 46.19 45.91 1s26 s LEU 497 CO -0.04 -0.18 0.13 0.00 0.23 0.00 0.00 176.35 176.49 1s26 s ALA 498 N 1.86 3.05 0.32 4.21 0.00 -0.26 -4.85 121.76 126.09 1s26 s ALA 498 Ca 0.03 -2.76 -0.11 0.00 0.00 0.00 0.00 51.96 49.12 1s26 s ALA 498 Cb -0.12 -2.07 -0.07 0.00 0.00 0.00 0.00 23.12 20.85 1s26 s ALA 498 CO -0.05 -1.80 0.67 -1.25 0.00 0.00 0.00 175.76 173.34 1s26 s PRO 499 N 0.56 3.83 0.41 0.00 0.04 -1.23 0.10 135.00 138.71 1s26 s PRO 499 Ca 0.13 0.42 -0.24 0.00 0.04 0.00 0.00 61.00 61.34 1s26 s PRO 499 Cb -0.21 -2.50 -0.08 0.00 0.04 0.00 0.00 34.50 31.74 1s26 s PRO 499 CO -0.05 0.15 1.11 -1.54 0.04 0.00 0.00 177.00 176.71 1s26 s SER 500 N -2.69 6.58 0.26 6.66 1.04 -0.57 0.86 113.70 125.84 1s26 s SER 500 Ca 0.50 2.20 -0.02 0.00 0.48 0.00 0.00 55.95 59.12 1s26 s SER 500 Cb -0.11 -2.60 0.51 0.00 0.10 0.00 0.00 66.02 63.93 1s26 s SER 500 CO 0.24 -0.62 1.76 -0.07 0.98 0.00 0.00 173.24 175.53 1s26 h LEU 501 N 2.51 0.51 -0.64 2.42 3.38 -1.89 0.12 115.31 121.72 1s26 h LEU 501 Ca -0.49 0.09 0.05 0.00 0.09 0.00 0.00 57.88 57.62 1s26 h LEU 501 Cb 1.23 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.94 1s26 h LEU 501 CO 0.62 0.22 0.37 0.71 0.09 0.00 0.00 178.44 180.45 1s26 h THR 502 N 0.61 1.00 0.00 0.22 1.35 -1.91 0.16 112.91 114.34 1s26 h THR 502 Ca 0.45 -0.24 -0.00 0.00 -0.55 0.00 0.00 66.41 66.07 1s26 h THR 502 Cb 0.63 0.24 -0.00 0.00 -1.73 0.00 0.00 68.15 67.29 1s26 h THR 502 CO -0.36 0.13 -0.02 -0.08 -0.25 0.00 0.00 175.52 174.94 1s26 h GLU 503 N 0.70 0.00 -0.04 4.72 4.57 -1.17 -0.88 114.58 122.48 1s26 h GLU 503 Ca 0.28 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 58.24 1s26 h GLU 503 Cb 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1s26 h GLU 503 CO -0.15 0.02 -0.87 0.82 -1.18 0.00 0.00 179.01 177.64 1s26 h ILE 504 N 0.00 1.37 -0.59 2.32 1.08 0.51 -3.27 117.51 118.93 1s26 h ILE 504 Ca -0.00 -2.29 0.12 0.00 -0.39 0.00 0.00 64.86 62.30 1s26 h ILE 504 Cb 0.04 2.28 -0.11 0.00 -3.07 0.00 0.00 36.82 35.95 1s26 h ILE 504 CO 0.00 0.69 -0.13 0.50 -0.69 0.00 0.00 178.15 178.52 1s26 h LYS 505 N 0.29 0.01 0.00 2.37 1.63 0.39 0.44 116.57 121.70 1s26 h LYS 505 Ca -0.07 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1s26 h LYS 505 Cb 1.49 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.12 1s26 h LYS 505 CO 0.16 0.01 0.15 1.63 -3.45 0.00 0.00 179.45 177.94 1s26 n LYS 506 N -5.40 0.04 0.08 1.90 5.02 -1.18 0.60 118.16 119.22 1s26 n LYS 506 Ca 0.07 0.46 0.12 0.00 -2.02 0.00 0.00 58.31 56.94 1s26 n LYS 506 Cb 0.31 -1.79 0.24 0.00 -0.02 0.00 0.00 35.03 33.78 1s26 n LYS 506 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1s26 n GLN 507 N -1.66 0.29 -3.49 1.97 -0.06 0.16 -4.82 117.38 109.76 1s26 n GLN 507 Ca -0.00 0.13 -0.37 0.00 -2.00 0.00 0.00 57.00 54.76 1s26 n GLN 507 Cb 0.16 -1.73 -0.06 0.00 -4.06 0.00 0.00 30.24 24.55 1s26 n GLN 507 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 1s26 s ILE 508 N -3.15 5.22 0.05 1.69 1.01 0.20 -4.98 121.20 121.24 1s26 s ILE 508 Ca 0.08 0.71 -0.30 0.00 0.00 0.00 0.00 60.65 61.13 1s26 s ILE 508 Cb 0.13 -3.69 -0.08 0.00 0.01 0.00 0.00 42.46 38.83 1s26 s ILE 508 CO 0.68 0.43 1.66 -2.16 0.00 0.00 0.00 174.94 175.56 1s26 s PRO 509 N 0.06 4.19 0.00 2.79 0.04 -1.26 -4.84 135.00 135.98 1s26 s PRO 509 Ca 0.21 2.32 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1s26 s PRO 509 Cb -0.14 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.71 1s26 s PRO 509 CO 0.08 -0.76 0.00 0.94 0.04 0.00 0.00 177.00 177.30 1s26 n GLN 510 N 5.93 0.00 0.00 4.56 -0.06 -1.26 -1.29 117.38 125.27 1s26 n GLN 510 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.16 1s26 n GLN 510 Cb 0.41 -1.32 0.00 0.00 -4.06 0.00 0.00 30.24 25.26 1s26 n GLN 510 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 1s26 n LYS 511 N 0.89 2.87 0.06 3.69 4.81 -1.26 -4.41 118.16 124.81 1s26 n LYS 511 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.29 1s26 n LYS 511 Cb 0.00 -0.95 -0.14 0.00 0.02 0.00 0.00 35.03 33.96 1s26 n LYS 511 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1s26 h GLU 512 N 0.00 0.21 0.00 1.64 5.08 -1.57 0.34 114.58 120.29 1s26 h GLU 512 Ca 0.00 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1s26 h GLU 512 Cb 0.91 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1s26 h GLU 512 CO 0.00 1.07 0.00 1.87 -1.00 0.00 0.00 179.01 180.95 1s26 n TRP 513 N -3.42 0.63 -0.07 4.33 -0.00 -0.99 -3.22 117.44 114.69 1s26 n TRP 513 Ca -0.15 0.22 -0.05 0.00 -0.00 0.00 0.00 57.50 57.52 1s26 n TRP 513 Cb 1.03 -0.85 -0.02 0.00 -0.00 0.00 0.00 31.31 31.47 1s26 n TRP 513 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 177.69 177.25 1s26 h ASP 514 N 0.00 0.00 -0.43 5.87 3.45 -1.65 -2.72 116.42 120.95 1s26 h ASP 514 Ca 0.00 -0.04 0.12 0.00 0.43 0.00 0.00 57.03 57.55 1s26 h ASP 514 Cb 0.48 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.23 1s26 h ASP 514 CO 0.00 0.76 0.78 0.50 -1.57 0.00 0.00 179.24 179.71 1s26 h LYS 515 N -1.00 0.00 0.01 3.56 3.64 -0.37 0.23 116.57 122.64 1s26 h LYS 515 Ca -0.02 0.00 -0.40 0.00 -1.27 0.00 0.00 60.65 58.96 1s26 h LYS 515 Cb 0.48 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.24 1s26 h LYS 515 CO -0.01 0.00 -2.42 0.28 -2.27 0.00 0.00 179.45 175.03 1s26 n VAL 516 N -3.13 1.53 0.23 2.00 0.31 -1.20 -4.35 118.33 113.72 1s26 n VAL 516 Ca 0.09 -0.51 0.07 0.00 -0.01 0.00 0.00 64.34 63.97 1s26 n VAL 516 Cb 0.93 -1.59 0.55 0.00 -0.91 0.00 0.00 33.84 32.82 1s26 n VAL 516 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 1s26 h VAL 517 N -0.29 0.99 -3.57 2.52 3.04 -0.93 -3.33 116.25 114.67 1s26 h VAL 517 Ca -0.59 -0.70 -0.77 0.00 -1.01 0.00 0.00 66.70 63.63 1s26 h VAL 517 Cb 1.82 1.39 -0.26 0.00 -2.01 0.00 0.00 31.29 32.23 1s26 h VAL 517 CO -0.17 0.19 -0.05 0.20 -1.01 0.00 0.00 177.57 176.73 1s26 s ASN 518 N -6.75 6.43 0.20 3.17 0.02 -0.04 -4.99 114.94 112.97 1s26 s ASN 518 Ca -0.03 -2.41 -0.24 0.00 -1.02 0.00 0.00 52.86 49.16 1s26 s ASN 518 Cb 0.15 -2.17 0.05 0.00 0.02 0.00 0.00 41.25 39.30 1s26 s ASN 518 CO 0.67 -0.64 0.89 0.28 0.02 0.00 0.00 177.10 178.32 1s26 s THR 519 N 0.61 0.00 0.00 1.60 -1.32 -1.25 -4.76 115.64 110.52 1s26 s THR 519 Ca 0.13 -0.77 0.00 0.00 -1.21 0.00 0.00 61.69 59.84 1s26 s THR 519 Cb -0.17 -2.04 0.00 0.00 -1.51 0.00 0.00 72.50 68.78 1s26 s THR 519 CO -0.05 0.00 0.00 -0.81 -2.21 0.00 0.00 174.62 171.55 1s26 n PRO 520 N -0.48 0.00 -0.89 7.08 -0.04 -1.26 -4.85 135.00 134.56 1s26 n PRO 520 Ca -0.05 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.16 1s26 n PRO 520 Cb 0.60 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.97 1s26 n PRO 520 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1s26 n ASN 521 N 0.00 0.18 -0.34 3.54 3.02 -1.26 -4.76 115.26 115.64 1s26 n ASN 521 Ca 0.00 0.11 0.11 0.00 -0.03 0.00 0.00 54.58 54.77 1s26 n ASN 521 Cb 0.00 -0.55 0.29 0.00 -0.61 0.00 0.00 39.78 38.91 1s26 n ASN 521 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1s26 h SER 522 N 7.14 0.74 0.47 6.41 4.64 -2.00 0.88 113.55 131.84 1s26 h SER 522 Ca -0.03 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1s26 h SER 522 Cb 0.78 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1s26 h SER 522 CO 0.83 0.29 0.00 -0.11 -0.87 0.00 0.00 176.83 176.97 1s26 n LEU 523 N -4.77 0.47 0.02 5.97 7.94 -1.26 -0.70 117.00 124.66 1s26 n LEU 523 Ca 0.21 0.64 0.11 0.00 -1.11 0.00 0.00 56.01 55.87 1s26 n LEU 523 Cb 0.51 -0.61 -0.07 0.00 0.53 0.00 0.00 43.42 43.77 1s26 n LEU 523 CO 0.22 -0.59 -0.30 1.21 -1.11 0.00 0.00 177.39 176.83 1s26 n GLU 524 N -2.05 0.43 0.01 1.96 4.07 0.29 -3.75 120.64 121.61 1s26 n GLU 524 Ca 0.01 -0.06 -0.09 0.00 -0.06 0.00 0.00 57.16 56.96 1s26 n GLU 524 Cb 0.16 -1.58 -0.07 0.00 -0.06 0.00 0.00 31.44 29.88 1s26 n GLU 524 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1s26 h LYS 525 N 0.00 -0.14 -0.13 5.31 3.64 0.61 -2.90 116.57 122.96 1s26 h LYS 525 Ca 0.00 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1s26 h LYS 525 Cb 0.84 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.62 1s26 h LYS 525 CO 0.00 0.33 -0.53 0.37 -2.27 0.00 0.00 179.45 177.34 1s26 h GLN 526 N -0.92 -0.56 -0.54 1.90 4.15 -1.59 0.25 115.11 117.81 1s26 h GLN 526 Ca -0.01 0.04 0.16 0.00 0.77 0.00 0.00 58.65 59.60 1s26 h GLN 526 Cb 0.53 0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.32 1s26 h GLN 526 CO 0.02 -0.37 0.55 -0.22 -1.93 0.00 0.00 178.83 176.88 1s26 h LYS 527 N -0.58 0.00 0.03 1.69 3.64 -1.68 0.12 116.57 119.78 1s26 h LYS 527 Ca 0.04 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.27 1s26 h LYS 527 Cb 0.68 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.51 1s26 h LYS 527 CO -0.43 0.00 -0.59 0.78 -2.27 0.00 0.00 179.45 176.94 1s26 h GLY 528 N 0.00 0.39 0.97 5.01 0.00 -0.33 -2.93 103.07 106.18 1s26 h GLY 528 Ca 0.26 -0.74 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 1s26 h GLY 528 CO -0.00 0.65 -0.33 -2.08 0.00 0.00 0.00 176.54 174.79 1s26 h VAL 529 N -0.23 0.32 -0.93 4.60 2.07 0.09 -2.75 116.25 119.42 1s26 h VAL 529 Ca -0.08 -0.06 0.27 0.00 0.82 0.00 0.00 66.70 67.65 1s26 h VAL 529 Cb 1.33 0.34 -0.14 0.00 -1.52 0.00 0.00 31.29 31.30 1s26 h VAL 529 CO 0.11 0.01 0.38 0.74 0.02 0.00 0.00 177.57 178.83 1s26 h THR 530 N -0.95 0.32 0.00 2.57 2.02 -1.26 0.39 112.91 116.00 1s26 h THR 530 Ca -0.09 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1s26 h THR 530 Cb 0.71 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1s26 h THR 530 CO 0.15 0.05 0.00 0.78 0.37 0.00 0.00 175.52 176.87 1s26 h ASN 531 N 0.27 0.00 0.17 4.18 2.35 -1.32 -0.38 115.58 120.84 1s26 h ASN 531 Ca 0.63 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 56.12 1s26 h ASN 531 Cb 1.33 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.73 1s26 h ASN 531 CO -0.63 0.00 -1.11 -0.07 -1.65 0.00 0.00 177.43 173.97 1s26 h LEU 532 N 0.00 0.69 0.08 1.61 3.38 -0.01 -1.38 115.31 119.68 1s26 h LEU 532 Ca 0.00 -0.90 0.02 0.00 0.09 0.00 0.00 57.88 57.09 1s26 h LEU 532 Cb 0.71 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 1s26 h LEU 532 CO 0.00 1.53 -0.33 0.25 0.09 0.00 0.00 178.44 179.99 1s26 h LEU 533 N -0.04 -0.95 -1.82 1.67 6.46 -0.90 0.98 115.31 120.70 1s26 h LEU 533 Ca -0.19 0.11 0.01 0.00 -0.12 0.00 0.00 57.88 57.70 1s26 h LEU 533 Cb 1.85 0.37 -0.01 0.00 -0.73 0.00 0.00 40.66 42.14 1s26 h LEU 533 CO 0.21 -0.40 0.14 0.40 -0.62 0.00 0.00 178.44 178.17 1s26 h ILE 534 N -0.53 1.03 0.17 4.05 2.04 -1.13 0.48 117.51 123.62 1s26 h ILE 534 Ca 0.04 -0.08 -0.30 0.00 1.00 0.00 