#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k93 n ILE 293 N 0.00 0.00 -2.22 5.15 5.41 -1.26 -4.82 119.36 121.62 1k93 n ILE 293 Ca 0.00 0.00 -0.32 0.00 1.00 0.00 0.00 62.75 63.43 1k93 n ILE 293 Cb 0.00 -0.35 -0.04 0.00 -0.71 0.00 0.00 39.64 38.53 1k93 n ILE 293 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1k93 s ASP 294 N 2.13 5.59 0.11 4.38 3.68 -1.26 -4.96 116.67 126.35 1k93 s ASP 294 Ca 0.82 -1.36 0.10 0.00 2.13 0.00 0.00 52.55 54.24 1k93 s ASP 294 Cb -1.17 -2.57 -0.04 0.00 -1.45 0.00 0.00 42.92 37.69 1k93 s ASP 294 CO 0.63 -2.40 -0.26 0.54 0.13 0.00 0.00 175.17 173.81 1k93 s VAL 295 N 8.61 2.14 0.70 1.11 0.11 -1.26 -4.61 120.40 127.20 1k93 s VAL 295 Ca 0.63 -1.66 -0.11 0.00 -2.93 0.00 0.00 61.98 57.91 1k93 s VAL 295 Cb -0.02 -1.89 0.01 0.00 -1.53 0.00 0.00 36.38 32.95 1k93 s VAL 295 CO 0.03 0.11 1.06 -0.76 -3.33 0.00 0.00 175.10 172.21 1k93 s LEU 296 N -1.90 3.13 0.06 2.54 1.43 -1.01 -4.90 118.68 118.03 1k93 s LEU 296 Ca 0.12 1.66 -0.03 0.00 -1.03 0.00 0.00 54.13 54.85 1k93 s LEU 296 Cb -0.10 -4.50 -0.03 0.00 0.03 0.00 0.00 46.19 41.59 1k93 s LEU 296 CO 0.05 -1.52 0.03 -0.54 0.23 0.00 0.00 176.35 174.60 1k93 s LYS 297 N -4.98 0.66 0.00 1.70 1.02 -1.26 -2.79 119.74 114.08 1k93 s LYS 297 Ca 0.59 -1.13 0.00 0.00 0.02 0.00 0.00 55.97 55.45 1k93 s LYS 297 Cb -0.15 0.24 0.00 0.00 -0.52 0.00 0.00 37.83 37.40 1k93 s LYS 297 CO 0.54 -0.15 0.00 0.41 -0.92 0.00 0.00 175.35 175.24 1k93 n GLY 298 N 0.13 0.57 0.00 -3.33 0.00 -0.77 -2.85 105.19 98.95 1k93 n GLY 298 Ca -0.15 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1k93 n GLY 298 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1k93 n GLU 299 N 0.00 0.00 -0.18 1.61 4.07 -1.26 0.16 120.64 125.03 1k93 n GLU 299 Ca 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.09 1k93 n GLU 299 Cb 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 31.44 31.47 1k93 n GLU 299 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1k93 h LYS 300 N 0.00 0.32 -0.08 5.31 1.57 -1.97 -0.03 116.57 121.69 1k93 h LYS 300 Ca 0.00 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1k93 h LYS 300 Cb 0.00 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1k93 h LYS 300 CO 0.00 0.21 0.03 0.00 -0.57 0.00 0.00 179.45 179.12 1k93 h ALA 301 N 1.40 0.10 -0.93 3.86 0.00 0.17 -2.43 119.26 121.43 1k93 h ALA 301 Ca 0.28 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.23 1k93 h ALA 301 Cb 0.36 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.03 1k93 h ALA 301 CO -0.32 -0.32 0.55 1.25 0.00 0.00 0.00 179.25 180.41 1k93 h LEU 302 N -0.03 0.77 -0.31 0.00 5.85 -1.13 -1.34 115.31 119.12 1k93 h LEU 302 Ca 0.03 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.85 1k93 h LEU 302 Cb 0.16 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 1k93 h LEU 302 CO -0.00 0.39 0.05 0.50 -0.34 0.00 0.00 178.44 179.03 1k93 h LYS 303 N 0.84 0.15 0.00 1.25 3.64 -0.73 -2.37 116.57 119.35 1k93 h LYS 303 Ca 0.48 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.85 1k93 h LYS 303 Cb 0.54 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1k93 h LYS 303 CO -0.29 0.10 0.00 0.00 -2.27 0.00 0.00 179.45 176.98 1k93 h ALA 304 N 1.24 1.00 -0.37 5.00 0.00 -0.80 -3.30 119.26 122.02 1k93 h ALA 304 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1k93 h ALA 304 Cb 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1k93 h ALA 304 CO -0.20 0.00 -0.37 0.66 0.00 0.00 0.00 179.25 179.34 1k93 h SER 305 N 0.00 0.93 0.00 0.00 4.64 -0.77 -3.46 113.55 114.89 1k93 h SER 305 Ca 0.00 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1k93 h SER 305 Cb 0.59 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1k93 h SER 305 CO 0.00 1.19 0.00 0.61 -0.87 0.00 0.00 176.83 177.76 1k93 n GLY 306 N 0.07 1.42 3.78 -0.77 0.00 -1.22 -2.23 105.19 106.24 1k93 n GLY 306 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1k93 n GLY 306 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k93 s LEU 307 N 0.00 3.36 0.11 0.99 1.02 -1.26 -4.32 118.68 118.58 1k93 s LEU 307 Ca 0.00 1.90 -0.31 0.00 0.02 0.00 0.00 54.13 55.74 1k93 s LEU 307 Cb 0.00 -4.54 -0.07 0.00 0.02 0.00 0.00 46.19 41.60 1k93 s LEU 307 CO 0.00 -1.52 1.29 -0.69 0.02 0.00 0.00 176.35 175.45 1k93 s VAL 308 N -2.49 3.60 0.17 -1.59 1.01 -1.26 -4.90 120.40 114.94 1k93 s VAL 308 Ca 0.65 1.18 -0.24 0.00 0.00 0.00 0.00 61.98 63.56 1k93 s VAL 308 Cb -0.18 -3.76 0.05 0.00 0.00 0.00 0.00 36.38 32.49 1k93 s VAL 308 CO 0.43 0.11 1.58 -0.65 0.00 0.00 0.00 175.10 176.56 1k93 h PRO 309 N 6.51 -0.23 -0.61 2.72 0.11 -1.94 -0.85 132.00 137.70 1k93 h PRO 309 Ca -0.42 0.02 0.13 0.00 0.11 0.00 0.00 66.00 65.83 1k93 