0.00 64.86 65.52 1s26 h ILE 534 Cb 0.58 0.76 0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1s26 h ILE 534 CO -0.22 0.04 -1.31 0.50 0.00 0.00 0.00 178.15 177.16 1s26 h LYS 535 N 0.24 0.46 -0.01 2.37 3.11 0.34 -0.92 116.57 122.16 1s26 h LYS 535 Ca 0.08 -0.71 0.00 0.00 -2.81 0.00 0.00 60.65 57.21 1s26 h LYS 535 Cb 0.03 0.26 0.00 0.00 -1.00 0.00 0.00 32.23 31.51 1s26 h LYS 535 CO -0.02 1.33 -0.36 0.66 -2.81 0.00 0.00 179.45 178.26 1s26 n TYR 536 N -3.67 0.00 0.00 1.91 4.01 0.32 -4.68 117.16 115.04 1s26 n TYR 536 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1s26 n TYR 536 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.06 1s26 n TYR 536 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1s26 n GLY 537 N 1.12 0.00 0.15 2.72 0.00 0.17 -4.75 105.19 104.60 1s26 n GLY 537 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 1s26 n GLY 537 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1s26 n ILE 538 N -1.16 1.48 -1.75 -0.61 5.41 -0.99 -4.99 119.36 116.76 1s26 n ILE 538 Ca 0.00 -0.45 -0.40 0.00 1.00 0.00 0.00 62.75 62.90 1s26 n ILE 538 Cb 0.22 -1.68 0.02 0.00 -0.71 0.00 0.00 39.64 37.48 1s26 n ILE 538 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1s26 n GLU 539 N -3.83 2.17 -4.18 0.38 2.13 -0.35 -4.98 120.64 111.97 1s26 n GLU 539 Ca -0.50 0.77 -0.11 0.00 0.66 0.00 0.00 57.16 57.98 1s26 n GLU 539 Cb 0.92 -2.58 -0.10 0.00 0.27 0.00 0.00 31.44 29.95 1s26 n GLU 539 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1s26 s ARG 540 N -2.41 0.87 0.00 5.31 0.52 -1.26 -4.46 118.95 117.53 1s26 s ARG 540 Ca 0.61 -1.35 -0.08 0.00 -0.52 0.00 0.00 55.73 54.40 1s26 s ARG 540 Cb -0.46 -0.29 0.00 0.00 0.52 0.00 0.00 34.95 34.72 1s26 s ARG 540 CO 0.57 0.00 0.15 0.15 0.02 0.00 0.00 175.30 176.19 1s26 s LYS 541 N -3.79 0.50 0.28 3.54 1.02 -0.24 -4.89 119.74 116.16 1s26 s LYS 541 Ca 0.12 -0.40 -0.29 0.00 0.02 0.00 0.00 55.97 55.42 1s26 s LYS 541 Cb 0.05 0.21 -0.10 0.00 -0.52 0.00 0.00 37.83 37.47 1s26 s LYS 541 CO -0.04 -0.12 1.28 -1.25 -0.92 0.00 0.00 175.35 174.30 1s26 s PRO 542 N -1.43 4.41 0.18 -1.68 0.04 -1.26 -1.99 135.00 133.28 1s26 s PRO 542 Ca -0.14 2.10 0.09 0.00 0.04 0.00 0.00 61.00 63.08 1s26 s PRO 542 Cb -0.07 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 1s26 s PRO 542 CO 0.02 -0.15 -0.08 0.34 0.04 0.00 0.00 177.00 177.16 1s26 s ASP 543 N -0.25 4.31 0.53 6.66 2.15 0.31 -4.94 116.67 125.44 1s26 s ASP 543 Ca 0.51 -0.57 0.24 0.00 0.43 0.00 0.00 52.55 53.16 1s26 s ASP 543 Cb -0.38 -0.75 1.38 0.00 -0.30 0.00 0.00 42.92 42.88 1s26 s ASP 543 CO 0.46 0.10 2.02 0.77 -0.17 0.00 0.00 175.17 178.34 1s26 h SER 544 N 2.83 0.00 0.00 -0.34 4.64 -1.96 -3.30 113.55 115.42 1s26 h SER 544 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1s26 h SER 544 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1s26 h SER 544 CO 0.55 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.86 1s26 n THR 545 N -4.40 0.00 -0.63 2.95 -2.24 -1.26 -4.84 114.28 103.87 1s26 n THR 545 Ca 0.08 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.94 1s26 n THR 545 Cb 0.54 0.38 0.36 0.00 -2.10 0.00 0.00 70.33 69.51 1s26 n THR 545 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1s26 n LYS 546 N 0.00 4.12 0.00 -0.78 5.02 -1.26 -4.62 118.16 120.64 1s26 n LYS 546 Ca 0.00 -2.84 0.00 0.00 -2.02 0.00 0.00 58.31 53.45 1s26 n LYS 546 Cb 0.00 -2.04 0.00 0.00 -0.02 0.00 0.00 35.03 32.97 1s26 n LYS 546 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s26 n GLY 547 N 0.87 1.01 3.67 0.72 0.00 -1.24 -0.79 105.19 109.42 1s26 n GLY 547 Ca 0.25 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1s26 n GLY 547 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s26 s THR 548 N 0.00 5.04 0.23 2.61 2.01 -1.26 -0.53 115.64 123.73 1s26 s THR 548 Ca 0.00 1.22 -0.17 0.00 0.31 0.00 0.00 61.69 63.05 1s26 s THR 548 Cb 0.00 -3.95 0.02 0.00 0.01 0.00 0.00 72.50 68.58 1s26 s THR 548 CO 0.00 0.15 0.56 -1.48 -0.69 0.00 0.00 174.62 173.16 1s26 s LEU 549 N 1.63 0.06 0.00 4.42 0.05 -0.84 -4.50 118.68 119.49 1s26 s LEU 549 Ca 0.30 -0.62 -0.02 0.00 0.05 0.00 0.00 54.13 53.84 1s26 s LEU 549 Cb -0.16 2.19 0.15 0.00 -2.05 0.00 0.00 46.19 46.31 1s26 s LEU 549 CO 0.11 -1.14 1.00 -1.54 -0.55 0.00 0.00 176.35 174.23 1s26 n SER 550 N -0.38 1.17 0.10 1.48 3.41 -1.26 -1.08 113.62 117.07 1s26 n SER 550 Ca -0.07 -2.03 -0.19 0.00 -0.26 0.00 0.00 58.87 56.32 1s26 n SER 550 Cb 0.62 -0.66 -0.15 0.00 -0.26 0.00 0.00 64.21 63.76 1s26 n SER 550 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1s26 h ASN 551 N -0.69 0.53 -0.37 4.04 2.35 -1.92 -2.79 115.58 116.73 1s26 h ASN 551 Ca -0.33 -0.64 -0.04 0.00 -0.55 0.00 0.00 56.30 54.74 1s26 h ASN 551 Cb 1.17 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 39.35 1s26 h ASN 551 CO 0.34 1.51 0.09 4.11 -1.65 0.00 0.00 177.43 181.83 1s26 h TRP 552 N 0.09 0.69 -0.62 1.19 5.08 -1.96 -2.01 115.95 118.41 1s26 h TRP 552 Ca -0.22 -0.06 -0.01 0.00 1.08 0.00 0.00 58.89 59.68 1s26 h TRP 552 Cb 2.05 -0.20 -0.03 0.00 -3.00 0.00 0.00 29.16 27.97 1s26 h TRP 552 CO 0.08 0.60 0.34 1.96 -1.28 0.00 0.00 178.44 180.15 1s26 h GLN 553 N 0.65 0.85 -0.64 0.12 4.20 -1.96 0.14 115.11 118.48 1s26 h GLN 553 Ca 0.15 -0.08 -0.07 0.00 0.06 0.00 0.00 58.65 58.70 1s26 h GLN 553 Cb 0.27 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 1s26 h GLN 553 CO -0.00 0.62 0.11 0.87 -0.67 0.00 0.00 178.83 179.76 1s26 h LYS 554 N 0.86 1.04 -0.07 1.46 1.57 -1.09 0.43 116.57 120.77 1s26 h LYS 554 Ca 0.22 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1s26 h LYS 554 Cb 0.01 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1s26 h LYS 554 CO -0.04 0.95 0.00 1.96 -0.57 0.00 0.00 179.45 181.76 1s26 h GLN 555 N 0.98 0.13 -0.92 3.15 4.20 -0.87 -1.40 115.11 120.38 1s26 h GLN 555 Ca 0.20 -0.04 0.09 0.00 0.06 0.00 0.00 58.65 58.95 1s26 h GLN 555 Cb 0.42 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.11 1s26 h GLN 555 CO 0.01 0.38 0.57 1.98 -0.67 0.00 0.00 178.83 181.10 1s26 h MET 556 N -0.15 0.94 0.54 1.46 4.05 -0.84 0.18 114.93 121.12 1s26 h MET 556 Ca 0.02 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.37 1s26 h MET 556 Cb 0.32 -0.21 -0.02 0.00 -0.80 0.00 0.00 31.60 30.90 1s26 h MET 556 CO 0.00 0.62 -0.44 -0.07 0.23 0.00 0.00 176.91 177.26 1s26 h LEU 557 N 0.97 -1.17 -0.73 3.39 4.07 -0.62 -0.90 115.31 120.33 1s26 h LEU 557 Ca 0.42 0.09 0.12 0.00 0.08 0.00 0.00 57.88 58.59 1s26 h LEU 557 Cb 0.30 0.37 -0.08 0.00 1.08 0.00 0.00 40.66 42.33 1s26 h LEU 557 CO -0.22 -0.63 0.32 0.44 -1.08 0.00 0.00 178.44 177.27 1s26 h ASP 558 N -0.97 0.36 -0.14 -0.43 3.32 -0.36 -0.30 116.42 117.91 1s26 h ASP 558 Ca -0.06 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 1s26 h ASP 558 Cb 0.82 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 1s26 h ASP 558 CO -0.01 0.17 0.09 0.03 -1.72 0.00 0.00 179.24 177.80 1s26 h ARG 559 N 0.51 0.19 -0.45 3.56 2.47 -0.46 -0.98 114.38 119.22 1s26 h ARG 559 Ca 0.38 -0.02 0.05 0.00 -1.26 0.00 0.00 59.98 59.13 1s26 h ARG 559 Cb 0.50 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.74 1s26 h ARG 559 CO -0.34 0.16 0.20 -0.07 0.56 0.00 0.00 179.97 180.48 1s26 h LEU 560 N 0.16 0.26 -1.13 3.04 3.38 -0.10 0.24 115.31 121.16 1s26 h LEU 560 Ca 0.05 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 1s26 h LEU 560 Cb 0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1s26 h LEU 560 CO -0.01 0.19 -0.18 0.78 0.09 0.00 0.00 178.44 179.31 1s26 h ASN 561 N 0.40 0.39 -0.35 -0.43 2.35 -0.91 -2.70 115.58 114.33 1s26 h ASN 561 Ca 0.20 -0.11 -0.10 0.00 -0.55 0.00 0.00 56.30 55.75 1s26 h ASN 561 Cb 0.15 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1s26 h ASN 561 CO -0.17 0.59 -0.16 -0.33 -1.65 0.00 0.00 177.43 175.70 1s26 h GLU 562 N 0.37 0.73 -0.95 0.81 5.08 -0.03 -2.71 114.58 117.88 1s26 h GLU 562 Ca 0.07 -0.32 0.13 0.00 -1.00 0.00 0.00 59.36 58.23 1s26 h GLU 562 Cb 0.53 -0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 1s26 h GLU 562 CO 0.03 0.93 0.57 0.00 -1.00 0.00 0.00 179.01 179.54 1s26 h ALA 563 N 0.79 1.43 0.00 3.43 0.00 -0.26 -0.74 119.26 123.91 1s26 h ALA 563 Ca 0.08 0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 1s26 h ALA 563 Cb 0.70 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1s26 h ALA 563 CO 0.05 0.13 -0.76 -0.39 0.00 0.00 0.00 179.25 178.28 1s26 h VAL 564 N 0.88 1.39 -0.27 0.00 -1.51 -1.44 -2.95 116.25 112.35 1s26 h VAL 564 Ca 0.48 -2.74 -0.07 0.00 -1.23 0.00 0.00 66.70 63.15 1s26 h VAL 564 Cb 0.53 2.54 -0.02 0.00 -2.13 0.00 0.00 31.29 32.21 1s26 h VAL 564 CO -0.29 0.74 -0.12 0.11 -1.23 0.00 0.00 177.57 176.79 1s26 h LYS 565 N 0.00 0.45 0.00 5.19 1.57 -0.91 -0.77 116.57 122.09 1s26 h LYS 565 Ca -0.01 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1s26 h LYS 565 Cb 1.48 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1s26 h LYS 565 CO 0.10 0.57 0.00 0.66 -0.57 0.00 0.00 179.45 180.21 1s26 n TYR 566 N -4.22 0.00 0.16 -1.35 0.53 -0.40 -1.52 117.16 110.36 1s26 n TYR 566 Ca 0.00 0.00 0.02 0.00 -1.02 0.00 0.00 57.90 56.90 1s26 n TYR 566 Cb 0.31 0.00 -0.01 0.00 -1.03 0.00 0.00 39.34 38.61 1s26 n TYR 566 CO 0.00 0.00 0.00 0.25 -1.02 0.00 0.00 176.86 176.09 1s26 n THR 567 N -0.90 0.00 0.00 -0.72 -2.24 -0.33 -5.01 114.28 105.08 1s26 n THR 567 Ca 0.11 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1s26 n THR 567 Cb 0.05 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 1s26 n THR 567 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s26 n GLY 568 N 0.75 1.73 3.55 3.38 0.00 -0.58 -5.07 105.19 108.95 1s26 n GLY 568 Ca 0.01 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.52 1s26 n GLY 568 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1s26 n TYR 569 N -0.31 1.84 0.96 1.61 9.36 -0.99 -4.86 117.16 124.77 1s26 n TYR 569 Ca 0.00 0.26 0.12 0.00 3.32 0.00 0.00 57.90 61.60 1s26 n TYR 569 Cb 0.00 -2.55 0.25 0.00 -0.63 0.00 0.00 39.34 36.41 1s26 n TYR 569 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1s26 n THR 570 N 6.33 0.15 0.88 2.97 -2.24 -1.26 -4.49 114.28 116.62 1s26 n THR 570 Ca 0.34 -0.49 0.13 0.00 -2.27 0.00 0.00 64.05 61.76 1s26 n THR 570 Cb 0.23 1.03 0.43 0.00 -2.10 0.00 0.00 70.33 69.92 1s26 n THR 570 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s26 n GLY 571 N 1.33 -1.46 0.00 3.38 0.00 -1.22 -5.03 105.19 102.20 1s26 n GLY 571 Ca 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1s26 n GLY 571 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s26 n GLY 572 N 1.45 0.15 3.87 -0.02 0.00 -1.26 -4.50 105.19 104.87 1s26 n GLY 572 Ca 0.06 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 1s26 n GLY 572 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s26 s ASP 573 N -4.00 6.25 0.00 1.61 1.01 -1.26 -4.94 116.67 115.34 1s26 s ASP 573 Ca 0.00 1.40 0.00 0.00 0.71 0.00 0.00 52.55 54.66 1s26 s ASP 573 Cb 0.00 -2.46 0.00 0.00 1.01 0.00 0.00 42.92 41.47 1s26 s ASP 573 CO 0.00 -0.84 0.00 0.52 0.21 0.00 0.00 175.17 175.06 1s26 n VAL 574 N -2.66 0.00 -4.00 -1.27 0.31 -1.26 -4.30 118.33 105.15 1s26 n VAL 574 Ca 0.06 -0.12 -0.31 0.00 -0.01 0.00 0.00 64.34 63.96 1s26 n VAL 574 Cb 0.54 0.61 -0.16 0.00 -0.91 0.00 0.00 33.84 33.92 1s26 n VAL 574 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1s26 s VAL 575 N -1.64 1.69 -1.22 2.52 1.01 -1.26 -0.35 120.40 121.15 1s26 s VAL 575 Ca 0.00 -1.08 0.13 0.00 0.00 0.00 0.00 61.98 61.03 1s26 s VAL 575 Cb 0.00 -1.78 0.35 0.00 0.00 0.00 0.00 36.38 34.95 1s26 s VAL 575 CO 0.00 0.13 1.27 0.59 0.00 0.00 0.00 175.10 177.10 1s26 n ASN 576 N 4.66 3.04 -3.66 3.32 3.02 -1.26 -4.93 115.26 119.44 1s26 n ASN 576 Ca -0.14 -1.95 0.01 0.00 -0.03 0.00 0.00 54.58 52.46 1s26 n ASN 576 Cb 0.46 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1s26 n ASN 576 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 1s26 s HIS 577 N -1.02 -0.02 1.24 3.10 -3.43 -1.26 -4.49 115.29 109.41 1s26 s HIS 577 Ca 0.27 -0.13 -0.18 0.00 -0.80 0.00 0.00 55.06 54.22 1s26 s HIS 577 Cb 0.15 0.57 0.28 0.00 -1.43 0.00 0.00 32.58 32.14 1s26 s HIS 577 CO 0.19 -0.37 0.62 0.41 -2.00 0.00 0.00 174.74 173.59 1s26 n GLY 578 N -0.62 -3.13 3.85 -1.38 0.00 0.03 -4.75 105.19 99.20 1s26 n GLY 578 Ca -0.05 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.43 1s26 n GLY 578 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s26 s THR 579 N -2.11 2.52 0.29 2.61 -4.23 -1.26 -4.61 115.64 108.85 1s26 s THR 579 Ca 0.52 0.17 0.37 0.00 -1.18 0.00 0.00 61.69 61.57 1s26 s THR 579 Cb -0.10 -3.06 0.40 0.00 1.34 0.00 0.00 72.50 71.09 1s26 s THR 579 CO 0.46 -0.22 2.12 -0.08 -0.54 0.00 0.00 174.62 176.35 1s26 h GLU 580 N -1.09 0.00 0.00 3.99 4.57 -0.74 -2.87 114.58 118.45 1s26 h GLU 580 Ca -0.47 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 1s26 h GLU 580 Cb 1.30 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1s26 h GLU 580 CO 0.63 0.00 0.00 1.04 -1.18 0.00 0.00 179.01 179.50 1s26 n GLN 581 N -3.02 0.00 -0.16 1.92 1.13 -1.21 -1.80 117.38 114.24 1s26 n GLN 581 Ca -0.01 0.22 0.05 0.00 -1.94 0.00 0.00 57.00 55.32 1s26 n GLN 581 Cb 0.20 -1.50 0.13 0.00 0.11 0.00 0.00 30.24 29.18 1s26 n GLN 581 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1s26 n ASP 582 N -1.50 2.79 -4.28 1.08 8.00 -1.08 -3.72 116.55 117.84 1s26 n ASP 582 Ca 0.04 -2.24 -0.44 0.00 0.71 0.00 0.00 54.79 52.86 1s26 n ASP 582 Cb 0.19 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 1s26 n ASP 582 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1s26 n ASN 583 N -0.05 5.43 0.12 -2.24 5.15 -0.74 -4.76 115.26 118.17 1s26 n ASN 583 Ca 0.10 -3.07 0.05 0.00 -0.60 0.00 0.00 54.58 51.07 1s26 n ASN 583 Cb 0.47 -1.47 0.02 0.00 -0.53 0.00 0.00 39.78 38.27 1s26 n ASN 583 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1s26 h GLU 584 N 6.58 0.00 0.15 1.20 5.08 -1.84 -3.24 114.58 122.51 1s26 h GLU 584 Ca 0.28 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.36 1s26 h GLU 584 Cb 0.80 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.06 1s26 h GLU 584 CO 1.25 0.27 -1.34 0.93 -1.00 0.00 0.00 179.01 179.11 1s26 h GLU 585 N 0.00 0.31 -1.87 2.33 5.08 -1.98 -3.40 114.58 115.05 1s26 h GLU 585 Ca -0.04 -0.53 -0.53 0.00 -1.00 0.00 0.00 59.36 57.25 1s26 h GLU 585 Cb 1.30 0.20 -0.41 0.00 0.50 0.00 0.00 28.75 30.34 1s26 h GLU 585 CO 0.04 1.25 -0.89 1.19 -1.00 0.00 0.00 179.01 179.60 1s26 n PHE 586 N -3.90 2.49 -1.71 4.33 3.01 -1.26 -0.85 117.46 119.57 1s26 n PHE 586 Ca -0.22 -3.60 -0.42 0.00 1.01 0.00 0.00 57.45 54.22 1s26 n PHE 586 Cb 0.93 -0.37 -0.00 0.00 -0.01 0.00 0.00 39.48 40.03 1s26 n PHE 586 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1s26 n PRO 587 N -0.13 2.16 -4.12 -1.08 -0.04 -1.22 -4.96 135.00 125.60 1s26 n PRO 587 Ca 0.28 0.76 -0.29 0.00 -0.04 0.00 0.00 63.50 64.21 1s26 n PRO 587 Cb 0.58 -2.36 -0.07 0.00 -0.04 0.00 0.00 33.50 31.60 1s26 n PRO 587 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1s26 s GLU 588 N -1.93 2.64 -0.25 0.54 0.41 -1.26 -4.90 118.70 113.95 1s26 s GLU 588 Ca 0.56 -0.87 0.00 0.00 -0.41 0.00 0.00 54.97 54.25 1s26 s GLU 588 Cb -0.55 -2.56 0.07 0.00 -1.78 0.00 0.00 34.13 29.31 1s26 s GLU 588 CO 0.62 0.52 0.00 0.21 -0.49 0.00 0.00 175.26 176.12 1s26 s LYS 589 N -2.58 1.24 -0.04 1.61 2.20 -1.26 -5.12 119.74 115.79 1s26 s LYS 589 Ca 0.28 -0.97 -0.07 0.00 -0.36 0.00 0.00 55.97 54.85 1s26 s LYS 589 Cb -0.11 -2.43 -0.04 0.00 -1.51 0.00 0.00 37.83 33.73 1s26 s LYS 589 CO 0.20 -0.71 0.22 -0.51 -0.36 0.00 0.00 175.35 174.19 1s26 s ASP 590 N 1.49 6.47 0.14 1.43 1.01 -1.26 -5.00 116.67 120.95 1s26 s ASP 590 Ca -0.00 0.54 -0.12 0.00 0.71 0.00 0.00 52.55 53.68 1s26 s ASP 590 Cb -0.18 -2.09 -0.02 0.00 1.01 0.00 0.00 42.92 41.64 1s26 s ASP 590 CO -0.10 0.32 1.52 0.78 0.21 0.00 0.00 175.17 177.90 1s26 h ASN 591 N 4.39 0.94 -3.27 0.27 2.35 -1.96 -3.39 115.58 114.91 1s26 h ASN 591 Ca -0.52 -0.40 -0.67 0.00 -0.55 0.00 0.00 56.30 54.16 1s26 h ASN 591 Cb 1.21 -0.26 -0.31 0.00 0.05 0.00 0.00 38.32 39.01 1s26 h ASN 591 CO 0.63 1.13 -0.81 -1.61 -1.65 0.00 0.00 177.43 175.12 1s26 s GLU 592 N -4.64 3.19 -0.13 0.81 2.02 -1.26 -2.41 118.70 116.28 1s26 s GLU 592 Ca -0.12 -0.76 -0.02 0.00 0.02 0.00 0.00 54.97 54.09 1s26 s GLU 592 Cb 0.11 -2.61 -0.03 0.00 0.10 0.00 0.00 34.13 31.70 1s26 s GLU 592 CO 0.86 0.00 -0.05 0.42 0.02 0.00 0.00 175.26 176.51 1s26 s ILE 593 N 0.84 3.78 -0.26 -1.63 -1.09 -1.24 -3.97 121.20 117.63 1s26 s ILE 593 Ca -0.05 -0.41 -0.16 0.00 -2.23 0.00 0.00 60.65 57.80 1s26 s ILE 593 Cb -0.15 -2.62 -0.03 0.00 -1.58 0.00 0.00 42.46 38.07 1s26 s ILE 593 CO -0.01 0.52 0.44 0.12 -1.23 0.00 0.00 174.94 174.78 1s26 s PHE 594 N 0.06 3.27 -0.03 3.97 5.36 -0.70 -1.55 117.98 128.36 1s26 s PHE 594 Ca -0.01 0.53 0.05 0.00 -0.96 0.00 0.00 56.93 56.54 1s26 s PHE 594 Cb -0.14 -2.63 -0.03 0.00 -0.34 0.00 0.00 43.02 39.89 1s26 s PHE 594 CO 0.03 -0.23 -0.17 0.42 -1.46 0.00 0.00 175.22 173.82 1s26 s ILE 595 N 2.09 2.87 -0.25 3.12 1.01 0.15 0.25 121.20 130.45 1s26 s ILE 595 Ca 0.18 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.00 1s26 s ILE 595 Cb -0.16 -2.12 0.06 0.00 0.01 0.00 0.00 42.46 40.25 1s26 s ILE 595 CO 0.09 0.55 -0.09 -0.63 0.00 0.00 0.00 174.94 174.86 1s26 s ILE 596 N -0.75 1.97 0.71 2.92 1.01 -0.20 -0.55 121.20 126.30 1s26 s ILE 596 Ca 0.12 -1.53 -0.11 0.00 0.00 0.00 0.00 60.65 59.14 1s26 s ILE 596 Cb -0.10 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.25 1s26 s ILE 596 CO 0.01 -0.07 1.08 0.54 0.00 0.00 0.00 174.94 176.50 1s26 s ASN 597 N 1.19 5.30 0.25 3.58 2.20 -0.97 -1.52 114.94 124.97 1s26 s ASN 597 Ca -0.08 0.99 0.13 0.00 -0.94 0.00 0.00 52.86 52.96 1s26 s ASN 597 Cb -0.20 -1.76 0.72 0.00 -2.00 0.00 0.00 41.25 38.01 1s26 s ASN 597 CO -0.06 -1.40 1.33 -0.81 -2.94 0.00 0.00 177.10 173.23 1s26 n PRO 598 N -2.99 0.09 -0.14 3.55 -0.04 -1.26 0.24 135.00 134.45 1s26 n PRO 598 Ca 0.07 0.55 0.11 0.00 -0.04 0.00 0.00 63.50 64.19 1s26 n PRO 598 Cb 0.58 -1.95 0.29 0.00 -0.04 0.00 0.00 33.50 32.38 1s26 n PRO 598 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1s26 n GLU 599 N -1.98 2.07 -1.08 0.54 4.71 -1.26 -3.24 120.64 120.40 1s26 n GLU 599 Ca -0.01 -1.62 -0.03 0.00 -0.01 0.00 0.00 57.16 55.49 1s26 n GLU 599 Cb 0.18 -1.43 -0.01 0.00 -1.01 0.00 0.00 31.44 29.16 1s26 n GLU 599 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1s26 n GLY 600 N 1.29 0.59 3.92 0.62 0.00 0.14 -4.98 105.19 106.76 1s26 n GLY 600 Ca 0.17 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 45.00 1s26 n GLY 600 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s26 s GLU 601 N -2.16 3.58 -0.22 1.61 2.02 -1.25 -4.88 118.70 117.40 1s26 s GLU 601 Ca 0.00 -0.13 -0.08 0.00 0.02 0.00 0.00 54.97 54.78 1s26 s GLU 601 Cb 0.00 -2.68 -0.04 0.00 0.10 0.00 0.00 34.13 31.51 1s26 s GLU 601 CO 0.00 0.23 0.09 -0.06 0.02 0.00 0.00 175.26 175.53 1s26 s PHE 602 N -2.11 3.18 0.09 1.61 2.99 -1.26 -2.28 117.98 120.20 1s26 s PHE 602 Ca 0.42 -0.10 0.06 0.00 0.00 0.00 0.00 56.93 57.31 1s26 s PHE 602 Cb -0.10 -2.19 -0.03 0.00 0.00 0.00 0.00 43.02 40.69 1s26 s PHE 602 CO 0.31 -0.09 -0.16 0.42 -0.00 0.00 0.00 175.22 175.71 1s26 s ILE 603 N 1.06 1.32 -0.13 0.64 -1.09 0.28 -1.24 121.20 122.04 1s26 s ILE 603 Ca 0.05 -1.45 -0.04 0.00 -2.23 0.00 0.00 60.65 56.98 1s26 s ILE 603 Cb -0.14 -1.29 0.06 0.00 -1.58 0.00 0.00 42.46 39.52 1s26 s ILE 603 CO 0.03 -0.22 0.21 -0.22 -1.23 0.00 0.00 174.94 173.52 1s26 s LEU 604 N -1.92 -0.17 0.57 2.97 0.20 -1.05 0.35 118.68 119.63 1s26 s LEU 604 Ca 0.02 0.31 -0.15 0.00 0.69 0.00 0.00 54.13 55.00 1s26 s LEU 604 Cb -0.09 0.46 -0.05 0.00 -0.43 0.00 0.00 46.19 46.08 1s26 s LEU 604 CO 0.03 -0.26 1.02 0.42 -0.29 0.00 0.00 176.35 177.26 1s26 s THR 605 N 2.35 4.38 -0.13 3.68 -4.23 -0.60 -1.66 115.64 119.43 1s26 s THR 605 Ca 0.03 1.02 0.00 0.00 -1.18 0.00 0.00 61.69 61.57 1s26 s THR 605 Cb -0.13 -3.65 -0.24 0.00 1.34 0.00 0.00 72.50 69.82 1s26 s THR 605 CO -0.08 -0.76 0.31 0.29 -0.54 0.00 0.00 174.62 173.83 1s26 n LYS 606 N -2.06 0.71 -3.80 3.99 4.76 -1.26 -3.69 118.16 116.81 1s26 n LYS 606 Ca 0.07 0.23 -0.10 0.00 -2.87 0.00 0.00 58.31 55.64 1s26 n LYS 606 Cb 0.54 -1.68 -0.07 0.00 -1.84 0.00 0.00 35.03 31.97 1s26 n LYS 606 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1s26 s ASN 607 N -6.67 -0.01 0.27 4.39 4.22 -1.01 -4.19 114.94 111.92 1s26 s ASN 607 Ca -0.20 -0.37 -0.04 0.00 -2.14 0.00 0.00 52.86 50.10 1s26 s ASN 607 Cb 0.07 0.34 0.53 0.00 1.28 0.00 0.00 41.25 43.47 1s26 s ASN 607 CO 0.76 -0.64 1.44 1.87 -2.04 0.00 0.00 177.10 178.49 1s26 n TRP 608 N 0.41 0.43 -0.15 1.54 -0.00 -1.20 0.11 117.44 118.57 1s26 n TRP 608 Ca -0.18 1.12 -0.06 0.00 -0.00 0.00 0.00 57.50 58.39 1s26 n TRP 608 Cb 0.60 -1.09 0.03 0.00 -0.00 0.00 0.00 31.31 30.85 1s26 n TRP 608 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 1s26 h GLU 609 N 0.00 0.49 -0.31 5.87 3.07 -1.96 -1.08 114.58 120.67 1s26 h GLU 609 Ca 0.49 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 59.28 1s26 h GLU 609 Cb 0.85 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.63 1s26 h GLU 609 