h PRO 309 Cb 1.21 0.05 -0.11 0.00 0.11 0.00 0.00 31.00 32.26 1k93 h PRO 309 CO 0.82 -0.15 -0.07 0.93 -0.21 0.00 0.00 178.00 179.32 1k93 h GLU 310 N -0.24 0.05 -0.26 1.05 3.07 -2.00 -2.04 114.58 114.21 1k93 h GLU 310 Ca 0.18 -0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.07 1k93 h GLU 310 Cb 0.56 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.43 1k93 h GLU 310 CO -0.64 0.04 0.09 0.45 -1.40 0.00 0.00 179.01 177.54 1k93 h HIS 311 N 0.06 0.15 0.00 4.33 3.86 -1.59 -1.88 115.15 120.08 1k93 h HIS 311 Ca 0.31 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.51 1k93 h HIS 311 Cb 0.49 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.93 1k93 h HIS 311 CO -0.43 0.07 -0.10 0.00 0.86 0.00 0.00 177.93 178.33 1k93 h ALA 312 N 1.17 1.82 -0.10 2.45 0.00 -0.59 -1.82 119.26 122.19 1k93 h ALA 312 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1k93 h ALA 312 Cb 0.09 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1k93 h ALA 312 CO -0.12 0.13 -0.07 -0.44 0.00 0.00 0.00 179.25 178.74 1k93 h ASP 313 N 0.00 0.23 -0.20 0.00 3.45 -0.86 -2.13 116.42 116.91 1k93 h ASP 313 Ca -0.00 -0.45 0.06 0.00 0.43 0.00 0.00 57.03 57.06 1k93 h ASP 313 Cb 0.18 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 38.88 1k93 h ASP 313 CO 0.01 0.63 0.16 0.00 -1.57 0.00 0.00 179.24 178.48 1k93 h ALA 314 N 0.60 2.02 0.00 3.45 0.00 -0.81 0.16 119.26 124.68 1k93 h ALA 314 Ca 0.02 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1k93 h ALA 314 Cb 0.56 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1k93 h ALA 314 CO 0.02 -0.26 -0.42 0.74 0.00 0.00 0.00 179.25 179.32 1k93 h PHE 315 N 0.00 0.00 -0.81 0.00 0.05 -0.98 -3.05 116.94 112.14 1k93 h PHE 315 Ca 0.09 0.00 0.01 0.00 3.82 0.00 0.00 57.97 61.89 1k93 h PHE 315 Cb 0.42 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 38.33 1k93 h PHE 315 CO 0.00 0.42 0.54 0.87 -0.18 0.00 0.00 178.31 179.96 1k93 h LYS 316 N 0.00 1.06 0.00 1.51 1.57 -0.03 -2.20 116.57 118.48 1k93 h LYS 316 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1k93 h LYS 316 Cb 1.20 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.27 1k93 h LYS 316 CO 0.06 0.70 0.00 1.17 -0.57 0.00 0.00 179.45 180.81 1k93 n LYS 317 N -4.41 0.00 -0.31 3.15 4.81 -1.15 -2.40 118.16 117.85 1k93 n LYS 317 Ca 0.09 0.51 0.27 0.00 -0.87 0.00 0.00 58.31 58.30 1k93 n LYS 317 Cb 0.03 -1.43 0.59 0.00 0.02 0.00 0.00 35.03 34.24 1k93 n LYS 317 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1k93 h ILE 318 N 0.00 0.50 0.84 3.15 5.03 -1.59 -0.12 117.51 125.32 1k93 h ILE 318 Ca 0.00 -0.09 -0.04 0.00 -0.12 0.00 0.00 64.86 64.61 1k93 h ILE 318 Cb 0.00 0.23 0.00 0.00 -3.03 0.00 0.00 36.82 34.02 1k93 h ILE 318 CO 0.00 0.05 -0.43 0.00 -0.68 0.00 0.00 178.15 177.08 1k93 h ALA 319 N 1.56 -1.18 0.04 1.87 0.00 -1.32 -1.70 119.26 118.53 1k93 h ALA 319 Ca 0.57 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 55.25 1k93 h ALA 319 Cb 1.72 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 19.95 1k93 h ALA 319 CO -0.19 -1.17 -0.38 -0.09 0.00 0.00 0.00 179.25 177.43 1k93 h ARG 320 N -1.16 -0.54 0.14 0.00 2.43 -0.81 0.37 114.38 114.81 1k93 h ARG 320 Ca -0.11 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1k93 h ARG 320 Cb 0.91 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.55 1k93 h ARG 320 CO 0.17 -0.36 -0.33 1.49 -1.51 0.00 0.00 179.97 179.42 1k93 h GLU 321 N -0.56 -0.50 0.00 0.20 4.81 -1.06 -2.02 114.58 115.45 1k93 h GLU 321 Ca 0.04 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1k93 h GLU 321 Cb 0.63 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.12 1k93 h GLU 321 CO -0.27 -0.34 0.00 1.28 -0.73 0.00 0.00 179.01 178.95 1k93 n LEU 322 N -4.36 0.00 -3.47 1.64 4.77 -0.64 -4.92 117.00 110.02 1k93 n LEU 322 Ca -0.06 0.35 -0.18 0.00 -0.03 0.00 0.00 56.01 56.09 1k93 n LEU 322 Cb 0.27 -0.35 0.02 0.00 -2.33 0.00 0.00 43.42 41.03 1k93 n LEU 322 CO 0.12 -0.11 0.03 -3.20 -1.33 0.00 0.00 177.39 172.90 1k93 n ASN 323 N -1.35 -6.14 -3.76 -1.43 4.05 0.12 -4.61 115.26 102.14 1k93 n ASN 323 Ca 0.08 -0.67 -0.12 0.00 0.45 0.00 0.00 54.58 54.32 1k93 n ASN 323 Cb 0.19 -3.75 -0.12 0.00 1.23 0.00 0.00 39.78 37.33 1k93 n ASN 323 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1k93 s THR 324 N -3.19 -0.01 0.10 -0.44 -1.32 -0.80 -2.36 115.64 107.62 1k93 s THR 324 Ca 0.21 0.04 -0.30 0.00 -1.21 0.00 0.00 61.69 60.43 1k93 s THR 324 Cb -0.07 -0.41 -0.06 0.00 -1.51 0.00 0.00 72.50 70.46 1k93 s THR 324 CO 0.82 0.02 1.12 -0.31 -2.21 0.00 0.00 174.62 174.06 1k93 s TYR 325 N 0.51 3.55 -0.25 9.09 1.51 0.29 -4.14 117.35 127.91 1k93 s TYR 325 Ca -0.03 1.50 -0.03 0.00 -1.01 0.00 0.00 