CO -0.92 0.33 0.04 1.98 -1.40 0.00 0.00 179.01 179.03 1s26 h MET 610 N 0.51 0.46 -0.17 2.33 4.05 0.37 -0.78 114.93 121.70 1s26 h MET 610 Ca 0.19 -0.08 -0.07 0.00 -0.28 0.00 0.00 59.70 59.46 1s26 h MET 610 Cb 0.05 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.77 1s26 h MET 610 CO -0.11 0.46 -0.20 1.15 0.23 0.00 0.00 176.91 178.44 1s26 h THR 611 N 0.45 1.22 -0.11 -0.77 2.02 -0.12 -1.22 112.91 114.38 1s26 h THR 611 Ca 0.10 -1.02 -0.20 0.00 0.77 0.00 0.00 66.41 66.06 1s26 h THR 611 Cb 0.24 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 1s26 h THR 611 CO 0.00 0.32 -0.76 1.23 0.37 0.00 0.00 175.52 176.68 1s26 h GLY 612 N 0.91 0.62 0.81 2.16 0.00 -0.00 -2.65 103.07 104.92 1s26 h GLY 612 Ca 0.05 -0.89 -0.02 0.00 0.00 0.00 0.00 47.33 46.47 1s26 h GLY 612 CO 0.03 0.79 0.02 3.21 0.00 0.00 0.00 176.54 180.60 1s26 h ARG 613 N 0.38 0.23 0.25 4.80 3.08 -0.80 -1.66 114.38 120.67 1s26 h ARG 613 Ca -0.04 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1s26 h ARG 613 Cb 1.36 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.37 1s26 h ARG 613 CO 0.14 0.41 -0.25 0.35 -1.07 0.00 0.00 179.97 179.55 1s26 h PHE 614 N 0.01 -0.70 -1.01 3.04 3.57 -1.26 0.35 116.94 120.94 1s26 h PHE 614 Ca 0.04 0.00 0.28 0.00 3.53 0.00 0.00 57.97 61.82 1s26 h PHE 614 Cb 0.29 0.27 -0.13 0.00 2.79 0.00 0.00 35.95 39.17 1s26 h PHE 614 CO 0.02 -0.34 0.60 0.82 -2.23 0.00 0.00 178.31 177.18 1s26 h ILE 615 N -0.50 0.45 -0.02 1.41 2.04 -1.53 0.53 117.51 119.89 1s26 h ILE 615 Ca -0.03 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1s26 h ILE 615 Cb 0.44 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.45 1s26 h ILE 615 CO -0.03 0.09 0.00 -0.08 0.00 0.00 0.00 178.15 178.13 1s26 h GLU 616 N 0.47 0.03 0.00 2.37 4.81 -0.78 -0.10 114.58 121.38 1s26 h GLU 616 Ca 0.68 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.83 1s26 h GLU 616 Cb 1.43 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.80 1s26 h GLU 616 CO -0.51 0.30 -0.31 -0.22 -0.73 0.00 0.00 179.01 177.54 1s26 h LYS 617 N -0.24 0.00 0.00 1.92 3.11 0.33 -2.96 116.57 118.74 1s26 h LYS 617 Ca 0.01 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1s26 h LYS 617 Cb 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 1s26 h LYS 617 CO 0.00 0.31 -0.09 0.09 -2.81 0.00 0.00 179.45 176.95 1s26 n ASN 618 N -3.25 0.12 0.00 4.20 4.13 0.05 -4.80 115.26 115.72 1s26 n ASN 618 Ca 0.02 -0.54 0.00 0.00 1.68 0.00 0.00 54.58 55.74 1s26 n ASN 618 Cb 0.60 1.00 0.00 0.00 -1.54 0.00 0.00 39.78 39.84 1s26 n ASN 618 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1s26 n ILE 619 N -1.05 0.00 0.00 2.41 5.41 -0.27 -4.62 119.36 121.24 1s26 n ILE 619 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1s26 n ILE 619 Cb 0.03 -0.62 0.00 0.00 -0.71 0.00 0.00 39.64 38.34 1s26 n ILE 619 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 1s26 n THR 620 N -1.81 1.59 -2.29 1.39 5.66 -0.21 -1.03 114.28 117.58 1s26 n THR 620 Ca 0.00 0.40 -0.05 0.00 -3.05 0.00 0.00 64.05 61.35 1s26 n THR 620 Cb 0.00 -1.40 0.07 0.00 -1.55 0.00 0.00 70.33 67.45 1s26 n THR 620 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1s26 n GLY 621 N -1.40 3.65 2.71 1.09 0.00 -1.12 -4.81 105.19 105.31 1s26 n GLY 621 Ca 0.00 -1.54 -0.03 0.00 0.00 0.00 0.00 46.02 44.45 1s26 n GLY 621 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1s26 n LYS 622 N -0.51 1.40 -3.50 1.61 3.00 -0.20 -4.87 118.16 115.09 1s26 n LYS 622 Ca 0.20 -1.87 -0.21 0.00 -0.00 0.00 0.00 58.31 56.43 1s26 n LYS 622 Cb 0.90 -0.14 0.06 0.00 0.00 0.00 0.00 35.03 35.85 1s26 n LYS 622 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1s26 n ASP 623 N -1.13 -4.40 -3.97 3.14 8.00 -1.25 -4.87 116.55 112.07 1s26 n ASP 623 Ca -0.09 -0.81 -0.12 0.00 0.71 0.00 0.00 54.79 54.47 1s26 n ASP 623 Cb 0.86 -4.41 -0.13 0.00 -0.02 0.00 0.00 41.12 37.42 1s26 n ASP 623 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1s26 s TYR 624 N -3.48 0.34 0.04 1.24 1.51 -1.24 -3.57 117.35 112.19 1s26 s TYR 624 Ca 0.30 -0.27 -0.30 0.00 -1.01 0.00 0.00 57.07 55.78 1s26 s TYR 624 Cb -0.07 -0.22 -0.05 0.00 -0.11 0.00 0.00 41.96 41.51 1s26 s TYR 624 CO 0.79 -0.07 1.18 -1.17 -1.11 0.00 0.00 175.55 175.17 1s26 s LEU 625 N -0.77 4.36 -0.07 -1.29 2.96 0.25 -4.71 118.68 119.41 1s26 s LEU 625 Ca -0.06 1.96 -0.26 0.00 -0.22 0.00 0.00 54.13 55.55 1s26 s LEU 625 Cb -0.05 -3.57 0.06 0.00 0.50 0.00 0.00 46.19 43.12 1s26 s LEU 625 CO -0.00 -0.47 0.58 -0.47 -1.32 0.00 0.00 176.35 174.67 1s26 s TYR 626 N 1.22 -0.55 -0.18 5.38 5.04 -1.26 -3.54 117.35 123.46 1s26 s TYR 626 Ca 0.58 1.02 -0.15 0.00 -2.44 0.00 0.00 57.07 56.08 1s26 s TYR 626 Cb -0.28 0.31 0.05 0.00 0.35 0.00 0.00 41.96 42.38 1s26 s TYR 626 CO 0.28 -0.51 0.47 1.52 -1.34 0.00 0.00 175.55 175.97 1s26 s TYR 627 N -0.95 -0.55 0.08 4.97 -0.85 -1.26 -5.07 117.35 113.72 1s26 s TYR 627 Ca -0.10 1.29 0.01 0.00 -0.52 0.00 0.00 57.07 57.75 1s26 s TYR 627 Cb -0.02 0.20 -0.04 0.00 0.38 0.00 0.00 41.96 42.49 1s26 s TYR 627 CO 0.07 -0.27 0.23 -0.59 -1.52 0.00 0.00 175.55 173.47 1s26 s PHE 628 N 0.46 3.51 -0.44 -3.49 -0.12 -1.26 -4.96 117.98 111.68 1s26 s PHE 628 Ca -0.02 0.22 -0.46 0.00 -0.05 0.00 0.00 56.93 56.62 1s26 s PHE 628 Cb -0.04 -1.74 -0.20 0.00 -0.63 0.00 0.00 43.02 40.42 1s26 s PHE 628 CO -0.02 0.57 1.56 -1.71 -0.05 0.00 0.00 175.22 175.57 1s26 n ASN 629 N 0.08 1.19 0.32 1.98 4.05 -1.24 -4.83 115.26 116.80 1s26 n ASN 629 Ca -0.05 1.18 0.21 0.00 0.45 0.00 0.00 54.58 56.37 1s26 n ASN 629 Cb 0.52 -0.90 1.13 0.00 1.23 0.00 0.00 39.78 41.75 1s26 n ASN 629 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 177.26 174.24 1s26 h ARG 630 N 4.98 0.00 0.00 1.20 3.08 -1.95 -1.90 114.38 119.79 1s26 h ARG 630 Ca -0.45 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.51 1s26 h ARG 630 Cb 1.37 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.41 1s26 h ARG 630 CO 0.95 0.00 -0.43 0.77 -1.07 0.00 0.00 179.97 180.19 1s26 h SER 631 N 0.00 0.00 -3.01 7.04 0.02 -1.88 -3.46 113.55 112.26 1s26 h SER 631 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 1s26 h SER 631 Cb 0.03 0.00 0.16 0.00 0.14 0.00 0.00 62.40 62.74 1s26 h SER 631 CO 0.00 0.43 -0.27 -1.22 -1.14 0.00 0.00 176.83 174.64 1s26 n TYR 632 N -3.28 -0.28 -1.61 3.45 0.53 -0.72 -1.14 117.16 114.11 1s26 n TYR 632 Ca 0.02 0.47 -0.17 0.00 -1.02 0.00 0.00 57.90 57.19 1s26 n TYR 632 Cb 0.66 -2.01 -0.06 0.00 -1.03 0.00 0.00 39.34 36.90 1s26 n TYR 632 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 1s26 n ASN 633 N 0.36 -5.00 -3.42 7.72 5.03 0.18 -4.94 115.26 115.18 1s26 n ASN 633 Ca 0.12 0.35 -0.15 0.00 0.87 0.00 0.00 54.58 55.77 1s26 n ASN 633 Cb 0.46 -4.00 -0.06 0.00 -1.02 0.00 0.00 39.78 35.17 1s26 n ASN 633 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1s26 s LYS 634 N -3.64 1.78 -0.51 3.52 1.02 -0.29 -5.05 119.74 116.56 1s26 s LYS 634 Ca 0.00 -1.76 -0.16 0.00 0.02 0.00 0.00 55.97 54.07 1s26 s LYS 634 Cb 0.00 0.40 0.11 0.00 -0.52 0.00 0.00 37.83 37.82 1s26 s LYS 634 CO 0.00 -0.71 0.46 0.42 -0.92 0.00 0.00 175.35 174.60 1s26 s ILE 635 N -3.33 5.22 0.21 2.17 1.01 -1.26 -4.27 121.20 120.95 1s26 s ILE 635 Ca 0.33 -1.32 -0.31 0.00 0.00 0.00 0.00 60.65 59.34 1s26 s ILE 635 Cb 0.01 -4.25 -0.15 0.00 0.01 0.00 0.00 42.46 38.08 1s26 s ILE 635 CO 0.20 -0.75 1.15 0.00 0.00 0.00 0.00 174.94 175.54 1s26 n ALA 636 N 5.23 -0.40 -0.05 9.38 0.00 0.01 -4.85 120.51 129.82 1s26 n ALA 636 Ca -0.13 0.44 -0.12 0.00 0.00 0.00 0.00 53.44 53.63 1s26 n ALA 636 Cb 0.41 -2.05 -0.06 0.00 0.00 0.00 0.00 19.45 17.75 1s26 n ALA 636 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1s26 h PRO 637 N 3.10 0.27 0.10 0.00 0.11 -1.78 -0.95 132.00 132.85 1s26 h PRO 637 Ca -0.42 -0.08 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1s26 h PRO 637 Cb 1.33 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 1s26 h PRO 637 CO 0.68 0.47 -0.08 0.78 -0.21 0.00 0.00 178.00 179.65 1s26 h GLY 638 N 0.03 -0.65 -2.21 -0.55 0.00 -1.29 -3.33 103.07 95.06 1s26 h GLY 638 Ca 0.05 0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1s26 h GLY 638 CO 0.01 -0.24 0.00 1.16 0.00 0.00 0.00 176.54 177.47 1s26 n ASN 639 N -2.71 3.46 -1.66 0.19 2.04 -0.97 -4.96 115.26 110.65 1s26 n ASN 639 Ca -0.02 -1.96 -0.21 0.00 -0.44 0.00 0.00 54.58 51.95 1s26 n ASN 639 Cb 0.07 -0.30 -0.08 0.00 -2.53 0.00 0.00 39.78 36.94 1s26 n ASN 639 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1s26 n LYS 640 N 1.37 -1.46 -2.00 -3.83 4.76 -0.36 -4.95 118.16 111.69 1s26 n LYS 640 Ca 0.19 1.21 -0.36 0.00 -2.87 0.00 0.00 58.31 56.47 1s26 n LYS 640 Cb 0.57 -5.61 0.03 0.00 -1.84 0.00 0.00 35.03 28.19 1s26 n LYS 640 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1s26 s ALA 641 N -2.79 2.60 -0.50 7.82 0.00 -1.25 -4.56 121.76 123.09 1s26 s ALA 641 Ca 0.00 1.05 0.03 0.00 0.00 0.00 0.00 51.96 53.04 1s26 s ALA 641 Cb 0.00 -3.46 0.16 0.00 0.00 0.00 0.00 23.12 19.81 1s26 s ALA 641 CO 0.00 -1.16 0.34 -0.47 0.00 0.00 0.00 175.76 174.47 1s26 s TYR 642 N -1.55 2.04 -0.23 0.00 5.04 -1.26 -0.81 117.35 120.57 1s26 s TYR 642 Ca 0.76 -2.59 -0.16 0.00 -2.44 0.00 0.00 57.07 52.64 1s26 s TYR 642 Cb -0.32 -1.73 -0.04 0.00 0.35 0.00 0.00 41.96 40.23 1s26 s TYR 642 CO 0.35 -0.74 0.40 0.42 -1.34 0.00 0.00 175.55 174.65 1s26 s ILE 643 N -0.19 5.17 0.34 3.14 1.09 -1.26 -4.91 121.20 124.59 1s26 s ILE 643 Ca 0.25 0.68 -0.14 0.00 -1.10 0.00 0.00 60.65 60.34 1s26 s ILE 643 Cb -0.10 -3.73 -0.08 0.00 -1.06 0.00 0.00 42.46 37.49 1s26 s ILE 643 CO -0.11 0.20 0.74 -1.61 -0.10 0.00 0.00 174.94 174.06 1s26 s GLU 644 N 1.70 3.94 -0.18 2.79 2.02 -1.26 0.48 118.70 128.18 1s26 s GLU 644 Ca 0.18 0.61 -0.23 0.00 0.02 0.00 0.00 54.97 55.54 1s26 s GLU 644 Cb -0.15 -2.42 0.06 0.00 0.10 0.00 0.00 34.13 31.72 1s26 s GLU 644 CO 0.09 0.10 0.62 -0.46 0.02 0.00 0.00 175.26 175.63 1s26 s TRP 645 N -2.09 -0.65 -0.24 1.61 -0.11 -1.26 -4.85 118.94 111.35 1s26 s TRP 645 Ca 0.53 1.47 -0.29 0.00 1.22 0.00 0.00 56.10 59.03 1s26 s TRP 645 Cb -0.10 0.26 -0.02 0.00 -1.50 0.00 0.00 33.47 32.12 1s26 s TRP 645 CO 0.21 -0.40 1.49 0.95 -4.62 0.00 0.00 176.95 174.59 1s26 s THR 646 N -0.12 3.87 -0.42 5.86 -4.23 -1.26 -4.86 115.64 114.48 1s26 s THR 646 Ca -0.03 0.99 -0.00 0.00 -1.18 0.00 0.00 61.69 61.46 1s26 s THR 646 Cb -0.03 -3.87 0.11 0.00 1.34 0.00 0.00 72.50 70.05 1s26 s THR 646 CO 0.03 -0.34 0.19 -0.62 -0.54 0.00 0.00 174.62 173.34 1s26 s ASP 647 N 3.61 5.05 0.32 3.99 2.15 -1.26 -5.00 116.67 125.54 1s26 s ASP 647 Ca 0.66 -2.23 0.09 0.00 0.43 0.00 