57.07 57.50 1k93 s TYR 325 Cb -0.04 -3.30 0.02 0.00 -0.11 0.00 0.00 41.96 38.52 1k93 s TYR 325 CO -0.03 -0.76 -0.03 0.42 -1.11 0.00 0.00 175.55 174.04 1k93 s ILE 326 N 0.48 3.13 -0.24 2.71 1.01 0.19 -1.04 121.20 127.44 1k93 s ILE 326 Ca 0.53 -0.89 -0.04 0.00 0.00 0.00 0.00 60.65 60.26 1k93 s ILE 326 Cb -0.28 -2.57 0.00 0.00 0.01 0.00 0.00 42.46 39.62 1k93 s ILE 326 CO 0.31 0.21 -0.03 -0.76 0.00 0.00 0.00 174.94 174.67 1k93 s LEU 327 N 1.38 3.10 0.25 2.97 1.02 -0.83 -0.61 118.68 125.96 1k93 s LEU 327 Ca 0.01 -0.57 0.04 0.00 0.02 0.00 0.00 54.13 53.63 1k93 s LEU 327 Cb -0.16 -1.73 -0.03 0.00 0.02 0.00 0.00 46.19 44.28 1k93 s LEU 327 CO -0.03 -0.07 0.38 -0.36 0.02 0.00 0.00 176.35 176.29 1k93 s PHE 328 N 1.44 3.46 0.08 0.29 0.40 0.77 0.10 117.98 124.51 1k93 s PHE 328 Ca 0.04 0.03 0.00 0.00 -0.60 0.00 0.00 56.93 56.40 1k93 s PHE 328 Cb -0.15 -1.61 -0.04 0.00 0.51 0.00 0.00 43.02 41.72 1k93 s PHE 328 CO -0.03 0.40 0.23 1.03 0.70 0.00 0.00 175.22 177.55 1k93 s ARG 329 N -4.01 3.45 0.23 0.44 0.52 0.43 -1.70 118.95 118.31 1k93 s ARG 329 Ca 0.35 -0.45 -0.24 0.00 -0.52 0.00 0.00 55.73 54.87 1k93 s ARG 329 Cb -0.09 -3.02 -0.15 0.00 0.52 0.00 0.00 34.95 32.21 1k93 s ARG 329 CO 0.30 0.59 0.37 -2.30 0.02 0.00 0.00 175.30 174.28 1k93 n PRO 330 N 0.14 0.00 -4.57 3.54 -0.02 -1.25 -4.55 135.00 128.28 1k93 n PRO 330 Ca -0.05 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.12 1k93 n PRO 330 Cb 0.52 -0.90 -0.17 0.00 -0.02 0.00 0.00 33.50 32.93 1k93 n PRO 330 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1k93 s VAL 331 N -1.05 1.85 -0.49 -1.45 1.01 -0.95 -4.82 120.40 114.49 1k93 s VAL 331 Ca 0.57 -0.85 -0.46 0.00 0.00 0.00 0.00 61.98 61.24 1k93 s VAL 331 Cb -0.78 -1.66 -0.19 0.00 0.00 0.00 0.00 36.38 33.75 1k93 s VAL 331 CO 0.52 0.51 1.73 -3.20 0.00 0.00 0.00 175.10 174.66 1k93 n ASN 332 N 4.14 1.06 0.17 3.32 2.85 -1.26 -4.30 115.26 121.25 1k93 n ASN 332 Ca -0.20 1.03 0.13 0.00 -0.11 0.00 0.00 54.58 55.44 1k93 n ASN 332 Cb 0.51 -0.87 0.58 0.00 1.24 0.00 0.00 39.78 41.24 1k93 n ASN 332 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1k93 h LYS 333 N 6.08 0.00 -0.02 1.20 1.57 -1.93 0.27 116.57 123.75 1k93 h LYS 333 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 1k93 h LYS 333 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1k93 h LYS 333 CO 1.00 0.00 -0.02 1.28 -0.57 0.00 0.00 179.45 181.14 1k93 n LEU 334 N -2.44 1.96 -0.02 2.94 4.77 -1.26 -3.75 117.00 119.21 1k93 n LEU 334 Ca 0.01 -0.65 -0.07 0.00 -0.03 0.00 0.00 56.01 55.27 1k93 n LEU 334 Cb 0.20 -0.01 -0.13 0.00 -2.33 0.00 0.00 43.42 41.16 1k93 n LEU 334 CO 0.19 0.33 -0.57 0.00 -1.33 0.00 0.00 177.39 176.02 1k93 n ALA 335 N 0.50 1.60 -0.30 -1.18 0.00 0.08 -4.29 120.51 116.92 1k93 n ALA 335 Ca 0.17 -0.80 -0.04 0.00 0.00 0.00 0.00 53.44 52.77 1k93 n ALA 335 Cb 0.43 -0.78 0.01 0.00 0.00 0.00 0.00 19.45 19.11 1k93 n ALA 335 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1k93 h THR 336 N 0.00 0.06 0.00 0.00 2.02 -1.63 0.34 112.91 113.71 1k93 h THR 336 Ca -0.29 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.82 1k93 h THR 336 Cb 1.95 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 1k93 h THR 336 CO 0.06 0.00 -0.32 0.78 0.37 0.00 0.00 175.52 176.42 1k93 h ASN 337 N -0.09 0.00 -0.14 4.18 -0.26 -1.83 0.39 115.58 117.83 1k93 h ASN 337 Ca 0.27 0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.93 1k93 h ASN 337 Cb 0.56 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.82 1k93 h ASN 337 CO -0.84 0.32 -0.21 -0.07 -1.06 0.00 0.00 177.43 175.57 1k93 h LEU 338 N 0.00 0.43 -0.10 1.61 3.38 -0.95 0.10 115.31 119.78 1k93 h LEU 338 Ca -0.00 -0.52 0.02 0.00 0.09 0.00 0.00 57.88 57.47 1k93 h LEU 338 Cb 0.59 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1k93 h LEU 338 CO 0.04 0.87 -0.04 0.40 0.09 0.00 0.00 178.44 179.79 1k93 h ILE 339 N 0.00 0.85 -0.68 1.22 2.04 -0.11 -0.36 117.51 120.47 1k93 h ILE 339 Ca 0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.93 1k93 h ILE 339 Cb 0.77 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 1k93 h ILE 339 CO 0.05 0.00 0.40 0.50 0.00 0.00 0.00 178.15 179.09 1k93 h LYS 340 N -0.03 0.72 0.00 2.37 3.64 -0.84 0.38 116.57 122.80 1k93 h LYS 340 Ca 0.06 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1k93 h LYS 340 Cb 0.11 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1k93 h LYS 340 CO -0.12 0.48 0.00 -1.13 -2.27 0.00 0.00 179.45 176.40 1k93 n SER 341 N -4.75 0.00 0.00 4.20 3.41 0.35 -4.79 113.62 112.04 1k93 n SER 341 Ca 0.08 -0.62 0.00 0.00 -0.26 0.00 0.00 58.87 58.08 1k93 n SER 341 Cb 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1k93 