0.00 52.55 51.49 1s26 s ASP 647 Cb -0.22 -1.76 0.95 0.00 -0.30 0.00 0.00 42.92 41.59 1s26 s ASP 647 CO 0.26 -0.46 1.61 -0.65 -0.17 0.00 0.00 175.17 175.76 1s26 h PRO 648 N 7.70 0.10 -0.82 4.34 0.11 -2.00 0.12 132.00 141.54 1s26 h PRO 648 Ca -0.09 -0.01 0.20 0.00 0.11 0.00 0.00 66.00 66.22 1s26 h PRO 648 Cb 1.02 -0.02 -0.14 0.00 0.11 0.00 0.00 31.00 31.97 1s26 h PRO 648 CO 0.65 0.07 0.10 0.82 -0.21 0.00 0.00 178.00 179.42 1s26 h ILE 649 N 0.10 0.30 -0.41 4.15 2.04 -2.00 0.15 117.51 121.84 1s26 h ILE 649 Ca 0.67 -0.05 -0.10 0.00 1.00 0.00 0.00 64.86 66.38 1s26 h ILE 649 Cb 1.54 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1s26 h ILE 649 CO -0.77 0.03 -0.17 0.74 0.00 0.00 0.00 178.15 177.98 1s26 h THR 650 N 0.14 1.26 -0.82 -0.27 2.02 -1.20 -2.00 112.91 112.04 1s26 h THR 650 Ca 0.48 -1.25 0.12 0.00 0.77 0.00 0.00 66.41 66.52 1s26 h THR 650 Cb 0.91 1.13 -0.08 0.00 -1.74 0.00 0.00 68.15 68.37 1s26 h THR 650 CO -0.68 0.42 0.44 0.50 0.37 0.00 0.00 175.52 176.57 1s26 h LYS 651 N 0.69 0.67 0.00 6.66 3.64 -0.64 -1.20 116.57 126.40 1s26 h LYS 651 Ca 0.11 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1s26 h LYS 651 Cb 0.66 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1s26 h LYS 651 CO 0.05 0.44 -0.10 0.00 -2.27 0.00 0.00 179.45 177.58 1s26 h ALA 652 N 1.49 0.94 -0.46 5.00 0.00 -1.01 -3.31 119.26 121.90 1s26 h ALA 652 Ca 0.42 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.37 1s26 h ALA 652 Cb 0.48 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1s26 h ALA 652 CO -0.30 0.12 0.55 -0.22 0.00 0.00 0.00 179.25 179.40 1s26 h LYS 653 N 0.00 0.00 0.36 0.00 3.64 -0.47 -2.10 116.57 118.00 1s26 h LYS 653 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1s26 h LYS 653 Cb 1.03 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 1s26 h LYS 653 CO 0.01 0.00 -0.35 0.82 -2.27 0.00 0.00 179.45 177.66 1s26 h ILE 654 N 0.00 0.28 -0.55 2.00 2.04 -1.70 -2.89 117.51 116.69 1s26 h ILE 654 Ca 0.22 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.91 1s26 h ILE 654 Cb 1.32 0.28 -0.10 0.00 -0.74 0.00 0.00 36.82 37.58 1s26 h ILE 654 CO -0.00 0.00 0.21 0.59 0.00 0.00 0.00 178.15 178.95 1s26 n ASN 655 N -5.46 4.03 -4.36 1.72 5.03 -0.81 -4.38 115.26 111.03 1s26 n ASN 655 Ca -0.10 -2.89 -0.32 0.00 0.87 0.00 0.00 54.58 52.14 1s26 n ASN 655 Cb 0.36 -0.68 -0.15 0.00 -1.02 0.00 0.00 39.78 38.29 1s26 n ASN 655 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1s26 s THR 656 N -2.31 2.54 0.19 3.41 2.01 -1.09 -4.04 115.64 116.34 1s26 s THR 656 Ca 0.40 -0.90 -0.30 0.00 0.31 0.00 0.00 61.69 61.21 1s26 s THR 656 Cb 0.32 -1.97 -0.08 0.00 0.01 0.00 0.00 72.50 70.79 1s26 s THR 656 CO 0.10 0.57 0.93 -0.63 -0.69 0.00 0.00 174.62 174.90 1s26 s ILE 657 N -0.34 4.24 0.71 1.82 1.01 -1.26 -4.71 121.20 122.67 1s26 s ILE 657 Ca 0.02 2.05 -0.16 0.00 0.00 0.00 0.00 60.65 62.56 1s26 s ILE 657 Cb -0.13 -4.31 0.03 0.00 0.01 0.00 0.00 42.46 38.06 1s26 s ILE 657 CO 0.02 0.44 1.22 -2.16 0.00 0.00 0.00 174.94 174.46 1s26 s PRO 658 N -0.78 2.26 0.53 2.79 0.04 -1.26 -5.04 135.00 133.55 1s26 s PRO 658 Ca 0.42 1.80 -0.02 0.00 0.04 0.00 0.00 61.00 63.24 1s26 s PRO 658 Cb -0.25 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.46 1s26 s PRO 658 CO 0.31 -1.75 0.79 0.99 0.04 0.00 0.00 177.00 177.38 1s26 s THR 659 N -1.88 3.63 0.17 1.26 2.01 -1.25 -4.89 115.64 114.69 1s26 s THR 659 Ca 0.76 -0.30 -0.16 0.00 0.31 0.00 0.00 61.69 62.30 1s26 s THR 659 Cb -0.30 -3.40 0.08 0.00 0.01 0.00 0.00 72.50 68.89 1s26 s THR 659 CO 0.43 -0.34 1.70 -1.28 -0.69 0.00 0.00 174.62 174.45 1s26 h SER 660 N 0.08 -0.15 -0.06 3.53 0.87 -1.84 -2.27 113.55 113.70 1s26 h SER 660 Ca -0.45 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1s26 h SER 660 Cb 1.26 0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 63.38 1s26 h SER 660 CO 0.58 -0.04 0.04 0.00 -0.53 0.00 0.00 176.83 176.88 1s26 h ALA 661 N 1.35 0.08 0.00 6.23 0.00 -1.96 -1.19 119.26 123.77 1s26 h ALA 661 Ca 0.20 -0.02 -0.42 0.00 0.00 0.00 0.00 54.91 54.67 1s26 h ALA 661 Cb 0.28 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.07 1s26 h ALA 661 CO -0.33 -0.42 2.36 0.39 0.00 0.00 0.00 179.25 181.26 1s26 n GLU 662 N -5.03 1.71 0.01 0.00 1.02 -0.86 -1.14 120.64 116.35 1s26 n GLU 662 Ca -0.06 -1.46 0.00 0.00 -0.02 0.00 0.00 57.16 55.62 1s26 n GLU 662 Cb 0.04 -2.53 0.00 0.00 -0.02 0.00 0.00 31.44 28.93 1s26 n GLU 662 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1s26 n PHE 663 N 5.22 -1.01 -0.12 -0.32 7.35 -1.09 -3.96 117.46 123.53 1s26 n PHE 663 Ca 0.42 0.06 0.06 0.00 -0.76 0.00 0.00 57.45 57.23 1s26 n PHE 663 Cb 0.20 0.32 0.38 0.00 0.35 0.00 0.00 39.48 40.73 1s26 n PHE 663 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1s26 h ILE 664 N 0.00 1.05 -0.02 -2.13 2.04 -0.91 0.17 117.51 117.71 1s26 h ILE 664 Ca 0.00 -0.23 -0.15 0.00 1.00 0.00 0.00 64.86 65.47 1s26 h ILE 664 Cb 0.00 0.31 0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1s26 h ILE 664 CO 0.00 0.12 -0.58 0.11 0.00 0.00 0.00 178.15 177.81 1s26 h LYS 665 N 0.68 0.43 -0.51 2.37 1.57 -1.37 -2.99 116.57 116.75 1s26 h LYS 665 Ca 0.25 -0.43 0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1s26 h LYS 665 Cb 0.14 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 1s26 h LYS 665 CO -0.07 1.09 0.35 -0.91 -0.57 0.00 0.00 179.45 179.33 1s26 h ASN 666 N -0.06 0.33 -0.00 0.86 -0.26 -1.52 0.14 115.58 115.06 1s26 h ASN 666 Ca -0.07 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.57 1s26 h ASN 666 Cb 1.28 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 38.46 1s26 h ASN 666 CO 0.12 0.21 -0.30 -0.07 -1.06 0.00 0.00 177.43 176.32 1s26 h LEU 667 N 0.37 0.46 -0.45 1.61 3.38 -0.95 -1.52 115.31 118.21 1s26 h LEU 667 Ca 0.23 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1s26 h LEU 667 Cb 0.43 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1s26 h LEU 667 CO -0.06 0.74 0.24 -1.28 0.09 0.00 0.00 178.44 178.18 1s26 h SER 668 N 0.39 0.56 -0.41 -0.43 0.87 -0.83 -1.53 113.55 112.18 1s26 h SER 668 Ca 0.05 -0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.45 1s26 h SER 668 Cb 0.72 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.53 1s26 h SER 668 CO 0.06 0.49 -0.02 0.28 -0.53 0.00 0.00 176.83 177.11 1s26 h SER 669 N 0.59 0.72 0.00 6.23 0.02 -1.27 -1.46 113.55 118.38 1s26 h SER 669 Ca 0.16 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1s26 h SER 669 Cb 0.06 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1s26 h SER 669 CO -0.02 0.87 0.00 0.00 -1.14 0.00 0.00 176.83 176.54 1s26 n ILE 670 N -4.41 0.00 0.22 3.27 3.06 -0.59 -0.68 119.36 120.23 1s26 n ILE 670 Ca -0.01 0.00 0.09 0.00 -2.50 0.00 0.00 62.75 60.33 1s26 n ILE 670 Cb 0.31 -0.26 0.17 0.00 0.54 0.00 0.00 39.64 40.39 1s26 n ILE 670 CO 0.00 0.00 0.00 -1.14 -2.50 0.00 0.00 176.55 172.91 1s26 n ARG 671 N -0.64 2.18 -0.09 9.51 0.63 -0.55 -3.91 116.66 123.78 1s26 n ARG 671 Ca 0.05 -2.01 0.12 0.00 -0.92 0.00 0.00 57.85 55.09 1s26 n ARG 671 Cb 0.02 -1.40 0.25 0.00 0.45 0.00 0.00 32.46 31.79 1s26 n ARG 671 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1s26 n ARG 672 N 1.09 2.21 -2.64 -0.14 5.12 0.15 -4.11 116.66 118.33 1s26 n ARG 672 Ca 0.15 -1.81 -0.23 0.00 -1.93 0.00 0.00 57.85 54.04 1s26 n ARG 672 Cb 0.50 -1.47 -0.00 0.00 -1.16 0.00 0.00 32.46 30.32 1s26 n ARG 672 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1s26 n SER 673 N 1.08 3.77 0.00 0.55 7.64 -1.25 -5.02 113.62 120.38 1s26 n SER 673 Ca 0.17 -3.47 0.00 0.00 1.01 0.00 0.00 58.87 56.59 1s26 n SER 673 Cb 0.52 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1s26 n SER 673 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1s26 n SER 674 N -0.31 0.00 -4.92 6.43 2.88 -1.26 -5.03 113.62 111.41 1s26 n SER 674 Ca 0.31 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.59 1s26 n SER 674 Cb 0.64 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.13 1s26 n SER 674 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1s26 s ASN 675 N 0.00 5.69 -0.04 -3.46 2.47 -1.26 -4.97 114.94 113.36 1s26 s ASN 675 Ca 0.00 0.63 0.05 0.00 0.42 0.00 0.00 52.86 53.96 1s26 s ASN 675 Cb 0.00 -1.70 -0.02 0.00 -1.45 0.00 0.00 41.25 38.08 1s26 s ASN 675 CO 0.00 -0.95 -0.20 0.54 -3.72 0.00 0.00 177.10 172.77 1s26 s VAL 676 N -2.88 2.59 0.00 -5.21 0.11 -1.26 -4.96 120.40 108.79 1s26 s VAL 676 Ca 0.52 -0.90 0.00 0.00 -2.93 0.00 0.00 61.98 58.68 1s26 s VAL 676 Cb -0.10 -1.97 0.00 0.00 -1.53 0.00 0.00 36.38 32.77 1s26 s VAL 676 CO 0.43 0.58 0.00 0.61 -3.33 0.00 0.00 175.10 173.40 1s26 n GLY 677 N 2.49 -2.17 2.73 6.54 0.00 -1.26 -5.12 105.19 108.40 1s26 n GLY 677 Ca -0.17 0.68 -0.26 0.00 0.00 0.00 0.00 46.02 46.28 1s26 n GLY 677 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s26 s VAL 678 N -0.38 0.38 0.32 1.61 1.01 -1.26 -5.01 120.40 117.07 1s26 s VAL 678 Ca 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1s26 s VAL 678 Cb 0.00 -0.78 0.27 0.00 0.00 0.00 0.00 36.38 35.87 1s26 s VAL 678 CO 0.00 -0.04 1.96 0.22 0.00 0.00 0.00 175.10 177.24 1s26 h TYR 679 N 8.30 0.95 -3.26 5.22 3.20 -1.99 -3.41 116.97 125.97 1s26 h TYR 679 Ca -0.17 0.02 -0.53 0.00 3.14 0.00 0.00 58.73 61.20 1s26 h TYR 679 Cb 1.13 -0.32 0.04 0.00 1.54 0.00 0.00 36.73 39.12 1s26 h TYR 679 CO 0.34 0.56 0.72 0.21 -1.64 0.00 0.00 178.16 178.35 1s26 s LYS 680 N -5.84 4.32 -0.73 1.82 2.20 -1.26 -3.63 119.74 116.62 1s26 s LYS 680 Ca -0.11 2.16 -0.01 0.00 -0.36 0.00 0.00 55.97 57.65 1s26 s LYS 680 Cb 0.18 -3.17 0.00 0.00 -1.51 0.00 0.00 37.83 33.33 1s26 s LYS 680 CO 0.79 -0.37 0.68 -3.47 -0.36 0.00 0.00 175.35 172.62 1s26 n ASP 681 N 2.89 -7.50 0.18 1.43 -0.08 -1.26 -4.90 116.55 107.31 1s26 n ASP 681 Ca 0.08 -0.13 0.02 0.00 -1.51 0.00 0.00 54.79 53.25 1s26 n ASP 681 Cb 0.41 -4.93 0.34 0.00 2.34 0.00 0.00 41.12 39.29 1s26 n ASP 681 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1s26 h SER 682 N 0.49 0.00 -2.20 1.67 0.02 -1.79 -3.44 113.55 108.29 1s26 h SER 682 Ca -0.07 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 1s26 h SER 682 Cb 1.04 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.61 1s26 h SER 682 CO 0.30 0.40 0.05 0.61 -1.14 0.00 0.00 176.83 177.05 1s26 n GLY 683 N -0.38 -1.24 0.09 -3.77 0.00 -1.26 -5.01 105.19 93.62 1s26 n GLY 683 Ca -0.02 -1.66 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 1s26 n GLY 683 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1s26 n ASP 684 N -3.11 0.89 -4.71 1.61 -0.08 -1.26 -4.89 116.55 105.00 1s26 n ASP 684 Ca 0.02 0.35 -0.42 0.00 -1.51 0.00 0.00 54.79 53.23 1s26 n ASP 684 Cb 0.07 -0.02 -0.03 0.00 2.34 0.00 0.00 41.12 43.48 1s26 n ASP 684 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1s26 s LYS 685 N -2.58 4.30 0.00 -0.67 1.02 -1.26 -4.90 119.74 115.64 1s26 s LYS 685 Ca -0.07 2.12 0.22 0.00 0.02 0.00 0.00 55.97 58.26 1s26 s LYS 685 Cb 0.08 -3.29 0.57 0.00 -0.52 0.00 0.00 37.83 34.67 1s26 s LYS 685 CO 0.82 -0.49 1.49 -0.25 -0.92 0.00 0.00 175.35 176.00 1s26 n ASP 686 N 4.18 3.62 -1.32 2.83 8.00 -1.26 -4.27 116.55 128.33 1s26 n ASP 686 Ca 0.12 -1.99 -0.01 0.00 0.71 0.00 0.00 54.79 53.62 1s26 n ASP 686 Cb 0.42 -0.40 0.17 0.00 -0.02 0.00 0.00 41.12 41.28 1s26 n ASP 686 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1s26 n GLU 687 N 1.51 2.54 -3.55 -1.24 1.02 -1.26 -4.82 120.64 114.84 1s26 n GLU 687 Ca 0.22 -1.54 0.02 0.00 -0.02 0.00 0.00 57.16 55.85 1s26 n GLU 687 Cb 0.59 -1.79 -0.06 0.00 -0.02 0.00 0.00 31.44 30.16 1s26 n GLU 687 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1s26 s PHE 688 N -1.80 -0.14 -0.43 -0.32 5.36 -1.26 -5.11 117.98 114.28 1s26 s PHE 688 Ca 0.27 0.28 0.09 0.00 -0.96 0.00 0.00 56.93 56.61 1s26 s PHE 688 Cb 0.22 0.09 0.30 0.00 -0.34 0.00 0.00 43.02 43.28 1s26 s PHE 688 CO 0.07 -0.07 0.67 0.00 -1.46 0.00 0.00 175.22 174.43 1s26 n ALA 689 N 3.51 2.66 -3.64 11.12 0.00 -1.26 -4.72 120.51 128.17 1s26 n ALA 689 Ca -0.15 -3.67 -0.07 0.00 0.00 0.00 0.00 53.44 49.54 1s26 n ALA 689 Cb 0.56 -0.86 -0.07 0.00 0.00 0.00 0.00 19.45 19.08 1s26 n ALA 689 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1s26 s LYS 690 N -2.03 0.46 -0.46 0.00 2.20 -1.26 -4.68 119.74 113.97 1s26 s LYS 690 Ca 0.39 0.60 -0.09 0.00 -0.36 0.00 0.00 55.97 56.50 1s26 s LYS 690 Cb 0.25 0.20 0.11 0.00 -1.51 0.00 0.00 37.83 36.88 1s26 s LYS 690 CO -0.09 -0.06 0.33 0.15 -0.36 0.00 0.00 175.35 175.31 1s26 s LYS 691 N 0.47 2.53 -0.02 4.03 1.02 -1.26 -5.02 119.74 121.48 1s26 s LYS 691 Ca 0.01 -1.68 -0.06 0.00 0.02 0.00 0.00 55.97 54.26 1s26 s LYS 691 Cb -0.05 -3.90 -0.03 0.00 -0.52 0.00 0.00 37.83 33.33 1s26 s LYS 691 CO -0.09 -1.13 0.19 -1.91 -0.92 0.00 0.00 175.35 171.49 1s26 n GLU 692 N 4.92 0.00 -2.70 1.68 4.07 -1.26 -0.86 120.64 126.50 1s26 n GLU 692 Ca -0.09 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 56.91 1s26 n GLU 692 Cb 0.41 -0.22 0.02 0.00 -0.06 0.00 0.00 31.44 31.59 1s26 n GLU 692 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1s26 n SER 693 N 0.35 -3.76 0.00 4.31 7.64 -1.26 -4.23 113.62 116.67 1s26 n SER 693 Ca 0.04 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.76 1s26 n SER 693 Cb 0.00 -2.59 0.00 0.00 -1.01 0.00 0.00 64.21 60.62 1s26 n SER 693 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1s26 n VAL 694 N -3.80 0.00 1.46 0.44 0.24 -0.04 -3.40 118.33 113.24 1s26 n VAL 694 Ca -0.04 0.37 0.15 0.00 -2.04 0.00 0.00 64.34 62.77 1s26 n VAL 694 Cb 0.55 -0.99 0.71 0.00 -1.47 0.00 0.00 33.84 32.63 1s26 n VAL 694 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1s26 n LYS 695 N 0.00 0.59 -0.21 7.34 4.81 -1.26 -3.79 118.16 125.64 1s26 n LYS 695 Ca 0.00 -0.10 -0.07 0.00 -0.87 0.00 0.00 58.31 57.27 1s26 n LYS 695 Cb 0.00 -1.50 0.03 0.00 0.02 0.00 0.00 35.03 33.58 1s26 n LYS 695 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 1s26 h LYS 696 N 0.25 0.85 -0.82 1.64 1.79 -1.98 -2.62 116.57 115.68 1s26 h LYS 696 Ca 0.00 -0.13 0.17 0.00 -2.18 0.00 0.00 60.65 58.51 1s26 h LYS 696 Cb 0.30 -0.15 -0.10 0.00 -1.58 0.00 0.00 32.23 30.69 1s26 h LYS 696 CO 0.00 0.69 0.36 0.82 -1.08 0.00 0.00 179.45 180.24 1s26 h ILE 697 N 0.80 0.62 -0.10 1.86 2.04 -1.65 -1.22 117.51 119.86 1s26 h ILE 697 Ca 0.20 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 1s26 h ILE 697 Cb 0.12 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1s26 h ILE 697 CO -0.03 0.09 -0.07 0.00 0.00 0.00 0.00 178.15 178.14 1s26 h ALA 698 N 1.60 0.14 -0.69 1.87 0.00 -1.76 -3.25 119.26 117.17 1s26 h ALA 698 Ca 0.47 -0.27 0.15 0.00 0.00 0.00 0.00 54.91 55.26 1s26 h ALA 698 Cb 0.76 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.41 1s26 h ALA 698 CO -0.43 -0.06 0.07 0.78 0.00 0.00 0.00 179.25 179.61 1s26 h GLY 699 N -0.16 0.84 2.00 0.00 0.00 -0.88 0.56 103.07 105.43 1s26 h GLY 699 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1s26 h GLY 699 CO 0.02 -0.22 0.00 -1.72 0.00 0.00 0.00 176.54 174.62 1s26 n TYR 700 N -5.24 0.75 0.08 5.60 0.53 -0.74 -0.92 117.16 117.22 1s26 n TYR 700 Ca 0.12 0.33 -0.16 0.00 -1.02 0.00 0.00 57.90 57.16 1s26 n TYR 700 Cb 0.42 -1.03 -0.14 0.00 -1.03 0.00 0.00 39.34 37.56 1s26 n TYR 700 CO 0.00 0.00 0.00 -0.07 -1.02 0.00 0.00 176.86 175.77 1s26 h LEU 701 N 0.00 0.41 -0.85 7.72 3.38 0.05 -2.82 115.31 123.20 1s26 h LEU 701 Ca 0.00 -0.50 -0.11 0.00 0.09 0.00 0.00 57.88 57.36 1s26 h LEU 701 Cb 0.22 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1s26 h LEU 701 CO 0.00 1.40 -0.53 -1.28 0.09 0.00 0.00 178.44 178.12 1s26 h SER 702 N 0.07 0.00 0.07 -0.43 0.87 -0.15 -3.07 113.55 110.91 1s26 h SER 702 Ca -0.19 0.00 -0.26 0.00 -1.23 0.00 0.00 61.79 60.12 1s26 h SER 702 Cb 2.00 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 63.97 1s26 h SER 702 CO 0.18 0.53 -1.01 0.44 -0.53 0.00 0.00 176.83 176.44 1s26 h ASP 703 N 0.00 0.84 -0.59 6.23 3.45 -1.30 -3.28 116.42 121.76 1s26 h ASP 703 Ca -0.01 -0.66 0.06 0.00 0.43 0.00 0.00 57.03 56.85 1s26 h ASP 703 Cb 1.01 -0.26 -0.05 0.00 -0.56 0.00 0.00 39.33 39.47 1s26 h ASP 703 CO 0.07 1.46 0.31 0.22 -1.57 0.00 0.00 179.24 179.73 1s26 h TYR 704 N 0.37 0.57 -2.46 4.55 3.20 -1.40 -2.95 116.97 118.84 1s26 h TYR 704 Ca -0.12 0.02 -0.80 0.00 3.14 0.00 0.00 58.73 60.98 1s26 h TYR 704 Cb 1.66 -0.17 -0.25 0.00 1.54 0.00 0.00 36.73 39.51 1s26 h TYR 704 CO 0.09 0.26 1.10 0.66 -1.64 0.00 0.00 178.16 178.64 1s26 n TYR 705 N -4.85 2.45 -3.69 -3.82 4.02 -1.19 -4.96 117.16 105.12 1s26 n TYR 705 Ca 0.07 -2.60 -0.38 0.00 -0.01 0.00 0.00 57.90 54.97 1s26 n TYR 705 Cb 0.17 -1.36 -0.12 0.00 -0.02 0.00 0.00 39.34 38.00 1s26 n TYR 705 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1s26 s ASN 706 N -1.24 5.41 0.63 7.72 2.47 -1.12 -4.95 114.94 123.87 1s26 s ASN 706 Ca 0.35 -0.55 0.32 0.00 0.42 0.00 0.00 52.86 53.40 1s26 s ASN 706 Cb 0.09 -1.97 1.76 0.00 -1.45 0.00 0.00 41.25 39.69 1s26 s ASN 706 CO 0.03 -0.18 2.05 0.28 -3.72 0.00 0.00 177.10 175.56 1s26 h SER 707 N 8.31 0.00 0.03 -4.21 0.02 -1.92 -0.52 113.55 115.25 1s26 h SER 707 Ca -0.32 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1s26 h SER 707 Cb 1.14 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.68 1s26 h SER 707 CO 0.61 0.00 -0.01 0.00 -1.14 0.00 0.00 176.83 176.29 1s26 h ALA 708 N 1.60 1.59 0.00 3.77 0.00 -1.98 -2.46 119.26 121.78 1s26 h ALA 708 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1s26 h ALA 708 Cb 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1s26 h ALA 708 CO -0.00 0.01 0.31 0.09 0.00 0.00 0.00 179.25 179.66 1s26 n ASN 709 N -3.96 0.34 0.00 0.00 4.13 -0.21 -2.53 115.26 113.04 1s26 n ASN 709 Ca -0.03 0.56 0.09 0.00 1.68 0.00 0.00 54.58 56.88 1s26 n ASN 709 Cb 0.10 -0.50 0.48 0.00 -1.54 0.00 0.00 39.78 38.32 1s26 n ASN 709 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1s26 n HIS 710 N -2.07 0.00 0.33 3.10 1.44 -0.93 -2.44 115.22 114.66 1s26 n HIS 710 Ca -0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.81 1s26 n HIS 710 Cb 0.33 -0.20 0.18 0.00 0.12 0.00 0.00 29.99 30.42 1s26 n HIS 710 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 1s26 n ILE 711 N -1.20 0.45 -3.69 0.61 -5.35 -1.05 -4.97 119.36 104.17 1s26 n ILE 711 Ca 0.10 -0.73 -0.24 0.00 -0.27 0.00 0.00 62.75 61.62 1s26 n ILE 711 Cb 0.12 1.02 -0.01 0.00 -1.74 0.00 0.00 39.64 39.03 1s26 n ILE 711 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1s26 s PHE 712 N -1.43 1.92 0.37 4.28 0.40 -1.02 -5.12 117.98 117.38 1s26 s PHE 712 Ca 0.34 -0.72 -0.06 0.00 -0.60 0.00 0.00 56.93 55.89 1s26 s PHE 712 Cb 0.20 -2.03 -0.05 0.00 0.51 0.00 0.00 43.02 41.66 1s26 s PHE 712 CO 0.28 -0.45 0.66 -1.54 0.70 0.00 0.00 175.22 174.87 1s26 s SER 713 N -4.28 6.40 0.19 1.36 1.04 -1.26 -4.85 113.70 112.30 1s26 s SER 713 Ca 0.42 0.84 -0.14 0.00 0.48 0.00 0.00 55.95 57.54 1s26 s SER 713 Cb -0.03 -2.20 0.19 0.00 0.10 0.00 0.00 66.02 64.09 1s26 s SER 713 CO 0.26 -0.35 1.65 1.56 0.98 0.00 0.00 173.24 177.33 1s26 h GLN 714 N 1.10 0.02 -0.63 4.02 1.08 -1.98 0.48 115.11 119.20 1s26 h GLN 714 Ca -0.48 -0.00 0.12 0.00 -1.45 0.00 0.00 58.65 56.85 1s26 h GLN 714 Cb 1.20 -0.01 -0.09 0.00 -0.05 0.00 0.00 27.48 28.53 1s26 h GLN 714 CO 0.64 0.02 0.11 1.49 -0.95 0.00 0.00 178.83 180.13 1s26 h GLU 715 N 0.02 0.22 0.64 1.46 4.57 -2.00 0.59 114.58 120.10 1s26 h GLU 715 Ca 0.27 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.40 1s26 h GLU 715 Cb 0.41 -0.05 0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1s26 h GLU 715 CO -0.54 0.15 -0.31 -0.22 -1.18 0.00 0.00 179.01 176.91 1s26 h LYS 716 N 0.23 -0.83 -0.60 1.92 1.63 -0.80 -2.68 116.57 115.44 1s26 h LYS 716 Ca 0.34 0.06 0.09 0.00 -0.85 0.00 0.00 60.65 60.29 1s26 h LYS 716 Cb 0.52 0.19 -0.11 0.00 -0.60 0.00 0.00 32.23 32.23 1s26 h LYS 716 CO -0.45 -0.52 -0.41 0.87 -3.45 0.00 0.00 179.45 175.49 1s26 h LYS 717 N -0.97 -0.19 -0.79 1.90 1.57 0.53 0.25 116.57 118.87 1s26 h LYS 717 Ca -0.09 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.82 1s26 h LYS 717 Cb 0.69 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.97 1s26 h LYS 717 CO 0.14 -0.13 0.41 0.00 -0.57 0.00 0.00 179.45 179.31 1s26 h ARG 718 N -0.20 0.64 0.83 3.15 3.08 -0.92 -0.36 114.38 120.60 1s26 h ARG 718 Ca 0.20 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 1s26 h ARG 718 Cb 0.56 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.47 1s26 h ARG 718 CO -0.70 0.42 -0.40 0.87 -1.07 0.00 0.00 179.97 179.09 1s26 h LYS 719 N 0.66 -1.08 0.00 0.04 1.79 -0.63 0.15 116.57 117.50 1s26 h LYS 719 Ca 0.40 0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.91 1s26 h LYS 719 Cb 0.47 0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 31.35 1s26 h LYS 719 CO -0.30 -0.71 -0.17 -0.84 -1.08 0.00 0.00 179.45 176.35 1s26 h ILE 720 N -1.18 0.97 0.09 1.86 3.07 -1.13 -1.77 117.51 119.43 1s26 h ILE 720 Ca -0.11 -0.63 -0.00 0.00 1.55 0.00 0.00 64.86 65.66 1s26 h ILE 720 Cb 0.86 1.35 0.00 0.00 -0.27 0.00 0.00 36.82 38.77 1s26 h ILE 720 CO 0.19 0.17 -0.05 0.28 -1.05 0.00 0.00 178.15 177.69 1s26 h SER 721 N 0.00 -0.11 -0.27 2.16 0.02 -0.97 0.14 113.55 114.52 1s26 h SER 721 Ca -0.00 -0.48 