n SER 341 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k93 n GLY 342 N -0.14 0.45 3.75 5.00 0.00 0.13 -4.94 105.19 109.44 1k93 n GLY 342 Ca 0.05 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 1k93 n GLY 342 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k93 s VAL 343 N -2.00 3.30 0.34 1.61 1.01 -0.19 -3.49 120.40 120.98 1k93 s VAL 343 Ca 0.00 1.24 -0.29 0.00 0.00 0.00 0.00 61.98 62.93 1k93 s VAL 343 Cb 0.00 -3.79 -0.11 0.00 0.00 0.00 0.00 36.38 32.48 1k93 s VAL 343 CO 0.00 0.27 1.47 0.00 0.00 0.00 0.00 175.10 176.83 1k93 s ALA 344 N -0.81 3.60 0.66 5.51 0.00 -1.25 -4.62 121.76 124.84 1k93 s ALA 344 Ca 0.48 1.49 -0.00 0.00 0.00 0.00 0.00 51.96 53.93 1k93 s ALA 344 Cb -0.34 -3.59 0.11 0.00 0.00 0.00 0.00 23.12 19.30 1k93 s ALA 344 CO 0.43 -0.94 0.75 0.25 0.00 0.00 0.00 175.76 176.25 1k93 n THR 345 N 1.00 0.00 -4.78 0.00 -2.24 -1.26 -1.79 114.28 105.20 1k93 n THR 345 Ca 0.03 -1.17 -0.33 0.00 -2.27 0.00 0.00 64.05 60.31 1k93 n THR 345 Cb 0.39 -1.03 -0.12 0.00 -2.10 0.00 0.00 70.33 67.47 1k93 n THR 345 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1k93 s LYS 346 N -4.43 2.58 0.33 -0.78 -2.85 -0.88 -4.61 119.74 109.09 1k93 s LYS 346 Ca 0.50 -0.65 0.01 0.00 -1.00 0.00 0.00 55.97 54.82 1k93 s LYS 346 Cb -0.03 -2.45 0.06 0.00 -2.06 0.00 0.00 37.83 33.36 1k93 s LYS 346 CO 0.33 0.64 0.45 0.41 0.10 0.00 0.00 175.35 177.28 1k93 n GLY 347 N 2.24 0.95 0.30 0.59 0.00 -1.26 -4.66 105.19 103.34 1k93 n GLY 347 Ca -0.17 -2.03 0.19 0.00 0.00 0.00 0.00 46.02 44.01 1k93 n GLY 347 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1k93 h LEU 348 N 0.00 0.00 0.00 0.99 3.38 -1.86 -1.72 115.31 116.10 1k93 h LEU 348 Ca -0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1k93 h LEU 348 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1k93 h LEU 348 CO 0.17 0.02 0.00 -0.46 0.09 0.00 0.00 178.44 178.26 1k93 n ASN 349 N -3.16 0.00 -3.77 -0.43 2.04 -1.26 -4.42 115.26 104.26 1k93 n ASN 349 Ca -0.01 -0.31 -0.25 0.00 -0.44 0.00 0.00 54.58 53.57 1k93 n ASN 349 Cb 0.20 -0.11 -0.17 0.00 -2.53 0.00 0.00 39.78 37.17 1k93 n ASN 349 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1k93 s VAL 350 N -2.22 0.51 -0.85 3.53 1.01 -0.65 -4.68 120.40 117.06 1k93 s VAL 350 Ca 0.22 -0.18 0.12 0.00 0.00 0.00 0.00 61.98 62.13 1k93 s VAL 350 Cb 0.11 -0.78 -0.06 0.00 0.00 0.00 0.00 36.38 35.66 1k93 s VAL 350 CO 0.22 0.10 0.61 1.41 0.00 0.00 0.00 175.10 177.43 1k93 n HIS 351 N 5.09 0.00 -1.87 5.22 8.25 -1.26 -4.67 115.22 125.97 1k93 n HIS 351 Ca -0.08 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.99 1k93 n HIS 351 Cb 0.49 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.63 1k93 n HIS 351 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1k93 s GLY 352 N -1.77 2.88 0.66 -1.41 0.00 -1.26 -4.98 107.32 101.43 1k93 s GLY 352 Ca 0.07 1.30 -0.10 0.00 0.00 0.00 0.00 44.72 45.99 1k93 s GLY 352 CO 0.37 1.83 1.04 0.54 0.00 0.00 0.00 173.10 176.89 1k93 s LYS 353 N -2.75 3.11 0.43 2.90 -0.14 -1.26 -4.97 119.74 117.06 1k93 s LYS 353 Ca 0.67 0.49 -0.01 0.00 -1.36 0.00 0.00 55.97 55.76 1k93 s LYS 353 Cb -0.39 -2.08 -0.02 0.00 -1.68 0.00 0.00 37.83 33.66 1k93 s LYS 353 CO 0.48 -0.83 0.66 -1.54 -0.76 0.00 0.00 175.35 173.36 1k93 s SER 354 N -4.29 6.03 0.48 2.83 1.04 -1.26 -4.15 113.70 114.38 1k93 s SER 354 Ca 0.56 0.46 -0.02 0.00 0.48 0.00 0.00 55.95 57.44 1k93 s SER 354 Cb -0.11 -1.81 -0.00 0.00 0.10 0.00 0.00 66.02 64.19 1k93 s SER 354 CO 0.51 -0.58 0.73 -0.55 0.98 0.00 0.00 173.24 174.34 1k93 s SER 355 N -4.15 5.83 0.00 7.02 0.15 -0.16 -2.09 113.70 120.30 1k93 s SER 355 Ca 0.46 0.46 0.06 0.00 0.70 0.00 0.00 55.95 57.63 1k93 s SER 355 Cb -0.10 -1.67 0.10 0.00 -1.71 0.00 0.00 66.02 62.64 1k93 s SER 355 CO 0.39 -0.76 1.02 -0.90 1.20 0.00 0.00 173.24 174.19 1k93 n ASP 356 N -2.21 0.22 -3.87 5.45 3.85 -1.26 -1.49 116.55 117.24 1k93 n ASP 356 Ca 0.02 -1.97 -0.08 0.00 -0.71 0.00 0.00 54.79 52.05 1k93 n ASP 356 Cb 0.57 -0.21 -0.03 0.00 -1.35 0.00 0.00 41.12 40.10 1k93 n ASP 356 CO 0.00 0.00 0.00 -1.66 -1.01 0.00 0.00 177.20 174.53 1k93 s TRP 357 N 0.00 -0.08 0.34 2.11 1.48 -1.26 -4.98 118.94 116.55 1k93 s TRP 357 Ca 0.08 -0.35 0.00 0.00 -1.06 0.00 0.00 56.10 54.77 1k93 s TRP 357 Cb 0.09 0.57 0.00 0.00 -1.16 0.00 0.00 33.47 32.97 1k93 s TRP 357 CO -0.04 -1.15 0.00 0.41 -4.06 0.00 0.00 176.95 172.11 1k93 n GLY 358 N -0.43 -1.95 0.35 3.67 0.00 -1.26 -2.74 105.19 102.83 1k93 n GLY 358 Ca -0.04 -1.17 0.18 0.00 0.00 0.00 0.00 46.02 44.99 1k93 n GLY 358 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k93 h PRO 359 N -1.28 0.00 -0.60 1.61 0.13 -1.95 -1.41 132.00 128.50 1k93 h PRO 359 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1k93 h PRO 359 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1k93 h PRO 359 CO 0.01 0.00 0.00 1.55 -0.23 0.00 0.00 178.00 179.33 1k93 n VAL 360 N -3.59 1.15 -1.65 1.56 3.14 -1.26 -4.97 118.33 112.72 1k93 n VAL 360 Ca 0.02 -0.84 -0.45 0.00 -2.96 0.00 0.00 64.34 60.12 1k93 n VAL 360 Cb 0.40 0.16 -0.02 0.00 -1.06 0.00 0.00 33.84 33.33 1k93 n VAL 360 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1k93 n ALA 361 N 0.94 0.68 0.00 1.55 0.00 -0.53 -1.95 120.51 121.20 1k93 n ALA 361 Ca 0.19 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.03 1k93 n ALA 361 Cb 0.62 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1k93 n ALA 361 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k93 n GLY 362 N 1.55 2.78 3.98 0.00 0.00 -0.55 -4.91 105.19 108.04 1k93 n GLY 362 Ca 0.10 -0.32 -0.25 0.00 0.00 0.00 0.00 46.02 45.54 1k93 n GLY 362 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k93 s TYR 363 N -1.61 1.60 -0.42 1.61 1.51 -0.82 -3.92 117.35 115.30 1k93 s TYR 363 Ca 0.00 -0.12 -0.09 0.00 -1.01 0.00 0.00 57.07 55.85 1k93 s TYR 363 Cb 0.00 -3.27 0.08 0.00 -0.11 0.00 0.00 41.96 38.66 1k93 s TYR 363 CO 0.00 -1.94 0.26 0.42 -1.11 0.00 0.00 175.55 173.18 1k93 s ILE 364 N -3.33 4.18 0.26 2.71 -1.09 -1.25 -0.99 121.20 121.70 1k93 s ILE 364 Ca 0.68 -1.44 -0.30 0.00 -2.23 0.00 0.00 60.65 57.37 1k93 s ILE 364 Cb -0.05 -3.58 -0.09 0.00 -1.58 0.00 0.00 42.46 37.16 1k93 s ILE 364 CO 0.46 -0.52 1.04 -2.16 -1.23 0.00 0.00 174.94 172.54 1k93 s PRO 365 N 1.41 4.72 0.11 2.79 0.04 -1.26 -0.28 135.00 142.53 1k93 s PRO 365 Ca 0.03 1.69 -0.22 0.00 0.04 0.00 0.00 61.00 62.54 1k93 s PRO 365 Cb -0.23 -3.22 -0.08 0.00 0.04 0.00 0.00 34.50 31.01 1k93 s PRO 365 CO 0.02 0.32 1.71 0.35 0.04 0.00 0.00 177.00 179.44 1k93 h PHE 366 N 3.95 -0.14 -2.11 0.56 3.57 -1.15 -3.32 116.94 118.30 1k93 h PHE 366 Ca -0.46 0.01 -0.52 0.00 3.53 0.00 0.00 57.97 60.53 1k93 h PHE 366 Cb 1.21 0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.96 1k93 h PHE 366 CO 0.60 -0.09 1.18 0.34 -2.23 0.00 0.00 178.31 178.10 1k93 s ASP 367 N -5.14 5.81 0.00 0.41 3.68 -1.26 -4.74 116.67 115.43 1k93 s ASP 367 Ca -0.14 -0.21 0.06 0.00 2.13 0.00 0.00 52.55 54.40 1k93 s ASP 367 Cb 0.08 -2.55 0.38 0.00 -1.45 0.00 0.00 42.92 39.38 1k93 s ASP 367 CO 0.67 -2.05 0.85 0.00 0.13 0.00 0.00 175.17 174.77 1k93 n GLN 368 N 9.27 0.19 0.00 4.34 1.13 -1.25 -1.51 117.38 129.55 1k93 n GLN 368 Ca 0.12 0.01 0.14 0.00 -1.94 0.00 0.00 57.00 55.33 1k93 n GLN 368 Cb 0.50 -1.50 0.65 0.00 0.11 0.00 0.00 30.24 30.01 1k93 n GLN 368 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1k93 n ASP 369 N -1.01 0.27 -0.72 1.08 2.03 -1.26 -2.30 116.55 114.63 1k93 n ASP 369 Ca 0.05 -0.35 0.12 0.00 0.52 0.00 0.00 54.79 55.13 1k93 n ASP 369 Cb 0.02 -0.16 0.20 0.00 -0.72 0.00 0.00 41.12 40.46 1k93 n ASP 369 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1k93 n LEU 370 N -1.13 2.35 0.00 -2.67 4.77 -0.57 -4.52 117.00 115.23 1k93 n LEU 370 Ca 0.14 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 1k93 n LEU 370 Cb 0.27 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1k93 n LEU 370 CO 0.24 0.40 0.00 -1.54 -1.33 0.00 0.00 177.39 175.16 1k93 n SER 371 N 0.70 0.00 0.09 -1.43 3.41 -0.97 -4.63 113.62 110.78 1k93 n SER 371 Ca 0.14 -0.99 0.12 0.00 -0.26 0.00 0.00 58.87 57.88 1k93 n SER 371 Cb 0.50 0.00 0.45 0.00 -0.26 0.00 0.00 64.21 64.91 1k93 n SER 371 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1k93 n LYS 372 N -0.99 0.18 -0.37 4.33 2.85 -0.89 -2.29 118.16 120.99 1k93 n LYS 372 Ca 0.00 0.25 0.04 0.00 -1.05 0.00 0.00 58.31 57.55 1k93 n LYS 372 Cb 0.00 -1.76 0.19 0.00 -0.65 0.00 0.00 35.03 32.82 1k93 n LYS 372 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1k93 n LYS 373 N -2.08 2.61 -1.49 -1.58 4.01 -1.26 -4.94 118.16 113.43 1k93 n LYS 373 Ca 0.05 -1.53 -0.40 0.00 -0.51 0.00 0.00 58.31 55.92 1k93 n LYS 373 Cb 0.34 -1.69 0.02 0.00 -0.51 0.00 0.00 35.03 33.19 1k93 n LYS 373 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 1k93 n HIS 374 N 0.42 -0.29 0.00 2.13 -0.00 -0.97 -2.17 115.22 114.34 1k93 n HIS 374 Ca 0.14 0.53 0.00 0.00 -0.00 0.00 0.00 57.72 58.39 1k93 n HIS 374 Cb 0.59 -2.01 0.00 0.00 -0.00 0.00 0.00 29.99 28.57 1k93 n HIS 374 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1k93 n GLY 375 N 1.68 2.13 3.12 1.57 0.00 -1.26 -4.91 105.19 107.52 1k93 n GLY 375 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1k93 n GLY 375 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1k93 n GLN 376 N 0.00 3.17 -0.17 1.61 6.02 -0.92 -4.89 117.38 122.20 1k93 n GLN 376 Ca 0.00 -3.15 0.09 0.00 -0.01 0.00 0.00 57.00 53.93 1k93 n GLN 376 Cb 0.00 -3.26 0.17 0.00 1.02 0.00 0.00 30.24 28.18 1k93 n GLN 376 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1k93 n GLN 377 N 6.36 -0.04 -0.09 -1.09 7.27 -1.26 0.75 117.38 129.29 1k93 n GLN 377 Ca 0.47 0.73 -0.12 0.00 0.07 0.00 0.00 57.00 58.15 1k93 n GLN 377 Cb 0.41 -1.19 -0.04 0.00 2.41 0.00 0.00 30.24 31.83 1k93 n GLN 377 CO 0.00 0.00 0.00 1.25 0.07 0.00 0.00 177.06 178.38 1k93 h LEU 378 N 0.00 0.49 -0.27 1.69 5.85 -1.96 -2.83 115.31 118.29 1k93 h LEU 378 Ca 0.32 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1k93 h LEU 378 Cb 0.71 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1k93 h LEU 378 CO -0.45 0.75 0.09 0.00 -0.34 0.00 0.00 178.44 178.49 1k93 h ALA 379 N 0.76 0.35 -0.60 1.25 0.00 -0.01 -2.26 119.26 118.76 1k93 h ALA 379 Ca 0.06 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 54.94 1k93 h ALA 379 Cb 0.53 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 1k93 h ALA 379 CO 0.03 -0.03 0.14 0.28 0.00 0.00 0.00 179.25 179.67 1k93 h VAL 380 N 0.27 0.67 -0.23 0.00 2.07 -1.29 0.69 116.25 118.43 1k93 h VAL 380 Ca 0.09 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1k93 h VAL 380 Cb 0.22 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1k93 h VAL 380 CO -0.00 0.05 0.06 -0.33 0.02 0.00 0.00 177.57 177.36 1k93 h GLU 381 N 0.28 0.15 -0.27 1.57 5.08 -1.23 1.12 114.58 121.28 1k93 h GLU 381 Ca 0.31 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.61 1k93 h GLU 381 Cb 0.45 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1k93 h GLU 381 CO -0.38 0.10 -0.04 -0.22 -1.00 0.00 0.00 179.01 177.47 1k93 h LYS 382 N 0.15 0.43 0.47 2.33 1.63 -0.91 0.12 116.57 120.79 1k93 h LYS 382 Ca 0.10 -0.09 -0.02 0.00 -0.85 0.00 0.00 60.65 59.79 1k93 h LYS 382 Cb 0.09 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 1k93 h LYS 382 CO -0.13 0.49 -0.23 0.78 -3.45 0.00 0.00 179.45 176.91 1k93 h GLY 383 N 0.79 -0.66 0.96 5.01 0.00 0.76 0.11 103.07 110.04 1k93 h GLY 383 Ca 0.09 0.25 0.02 0.00 0.00 0.00 0.00 47.33 47.68 1k93 h GLY 383 CO 0.01 -0.24 0.61 3.43 0.00 0.00 0.00 176.54 180.35 1k93 h ASN 384 N -0.84 1.03 -0.85 0.19 2.35 0.15 -0.75 115.58 116.87 1k93 h ASN 384 Ca -0.06 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1k93 h ASN 384 Cb 0.57 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.65 1k93 h ASN 384 CO 0.11 0.74 0.51 0.25 -1.65 0.00 0.00 177.43 177.39 1k93 h LEU 385 N 1.22 1.02 -0.23 1.61 7.12 -0.64 0.69 115.31 126.09 1k93 h LEU 385 Ca 0.35 -0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.30 1k93 h LEU 385 Cb -0.09 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 39.77 1k93 h LEU 385 CO -0.09 0.78 0.15 -0.33 -0.13 0.00 0.00 178.44 178.82 1k93 h GLU 386 N 1.18 0.31 -0.22 1.25 4.39 0.26 -0.00 114.58 121.75 1k93 h GLU 386 Ca 0.31 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.98 1k93 h GLU 386 Cb -0.05 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 1k93 h GLU 386 CO -0.06 0.24 0.12 -0.91 -1.16 0.00 0.00 179.01 177.23 1k93 h ASN 387 N 0.30 0.29 -0.61 1.42 2.35 -0.66 -0.22 115.58 118.45 1k93 h ASN 387 Ca 0.08 -0.10 0.13 0.00 -0.55 0.00 0.00 56.30 55.86 1k93 h ASN 387 Cb -0.00 -0.07 -0.11 0.00 0.05 0.00 0.00 38.32 38.18 1k93 h ASN 387 CO -0.02 0.31 -0.09 0.11 -1.65 0.00 0.00 177.43 176.10 1k93 h LYS 388 N 0.24 0.04 -0.16 0.81 6.56 -0.54 0.54 116.57 124.07 1k93 h LYS 388 Ca 0.08 -0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.64 1k93 h LYS 388 Cb 0.09 -0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 31.74 1k93 h LYS 388 CO -0.01 0.03 0.01 0.87 -2.06 0.00 0.00 179.45 178.28 1k93 h LYS 389 N 0.04 0.27 -0.71 3.15 1.57 -0.67 -2.94 116.57 117.29 1k93 h LYS 389 Ca 0.31 -0.08 0.16 0.00 -1.87 0.00 0.00 60.65 59.16 1k93 h LYS 389 Cb 0.48 -0.03 -0.11 0.00 0.08 0.00 0.00 32.23 32.66 1k93 h LYS 389 CO -0.59 0.49 0.12 0.77 -0.57 0.00 0.00 179.45 179.68 1k93 h SER 390 N 0.03 -0.08 0.27 0.86 0.02 0.79 0.28 113.55 115.72 1k93 h SER 390 Ca 0.05 0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 61.12 1k93 h SER 390 Cb 0.36 0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1k93 h SER 390 CO 0.01 -0.07 -0.13 0.40 -1.14 0.00 0.00 176.83 175.90 1k93 h ILE 391 N 0.22 0.74 0.00 3.27 1.08 -0.84 -3.22 117.51 118.76 1k93 h ILE 391 Ca 0.40 -0.52 -0.08 0.00 -0.39 0.00 0.00 64.86 64.27 1k93 h ILE 391 Cb 0.68 1.31 -0.01 0.00 -3.07 0.00 0.00 36.82 35.73 1k93 h ILE 391 CO -0.53 0.13 -1.06 0.35 -0.69 0.00 0.00 178.15 176.35 1k93 n THR 392 N -3.87 1.34 0.00 -0.27 -2.24 -0.19 -3.78 114.28 105.29 1k93 n THR 392 Ca -0.02 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1k93 