0.08 0.00 -0.84 0.00 0.00 61.79 60.55 1s26 h SER 721 Cb 0.34 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1s26 h SER 721 CO 0.02 0.52 0.43 0.40 -1.14 0.00 0.00 176.83 177.06 1s26 h ILE 722 N -0.83 0.23 0.00 3.27 2.04 -0.51 0.21 117.51 121.92 1s26 h ILE 722 Ca -0.01 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 1s26 h ILE 722 Cb 0.58 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1s26 h ILE 722 CO 0.02 0.00 -0.40 0.15 0.00 0.00 0.00 178.15 177.93 1s26 h PHE 723 N 0.00 0.00 -0.22 1.37 3.57 -1.16 -3.09 116.94 117.41 1s26 h PHE 723 Ca 0.13 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.69 1s26 h PHE 723 Cb 0.99 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 1s26 h PHE 723 CO 0.00 0.53 0.37 0.00 -2.23 0.00 0.00 178.31 176.98 1s26 h ARG 724 N -1.00 0.00 0.22 1.11 3.08 0.30 0.18 114.38 118.27 1s26 h ARG 724 Ca -0.07 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1s26 h ARG 724 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1s26 h ARG 724 CO -0.04 0.00 -0.10 0.78 -1.07 0.00 0.00 179.97 179.53 1s26 h GLY 725 N 0.00 -0.30 0.58 0.04 0.00 -0.75 -2.87 103.07 99.77 1s26 h GLY 725 Ca 0.10 0.11 0.18 0.00 0.00 0.00 0.00 47.33 47.72 1s26 h GLY 725 CO -0.00 -0.11 0.54 -2.22 0.00 0.00 0.00 176.54 174.75 1s26 h ILE 726 N -1.06 0.44 0.25 2.60 2.04 -1.21 0.26 117.51 120.83 1s26 h ILE 726 Ca -0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 1s26 h ILE 726 Cb 0.22 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1s26 h ILE 726 CO 0.05 0.00 -0.12 1.56 0.00 0.00 0.00 178.15 179.64 1s26 h GLN 727 N 0.00 -0.33 -0.26 2.37 4.20 -1.01 -2.22 115.11 117.86 1s26 h GLN 727 Ca 0.29 0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.96 1s26 h GLN 727 Cb 1.37 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 29.21 1s26 h GLN 727 CO -0.00 -0.09 -0.08 0.00 -0.67 0.00 0.00 178.83 177.99 1s26 h ALA 728 N 0.17 1.38 0.00 3.87 0.00 -0.38 -0.87 119.26 123.42 1s26 h ALA 728 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1s26 h ALA 728 Cb 0.39 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1s26 h ALA 728 CO 0.06 0.43 0.00 0.98 0.00 0.00 0.00 179.25 180.71 1s26 n TYR 729 N -4.25 0.07 -0.07 0.00 9.36 0.23 -2.57 117.16 119.92 1s26 n TYR 729 Ca 0.00 0.03 -0.06 0.00 3.32 0.00 0.00 57.90 61.20 1s26 n TYR 729 Cb 0.28 -0.55 -0.02 0.00 -0.63 0.00 0.00 39.34 38.42 1s26 n TYR 729 CO 0.00 0.00 0.00 -0.97 0.22 0.00 0.00 176.86 176.11 1s26 h ASN 730 N 0.00 0.00 -0.84 2.98 -1.24 -0.54 -3.24 115.58 112.71 1s26 h ASN 730 Ca 0.00 -0.06 0.14 0.00 0.71 0.00 0.00 56.30 57.09 1s26 h ASN 730 Cb 0.21 0.00 -0.09 0.00 0.73 0.00 0.00 38.32 39.17 1s26 h ASN 730 CO 0.00 0.79 0.43 -0.33 -1.29 0.00 0.00 177.43 177.03 1s26 h GLU 731 N -1.00 0.62 -0.86 6.67 4.39 -1.49 0.11 114.58 123.01 1s26 h GLU 731 Ca -0.03 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 1s26 h GLU 731 Cb 0.52 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 1s26 h GLU 731 CO -0.02 0.41 0.47 0.82 -1.16 0.00 0.00 179.01 179.53 1s26 h ILE 732 N 0.63 1.25 0.34 3.13 2.04 -1.69 -2.37 117.51 120.84 1s26 h ILE 732 Ca 0.45 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 1s26 h ILE 732 Cb 0.60 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 1s26 h ILE 732 CO -0.35 0.28 -0.30 -0.08 0.00 0.00 0.00 178.15 177.71 1s26 h GLU 733 N 1.21 -0.64 0.00 2.37 4.57 -1.02 -2.19 114.58 118.88 1s26 h GLU 733 Ca 0.30 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 1s26 h GLU 733 Cb 0.03 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1s26 h GLU 733 CO -0.05 -0.42 0.00 0.27 -1.18 0.00 0.00 179.01 177.63 1s26 n ASN 734 N -5.42 0.44 0.10 1.04 0.23 -0.89 -1.72 115.26 109.03 1s26 n ASN 734 Ca -0.10 0.60 -0.22 0.00 -0.53 0.00 0.00 54.58 54.34 1s26 n ASN 734 Cb 0.33 -0.70 -0.13 0.00 -2.08 0.00 0.00 39.78 37.20 1s26 n ASN 734 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1s26 h VAL 735 N 0.00 1.29 0.00 3.53 2.07 -0.97 -2.79 116.25 119.37 1s26 h VAL 735 Ca 0.00 -2.50 0.00 0.00 0.82 0.00 0.00 66.70 65.02 1s26 h VAL 735 Cb 0.35 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1s26 h VAL 735 CO 0.00 0.76 0.00 -0.07 0.02 0.00 0.00 177.57 178.28 1s26 h LEU 736 N 0.26 0.00 0.00 2.57 3.38 -0.86 -1.96 115.31 118.70 1s26 h LEU 736 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1s26 h LEU 736 Cb 1.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.68 1s26 h LEU 736 CO 0.24 0.00 -0.07 1.17 0.09 0.00 0.00 178.44 179.87 1s26 n LYS 737 N -2.42 0.10 0.00 1.13 3.00 -0.70 -4.71 118.16 114.56 1s26 n LYS 737 Ca 0.03 0.07 0.00 0.00 -0.00 0.00 0.00 58.31 58.41 1s26 n LYS 737 Cb 0.29 -1.60 0.00 0.00 0.00 0.00 0.00 35.03 33.72 1s26 n LYS 737 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1s26 n SER 738 N -1.77 0.00 -4.79 3.14 7.64 -0.74 -5.03 113.62 112.08 1s26 n SER 738 Ca 0.06 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.57 1s26 n SER 738 Cb 0.37 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.51 1s26 n SER 738 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1s26 s LYS 739 N 1.68 3.97 -1.18 1.43 2.47 -1.26 -4.96 119.74 121.89 1s26 s LYS 739 Ca 0.00 0.10 -0.23 0.00 -1.56 0.00 0.00 55.97 54.29 1s26 s LYS 739 Cb 0.00 -3.32 -0.08 0.00 -1.46 0.00 0.00 37.83 32.97 1s26 s LYS 739 CO 0.00 0.49 1.93 -0.65 0.16 0.00 0.00 175.35 177.28 1s26 s GLN 740 N -0.28 2.52 0.00 4.03 1.11 -1.26 -4.76 119.66 121.01 1s26 s GLN 740 Ca 0.17 -1.17 0.00 0.00 0.01 0.00 0.00 55.36 54.37 1s26 s GLN 740 Cb -0.14 -5.25 0.00 0.00 -1.01 0.00 0.00 33.01 26.62 1s26 s GLN 740 CO 0.06 -3.96 0.78 -0.89 0.01 0.00 0.00 175.29 171.30 1s26 n ILE 741 N 7.78 0.00 -3.89 1.08 2.08 -1.26 -4.40 119.36 120.75 1s26 n ILE 741 Ca 0.45 1.28 -0.35 0.00 0.56 0.00 0.00 62.75 64.69 1s26 n ILE 741 Cb 0.47 -1.94 -0.11 0.00 -0.75 0.00 0.00 39.64 37.30 1s26 n ILE 741 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1s26 s ALA 742 N -3.25 3.35 0.31 -1.39 0.00 -1.26 -5.00 121.76 114.53 1s26 s ALA 742 Ca 0.00 -0.90 0.08 0.00 0.00 0.00 0.00 51.96 51.14 1s26 s ALA 742 Cb 0.00 -2.03 0.88 0.00 0.00 0.00 0.00 23.12 21.97 1s26 s ALA 742 CO 0.00 -0.10 1.66 -1.35 0.00 0.00 0.00 175.76 175.97 1s26 h PRO 743 N 7.34 0.29 -0.01 0.00 0.11 -1.97 0.35 132.00 138.11 1s26 h PRO 743 Ca -0.37 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1s26 h PRO 743 Cb 1.17 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1s26 h PRO 743 CO 0.65 0.19 -0.20 0.39 -0.21 0.00 0.00 178.00 178.82 1s26 n GLU 744 N -5.11 0.71 0.09 1.05 1.02 -1.26 -3.56 120.64 113.58 1s26 n GLU 744 Ca 0.26 -0.35 -0.17 0.00 -0.02 0.00 0.00 57.16 56.89 1s26 n GLU 744 Cb 0.81 -1.49 -0.10 0.00 -0.02 0.00 0.00 31.44 30.63 1s26 n GLU 744 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1s26 h TYR 745 N 0.85 0.66 -0.44 -0.32 -1.99 -1.29 -3.12 116.97 111.32 1s26 h TYR 745 Ca 0.00 -0.42 0.13 0.00 2.00 0.00 0.00 58.73 60.44 1s26 h TYR 745 Cb 0.44 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 39.11 1s26 h TYR 745 CO 0.00 1.28 0.52 -0.22 -0.00 0.00 0.00 178.16 179.74 1s26 h LYS 746 N 0.17 0.00 0.00 4.88 3.64 -1.58 -0.35 116.57 123.34 1s26 h LYS 746 Ca -0.13 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1s26 h LYS 746 Cb 1.82 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.64 1s26 h LYS 746 CO 0.20 0.00 -0.01 -0.91 -2.27 0.00 0.00 179.45 176.46 1s26 h ASN 747 N 0.00 0.01 -1.02 4.20 4.21 -1.74 -1.89 115.58 119.35 1s26 h ASN 747 Ca 0.21 -0.85 0.25 0.00 1.21 0.00 0.00 56.30 57.12 1s26 h ASN 747 Cb 1.25 -0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 38.34 1s26 h ASN 747 CO -0.00 0.86 0.62 0.22 -1.29 0.00 0.00 177.43 177.84 1s26 h TYR 748 N -0.84 0.90 0.11 1.19 3.20 -1.14 0.24 116.97 120.62 1s26 h TYR 748 Ca -0.00 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.73 1s26 h TYR 748 Cb 0.86 -0.26 0.02 0.00 1.54 0.00 0.00 36.73 38.89 1s26 h TYR 748 CO 0.23 0.07 -0.73 0.74 -1.64 0.00 0.00 178.16 176.83 1s26 h PHE 749 N 0.53 0.52 -0.09 -3.82 0.05 -1.56 0.10 116.94 112.67 1s26 h PHE 749 Ca 0.63 -0.36 0.03 0.00 3.82 0.00 0.00 57.97 62.08 1s26 h PHE 749 Cb 1.31 -0.03 -0.00 0.00 2.00 0.00 0.00 35.95 39.22 1s26 h PHE 749 CO -0.00 1.26 0.10 -0.56 -0.18 0.00 0.00 178.31 178.92 1s26 h GLN 750 N -0.37 0.00 0.04 1.51 3.07 -0.50 0.92 115.11 119.78 1s26 h GLN 750 Ca -0.12 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.62 1s26 h GLN 750 Cb 1.55 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.11 1s26 h GLN 750 CO 0.14 0.00 -0.02 -0.92 0.09 0.00 0.00 178.83 178.12 1s26 h TYR 751 N 0.00 -0.05 -0.42 0.06 3.20 -0.49 -2.98 116.97 116.30 1s26 h TYR 751 Ca 0.04 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.00 1s26 h TYR 751 Cb 0.24 0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.44 1s26 h TYR 751 CO 0.00 0.40 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.73 1s26 h LEU 752 N -0.98 -0.42 -0.87 2.82 3.38 -0.29 0.25 115.31 119.19 1s26 h LEU 752 Ca -0.01 0.13 0.22 0.00 0.09 0.00 0.00 57.88 58.31 1s26 h LEU 752 Cb 0.47 0.27 -0.13 0.00 0.09 0.00 0.00 40.66 41.37 1s26 h LEU 752 CO 0.01 -0.15 0.33 0.11 0.09 0.00 0.00 178.44 178.83 1s26 h LYS 753 N -0.02 0.33 -0.43 1.13 1.57 -0.95 0.43 116.57 118.65 1s26 h LYS 753 Ca 0.20 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1s26 h LYS 753 Cb 0.32 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1s26 h LYS 753 CO -0.44 0.22 0.06 1.49 -0.57 0.00 0.00 179.45 180.21 1s26 h GLU 754 N 0.34 0.71 0.74 3.15 4.81 -0.41 -0.02 114.58 123.90 1s26 h GLU 754 Ca 0.54 -0.20 -0.04 0.00 -0.13 0.00 0.00 59.36 59.54 1s26 h GLU 754 Cb 1.03 -0.08 0.01 0.00 0.63 0.00 0.00 28.75 30.34 1s26 h GLU 754 CO -0.55 0.75 -0.35 0.00 -0.73 0.00 0.00 179.01 178.13 1s26 h ARG 755 N 0.57 -0.96 -0.86 1.92 3.08 0.60 -1.53 114.38 117.21 1s26 h ARG 755 Ca 0.13 0.07 0.23 0.00 0.07 0.00 0.00 59.98 60.47 1s26 h ARG 755 Cb 0.39 0.22 -0.14 0.00 0.08 0.00 0.00 29.97 30.52 1s26 h ARG 755 CO 0.01 -0.61 0.19 0.82 -1.07 0.00 0.00 179.97 179.31 1s26 h ILE 756 N -1.13 0.31 0.66 2.04 1.08 -0.25 0.54 117.51 120.75 1s26 h ILE 756 Ca -0.10 -0.06 -0.03 0.00 -0.39 0.00 0.00 64.86 64.28 1s26 h ILE 756 Cb 0.78 0.11 -0.01 0.00 -3.07 0.00 0.00 36.82 34.63 1s26 h ILE 756 CO 0.17 0.03 -0.49 0.74 -0.69 0.00 0.00 178.15 177.91 1s26 h THR 757 N 0.18 0.00 -0.66 -0.27 2.02 -0.70 -0.92 112.91 112.56 1s26 h THR 757 Ca 0.53 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.83 1s26 h THR 757 Cb 1.05 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1s26 h