n THR 392 Cb 0.23 -2.04 0.00 0.00 -2.10 0.00 0.00 70.33 66.41 1k93 n THR 392 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1k93 n GLU 393 N -4.11 0.00 -1.33 -0.78 1.02 0.80 -0.82 120.64 115.42 1k93 n GLU 393 Ca -0.17 0.03 0.01 0.00 -0.02 0.00 0.00 57.16 57.01 1k93 n GLU 393 Cb 0.47 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.38 1k93 n GLU 393 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1k93 n HIS 394 N -1.01 0.00 -1.35 -0.32 8.25 -1.21 -5.03 115.22 114.55 1k93 n HIS 394 Ca 0.00 -0.48 -0.51 0.00 -0.26 0.00 0.00 57.72 56.47 1k93 n HIS 394 Cb 0.00 0.04 -0.06 0.00 1.12 0.00 0.00 29.99 31.09 1k93 n HIS 394 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1k93 n GLU 395 N 0.35 0.00 0.00 -0.41 2.13 0.00 -0.16 120.64 122.55 1k93 n GLU 395 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 1k93 n GLU 395 Cb 1.01 -1.23 0.00 0.00 0.27 0.00 0.00 31.44 31.48 1k93 n GLU 395 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1k93 n GLY 396 N 1.52 2.57 0.12 8.31 0.00 -1.26 -4.75 105.19 111.71 1k93 n GLY 396 Ca 0.18 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1k93 n GLY 396 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1k93 n GLU 397 N 0.00 0.73 -4.60 1.61 4.07 0.78 -4.57 120.64 118.66 1k93 n GLU 397 Ca 0.00 0.28 -0.24 0.00 -0.06 0.00 0.00 57.16 57.14 1k93 n GLU 397 Cb 0.00 -1.74 -0.16 0.00 -0.06 0.00 0.00 31.44 29.48 1k93 n GLU 397 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1k93 s ILE 398 N -2.57 1.10 0.00 6.31 -1.09 -1.09 -1.56 121.20 122.30 1k93 s ILE 398 Ca -0.17 -0.51 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 1k93 s ILE 398 Cb 0.07 -0.98 0.00 0.00 -1.58 0.00 0.00 42.46 39.97 1k93 s ILE 398 CO 0.79 0.33 0.00 0.61 -1.23 0.00 0.00 174.94 175.44 1k93 n GLY 399 N 3.41 5.23 3.14 6.18 0.00 0.49 -4.48 105.19 119.15 1k93 n GLY 399 Ca -0.20 -1.35 -0.12 0.00 0.00 0.00 0.00 46.02 44.35 1k93 n GLY 399 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k93 s LYS 400 N 1.25 0.41 0.11 1.61 -2.85 -1.26 -0.08 119.74 118.94 1k93 s LYS 400 Ca 0.00 0.02 -0.03 0.00 -1.00 0.00 0.00 55.97 54.96 1k93 s LYS 400 Cb 0.00 0.19 -0.03 0.00 -2.06 0.00 0.00 37.83 35.93 1k93 s LYS 400 CO 0.00 -0.09 0.10 0.96 0.10 0.00 0.00 175.35 176.42 1k93 s ILE 401 N -0.58 0.13 0.47 3.79 -4.36 -0.54 -4.90 121.20 115.21 1k93 s ILE 401 Ca -0.07 -1.71 -0.24 0.00 -0.26 0.00 0.00 60.65 58.38 1k93 s ILE 401 Cb -0.04 -1.81 -0.07 0.00 1.25 0.00 0.00 42.46 41.79 1k93 s ILE 401 CO 0.01 -0.57 1.29 -2.84 0.24 0.00 0.00 174.94 173.07 1k93 s PRO 402 N -3.98 3.59 0.22 0.37 0.02 -1.26 -0.11 135.00 133.84 1k93 s PRO 402 Ca 0.17 2.08 -0.30 0.00 0.02 0.00 0.00 61.00 62.97 1k93 s PRO 402 Cb 0.06 -2.47 -0.08 0.00 0.02 0.00 0.00 34.50 32.03 1k93 s PRO 402 CO -0.03 -0.78 1.02 -1.17 -0.33 0.00 0.00 177.00 175.71 1k93 s LEU 403 N -3.01 4.57 -0.16 -5.54 2.96 -0.01 -4.78 118.68 112.70 1k93 s LEU 403 Ca 0.64 2.03 -0.00 0.00 -0.22 0.00 0.00 54.13 56.58 1k93 s LEU 403 Cb -0.36 -3.61 0.04 0.00 0.50 0.00 0.00 46.19 42.76 1k93 s LEU 403 CO 0.45 -0.03 -0.06 -0.54 -1.32 0.00 0.00 176.35 174.85 1k93 s LYS 404 N -0.89 1.50 -0.43 1.98 1.02 -1.26 -2.34 119.74 119.33 1k93 s LYS 404 Ca 0.44 -0.50 -0.15 0.00 0.02 0.00 0.00 55.97 55.78 1k93 s LYS 404 Cb -0.28 -1.97 0.03 0.00 -0.52 0.00 0.00 37.83 35.09 1k93 s LYS 404 CO 0.34 -0.40 0.34 -0.51 -0.92 0.00 0.00 175.35 174.20 1k93 s LEU 405 N 1.63 5.20 0.81 3.17 1.43 -0.88 -5.03 118.68 125.00 1k93 s LEU 405 Ca 0.01 -0.97 -0.11 0.00 -1.03 0.00 0.00 54.13 52.03 1k93 s LEU 405 Cb -0.15 -2.19 0.07 0.00 0.03 0.00 0.00 46.19 43.96 1k93 s LEU 405 CO -0.08 -0.51 1.09 1.51 0.23 0.00 0.00 176.35 178.59 1k93 s ASP 406 N 1.90 4.33 0.31 2.29 1.47 -1.26 -4.80 116.67 120.90 1k93 s ASP 406 Ca 0.06 1.53 0.06 0.00 1.18 0.00 0.00 52.55 55.38 1k93 s ASP 406 Cb -0.20 -2.26 0.83 0.00 -0.34 0.00 0.00 42.92 40.95 1k93 s ASP 406 CO 0.10 -2.10 1.66 0.45 0.68 0.00 0.00 175.17 175.95 1k93 h HIS 407 N -1.18 0.57 -0.22 2.11 3.86 -1.99 -1.81 115.15 116.49 1k93 h HIS 407 Ca -0.46 0.05 -0.06 0.00 -1.16 0.00 0.00 60.37 58.74 1k93 h HIS 407 Cb 1.25 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.61 1k93 h HIS 407 CO 0.50 -0.18 -0.08 -0.07 0.86 0.00 0.00 177.93 178.97 1k93 h LEU 408 N 0.27 0.46 -0.86 2.43 4.07 -2.00 -3.15 115.31 116.53 1k93 h LEU 408 Ca 0.61 -0.39 0.01 0.00 0.08 0.00 0.00 57.88 58.20 1k93 h LEU 408 Cb 1.28 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 42.85 1k93 h LEU 408 CO -0.63 0.74 0.57 -0.09 -1.08 0.00 0.00 178.44 177.95 1k93 h ARG 409 N 0.17 1.12 -0.93 1.13 9.65 -1.70 -0.15 114.38 123.67 1k93 h ARG 409 Ca 0.05 -0.07 0.14 