THR 757 CO -0.67 0.00 0.44 0.78 0.37 0.00 0.00 175.52 176.45 1s26 h ASN 758 N -1.11 0.36 0.27 4.18 2.35 -0.13 0.17 115.58 121.68 1s26 h ASN 758 Ca -0.09 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 1s26 h ASN 758 Cb 0.92 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.23 1s26 h ASN 758 CO 0.03 0.21 -0.13 -0.61 -1.65 0.00 0.00 177.43 175.27 1s26 h GLN 759 N 0.40 -0.35 1.01 0.81 5.75 -0.59 -2.02 115.11 120.11 1s26 h GLN 759 Ca 0.31 0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.79 1s26 h GLN 759 Cb 0.69 0.08 0.01 0.00 1.07 0.00 0.00 27.48 29.33 1s26 h GLN 759 CO -0.09 -0.04 -0.49 0.28 -2.65 0.00 0.00 178.83 175.85 1s26 h VAL 760 N -0.70 0.00 -1.65 2.39 2.07 -0.57 -2.18 116.25 115.61 1s26 h VAL 760 Ca -0.04 0.00 0.49 0.00 0.82 0.00 0.00 66.70 67.97 1s26 h VAL 760 Cb 0.48 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.16 1s26 h VAL 760 CO 0.06 0.00 1.16 -0.61 0.02 0.00 0.00 177.57 178.20 1s26 h GLN 761 N -1.36 0.02 0.32 1.57 5.75 -0.77 0.07 115.11 120.71 1s26 h GLN 761 Ca -0.14 -0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.34 1s26 h GLN 761 Cb 1.04 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.59 1s26 h GLN 761 CO 0.23 0.02 -0.15 1.25 -2.65 0.00 0.00 178.83 177.52 1s26 h LEU 762 N 0.03 -0.36 -1.38 -2.39 5.85 -0.74 -2.86 115.31 113.45 1s26 h LEU 762 Ca 0.84 -0.15 0.14 0.00 0.84 0.00 0.00 57.88 59.55 1s26 h LEU 762 Cb 3.16 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 44.22 1s26 h LEU 762 CO -0.12 0.10 0.55 -0.07 -0.34 0.00 0.00 178.44 178.56 1s26 h LEU 763 N -0.99 0.57 -0.03 2.25 3.38 -0.60 -1.11 115.31 118.78 1s26 h LEU 763 Ca -0.04 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1s26 h LEU 763 Cb 0.49 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1s26 h LEU 763 CO 0.07 0.30 0.01 -0.07 0.09 0.00 0.00 178.44 178.84 1s26 h LEU 764 N 0.61 0.04 -1.71 1.67 3.38 -1.39 -1.87 115.31 116.04 1s26 h LEU 764 Ca 0.42 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1s26 h LEU 764 Cb 0.73 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1s26 h LEU 764 CO -0.17 0.17 0.00 0.71 0.09 0.00 0.00 178.44 179.24 1s26 h THR 765 N -0.10 0.00 0.00 0.22 1.35 -1.03 0.55 112.91 113.90 1s26 h THR 765 Ca 0.01 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1s26 h THR 765 Cb 0.14 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 1s26 h THR 765 CO -0.00 0.00 0.00 1.57 -0.25 0.00 0.00 175.52 176.84 1s26 n HIS 766 N -2.71 0.30 0.00 4.73 -0.00 -0.53 -4.47 115.22 112.54 1s26 n HIS 766 Ca -0.01 0.11 0.00 0.00 -0.00 0.00 0.00 57.72 57.82 1s26 n HIS 766 Cb 0.16 -0.68 0.00 0.00 -0.00 0.00 0.00 29.99 29.48 1s26 n HIS 766 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1s26 n GLN 767 N -1.76 0.00 0.00 1.57 6.02 0.80 -5.09 117.38 118.91 1s26 n GLN 767 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 1s26 n GLN 767 Cb 0.22 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.48 1s26 n GLN 767 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1s26 n LYS 768 N -1.28 0.00 0.00 -1.09 4.81 0.16 -5.11 118.16 115.65 1s26 n LYS 768 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1s26 n LYS 768 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 1s26 n LYS 768 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1s26 n PHE 773 N -0.31 0.00 -0.11 5.64 7.35 -1.26 -4.80 117.46 123.97 1s26 n PHE 773 Ca 0.00 0.00 0.24 0.00 -0.76 0.00 0.00 57.45 56.93 1s26 n PHE 773 Cb 0.00 0.20 0.69 0.00 0.35 0.00 0.00 39.48 40.72 1s26 n PHE 773 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1s26 h LYS 774 N 0.00 0.04 -0.93 -4.13 1.57 -2.00 0.51 116.57 111.63 1s26 h LYS 774 Ca 0.00 -0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.91 1s26 h LYS 774 Cb 0.00 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.21 1s26 h LYS 774 CO 0.00 0.03 0.55 1.37 -0.57 0.00 0.00 179.45 180.82 1s26 h LEU 775 N 0.04 0.76 -0.22 2.94 -0.00 -2.05 -0.55 115.31 116.24 1s26 h LEU 775 Ca 0.35 0.07 0.00 0.00 -0.00 0.00 0.00 57.88 58.30 1s26 h LEU 775 Cb 1.36 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.94 1s26 h LEU 775 CO -0.02 0.38 -0.56 0.18 -0.00 0.00 0.00 178.44 178.41 1s26 n LEU 776 N -4.73 0.90 0.00 0.17 4.32 0.17 -4.01 117.00 113.82 1s26 n LEU 776 Ca 0.18 -0.26 0.12 0.00 -0.02 0.00 0.00 56.01 56.03 1s26 n LEU 776 Cb 0.39 -0.14 0.71 0.00 -1.62 0.00 0.00 43.42 42.76 1s26 n LEU 776 CO 0.25 0.20 0.94 0.00 -1.22 0.00 0.00 177.39 177.56 1s26 n TYR 777 N -1.15 0.00 -0.08 -1.77 9.36 -0.22 -3.57 117.16 119.73 1s26 n TYR 777 Ca 0.07 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.19 1s26 n TYR 777 Cb 0.35 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.02 1s26 n TYR 777 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1s26 n LYS 778 N -0.90 0.49 -1.63 2.98 4.76 -1.21 -4.61 118.16 118.04 1s26 n LYS 778 Ca 0.18 0.48 -0.40 0.00 -2.87 0.00 0.00 58.31 55.69 1s26 n LYS 778 Cb 0.08 -1.66 -0.04 0.00 -1.84 0.00 0.00 35.03 31.58 1s26 n LYS 778 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1s26 n GLN 779 N -4.54 2.08 -3.52 1.97 10.64 -1.23 -4.82 117.38 117.95 1s26 n GLN 779 Ca -0.15 -2.33 -0.12 0.00 -1.83 0.00 0.00 57.00 52.57 1s26 n GLN 779 Cb 0.41 -3.23 -0.04 0.00 -0.86 0.00 0.00 30.24 26.53 1s26 n GLN 779 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 1s26 s LEU 780 N 3.51 -0.47 -0.01 2.61 0.05 -1.26 -4.78 118.68 118.32 1s26 s LEU 780 Ca 0.56 0.30 -0.20 0.00 0.05 0.00 0.00 54.13 54.84 1s26 s LEU 780 Cb 0.10 2.20 -0.05 0.00 -2.05 0.00 0.00 46.19 46.39 1s26 s LEU 780 CO 0.06 -0.59 0.58 0.20 -0.55 0.00 0.00 176.35 176.05 1s26 s ASN 781 N -1.80 6.95 0.00 1.48 0.02 -1.26 -4.84 114.94 115.49 1s26 s ASN 781 Ca -0.02 1.13 0.00 0.00 -1.02 0.00 0.00 52.86 52.96 1s26 s ASN 781 Cb -0.01 -2.36 0.00 0.00 0.02 0.00 0.00 41.25 38.91 1s26 s ASN 781 CO -0.02 0.10 0.00 0.49 0.02 0.00 0.00 177.10 177.69 1s26 n PHE 782 N 2.77 0.00 -0.34 2.20 3.01 -1.26 -4.88 117.46 118.97 1s26 n PHE 782 Ca -0.07 0.00 0.22 0.00 1.01 0.00 0.00 57.45 58.61 1s26 n PHE 782 Cb 0.51 0.00 0.48 0.00 -0.01 0.00 0.00 39.48 40.46 1s26 n PHE 782 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 1s26 h THR 783 N 0.00 0.49 -1.02 4.37 1.35 -2.03 -3.44 112.91 112.63 1s26 h THR 783 Ca 0.00 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1s26 h THR 783 Cb 0.10 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 66.55 1s26 h THR 783 CO 0.00 0.08 0.00 -0.62 -0.25 0.00 0.00 175.52 174.73 1s26 n GLU 784 N -4.74 0.00 -2.08 4.72 4.71 -1.26 -5.08 120.64 116.91 1s26 n GLU 784 Ca 0.27 0.00 0.01 0.00 -0.01 0.00 0.00 57.16 57.43 1s26 n GLU 784 Cb 0.88 0.00 0.03 0.00 -1.01 0.00 0.00 31.44 31.34 1s26 n GLU 784 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1s26 n ASN 785 N -0.04 0.97 0.00 1.62 0.23 -1.26 -4.88 115.26 111.89 1s26 n ASN 785 Ca 0.00 -2.02 0.00 0.00 -0.53 0.00 0.00 54.58 52.03 1s26 n ASN 785 Cb 0.00 -0.28 0.00 0.00 -2.08 0.00 0.00 39.78 37.42 1s26 n ASN 785 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1s26 n GLU 786 N -0.10 0.36 0.00 -3.83 -0.58 -1.26 -4.84 120.64 110.39 1s26 n GLU 786 Ca 0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.77 1s26 n GLU 786 Cb 0.96 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.83 1s26 n GLU 786 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1s26 n THR 787 N 0.00 0.00 0.03 2.62 -1.04 -1.26 -2.99 114.28 111.64 1s26 n THR 787 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 1s26 n THR 787 Cb 0.00 -0.25 -0.14 0.00 -1.82 0.00 0.00 70.33 68.12 1s26 n THR 787 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1s26 h ASP 788 N 0.31 0.21 -0.24 8.00 3.58 -1.95 -3.31 116.42 123.01 1s26 h ASP 788 Ca 0.00 -0.33 -0.10 0.00 0.42 0.00 0.00 57.03 57.02 1s26 h ASP 788 Cb 0.15 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.13 1s26 h ASP 788 CO 0.00 1.28 -0.24 0.78 -2.88 0.00 0.00 179.24 178.18 1s26 h ASN 789 N 0.04 0.63 -0.08 2.28 -0.26 -1.87 -2.87 115.58 113.44 1s26 h ASN 789 Ca -0.24 -0.47 0.02 0.00 -0.56 0.00 0.00 56.30 55.05 1s26 h ASN 789 Cb 1.98 -0.18 -0.00 0.00 -1.06 0.00 0.00 38.32 39.06 1s26 h ASN 789 CO 0.12 0.98 0.22 0.15 -1.06 0.00 0.00 177.43 177.84 1s26 h PHE 790 N 0.30 0.00 0.16 1.19 3.57 -1.73 -3.08 116.94 117.35 1s26 h PHE 790 Ca 0.04 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1s26 h PHE 790 Cb 0.80 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.54 1s26 h PHE 790 CO 0.08 0.00 -0.08 0.93 -2.23 0.00 0.00 178.31 177.01 1s26 h GLU 791 N 0.00 -0.21 -0.80 1.11 4.39 -1.59 -2.71 114.58 114.77 1s26 h GLU 791 Ca 0.04 0.01 0.19 0.00 0.34 0.00 0.00 59.36 59.95 1s26 h GLU 791 Cb 0.49 0.05 -0.14 0.00 -0.10 0.00 0.00 28.75 29.05 1s26 h GLU 791 CO -0.00 -0.14 0.08 0.28 -1.16 0.00 0.00 179.01 178.06 1s26 h VAL 792 N -0.32 0.32 -0.20 3.13 2.07 -1.66 -1.76 116.25 117.85 1s26 h VAL 792 Ca -0.02 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.47 1s26 h VAL 792 Cb 0.17 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.08 1s26 h VAL 792 CO 0.04 0.02 -0.26 0.15 0.02 0.00 0.00 177.57 177.54 1s26 h PHE 793 N 0.14 -0.80 -0.76 1.57 3.57 -1.60 -1.62 116.94 117.44 1s26 h PHE 793 Ca 0.46 0.04 0.19 0.00 3.53 0.00 0.00 57.97 62.19 1s26 h PHE 793 Cb 0.85 0.38 -0.14 0.00 2.79 0.00 0.00 35.95 39.82 1s26 h PHE 793 CO -0.38 -0.23 -0.06 1.04 -2.23 0.00 0.00 178.31 176.45 1s26 n GLN 794 N -3.95 -0.06 -0.01 1.11 1.13 -0.66 0.45 117.38 115.38 1s26 n GLN 794 Ca -0.02 1.15 -0.13 0.00 -1.94 0.00 0.00 57.00 56.06 1s26 n GLN 794 Cb 0.16 -1.79 -0.01 0.00 0.11 0.00 0.00 30.24 28.71 1s26 n GLN 794 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1s26 h LYS 795 N 0.00 0.65 -0.78 -1.09 1.57 -1.35 -3.31 116.57 112.27 1s26 h LYS 795 Ca 0.42 -0.49 0.08 0.00 -1.87 0.00 0.00 60.65 58.80 1s26 h LYS 795 Cb 0.80 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 33.13 1s26 h LYS 795 CO -0.74 1.11 0.44 0.82 -0.57 0.00 0.00 179.45 180.50 1s26 h ILE 796 N 0.47 0.92 0.00 1.86 1.08 0.91 -2.51 117.51 120.23 1s26 h ILE 796 Ca -0.02 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.19 1s26 h ILE 796 Cb 1.28 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 35.13 1s26 h ILE 796 CO 0.13 0.14 0.00 2.30 -0.69 0.00 0.00 178.15 180.03 1s26 n ILE 797 N -4.76 1.61 1.19 -0.67 -6.64 -1.09 -5.12 119.36 103.89 1s26 n ILE 797 Ca 0.12 0.40 0.13 0.00 -1.77 0.00 0.00 62.75 61.63 1s26 n ILE 797 Cb 0.25 -1.35 0.26 0.00 -1.44 0.00 0.00 39.64 37.36 1s26 n ILE 797 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25