0.00 -1.10 0.00 0.00 59.98 59.00 1k93 h ARG 409 Cb 0.55 -0.25 -0.08 0.00 -1.39 0.00 0.00 29.97 28.80 1k93 h ARG 409 CO 0.03 0.74 0.59 0.82 2.80 0.00 0.00 179.97 184.95 1k93 h ILE 410 N 1.15 0.86 0.10 1.20 1.08 -1.41 0.24 117.51 120.74 1k93 h ILE 410 Ca 0.32 -0.27 -0.27 0.00 -0.39 0.00 0.00 64.86 64.24 1k93 h ILE 410 Cb -0.12 -0.01 0.01 0.00 -3.07 0.00 0.00 36.82 33.63 1k93 h ILE 410 CO -0.07 0.15 -1.18 -0.33 -0.69 0.00 0.00 178.15 176.03 1k93 h GLU 411 N 0.80 0.37 -0.41 2.37 5.08 -1.20 0.64 114.58 122.22 1k93 h GLU 411 Ca 0.47 -0.54 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1k93 h GLU 411 Cb 0.64 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1k93 h GLU 411 CO -0.23 1.22 0.19 0.93 -1.00 0.00 0.00 179.01 180.13 1k93 h GLU 412 N 0.15 0.57 -0.14 2.33 5.08 0.23 0.18 114.58 122.99 1k93 h GLU 412 Ca -0.14 -0.06 -0.22 0.00 -1.00 0.00 0.00 59.36 57.94 1k93 h GLU 412 Cb 1.87 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 31.01 1k93 h GLU 412 CO 0.20 0.45 -0.78 -0.07 -1.00 0.00 0.00 179.01 177.81 1k93 h LEU 413 N 0.58 0.87 -1.05 1.33 3.38 -0.47 -1.67 115.31 118.28 1k93 h LEU 413 Ca 0.15 -0.57 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 1k93 h LEU 413 Cb 0.07 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1k93 h LEU 413 CO -0.02 1.37 0.16 0.50 0.09 0.00 0.00 178.44 180.53 1k93 h LYS 414 N 0.49 0.84 0.45 1.13 3.64 0.11 -1.05 116.57 122.18 1k93 h LYS 414 Ca -0.05 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.15 1k93 h LYS 414 Cb 1.40 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1k93 h LYS 414 CO 0.16 0.74 -0.22 0.93 -2.27 0.00 0.00 179.45 178.79 1k93 h GLU 415 N 0.81 -0.58 0.00 1.90 4.39 -0.54 -2.35 114.58 118.21 1k93 h GLU 415 Ca 0.18 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.92 1k93 h GLU 415 Cb 0.26 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1k93 h GLU 415 CO -0.01 -0.39 0.23 0.09 -1.16 0.00 0.00 179.01 177.78 1k93 n ASN 416 N -3.93 0.00 -3.32 1.42 5.03 -0.64 -4.74 115.26 109.08 1k93 n ASN 416 Ca -0.07 0.21 -0.16 0.00 0.87 0.00 0.00 54.58 55.42 1k93 n ASN 416 Cb 0.24 -0.21 0.08 0.00 -1.02 0.00 0.00 39.78 38.87 1k93 n ASN 416 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1k93 n GLY 417 N -1.18 -0.53 0.06 7.41 0.00 -0.74 -4.94 105.19 105.27 1k93 n GLY 417 Ca 0.00 0.20 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 1k93 n GLY 417 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1k93 n ILE 418 N -3.83 0.74 -3.70 -0.61 2.08 -0.48 -5.04 119.36 108.52 1k93 n ILE 418 Ca -0.23 -0.34 -0.14 0.00 0.56 0.00 0.00 62.75 62.59 1k93 n ILE 418 Cb 0.65 -0.88 -0.08 0.00 -0.75 0.00 0.00 39.64 38.58 1k93 n ILE 418 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 1k93 s ILE 419 N -2.26 0.04 -0.11 1.39 -4.36 -1.23 -4.19 121.20 110.48 1k93 s ILE 419 Ca -0.13 -0.35 0.03 0.00 -0.26 0.00 0.00 60.65 59.93 1k93 s ILE 419 Cb 0.04 -0.70 -0.01 0.00 1.25 0.00 0.00 42.46 43.04 1k93 s ILE 419 CO 0.35 -0.19 -0.20 -0.76 0.24 0.00 0.00 174.94 174.38 1k93 s LEU 420 N -1.25 2.34 -0.35 0.37 1.43 -0.93 -3.80 118.68 116.49 1k93 s LEU 420 Ca -0.13 -0.46 -0.29 0.00 -1.03 0.00 0.00 54.13 52.23 1k93 s LEU 420 Cb -0.04 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.69 1k93 s LEU 420 CO 0.05 0.17 1.56 -0.75 0.23 0.00 0.00 176.35 177.62 1k93 s LYS 421 N 0.28 3.55 0.00 1.70 2.47 -1.26 -1.04 119.74 125.44 1k93 s LYS 421 Ca -0.14 1.23 0.00 0.00 -1.56 0.00 0.00 55.97 55.49 1k93 s LYS 421 Cb -0.17 -4.07 0.00 0.00 -1.46 0.00 0.00 37.83 32.13 1k93 s LYS 421 CO 0.07 -1.59 0.00 0.41 0.16 0.00 0.00 175.35 174.40 1k93 n GLY 422 N 5.09 1.34 3.82 5.54 0.00 0.84 -4.96 105.19 116.85 1k93 n GLY 422 Ca 0.19 -1.71 -0.31 0.00 0.00 0.00 0.00 46.02 44.18 1k93 n GLY 422 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k93 s LYS 423 N 1.96 3.09 0.74 1.61 -2.85 -1.26 -4.43 119.74 118.60 1k93 s LYS 423 Ca 0.00 1.00 -0.11 0.00 -1.00 0.00 0.00 55.97 55.86 1k93 s LYS 423 Cb 0.00 -2.01 0.03 0.00 -2.06 0.00 0.00 37.83 33.79 1k93 s LYS 423 CO 0.00 -0.98 1.09 0.21 0.10 0.00 0.00 175.35 175.78 1k93 s LYS 424 N -4.79 2.60 -0.14 1.78 2.20 -1.26 -1.11 119.74 119.01 1k93 s LYS 424 Ca 0.59 0.56 -0.30 0.00 -0.36 0.00 0.00 55.97 56.47 1k93 s LYS 424 Cb -0.14 -1.98 0.10 0.00 -1.51 0.00 0.00 37.83 34.30 1k93 s LYS 424 CO 0.50 -1.24 0.86 -2.00 -0.36 0.00 0.00 175.35 173.11 1k93 s GLU 425 N -5.26 0.78 0.01 4.03 2.12 0.14 -4.86 118.70 115.65 1k93 s GLU 425 Ca 0.59 0.30 0.06 0.00 0.36 0.00 0.00 54.97 56.28 1k93 s GLU 425 Cb -0.12 0.37 -0.02 0.00 0.26 0.00 0.00 34.13 34.62 1k93 s GLU 425 CO 0.53 -0.22 -0.18 0.42 -0.54 0.00 0.00 175.26 175.26 1k93 s ILE 426 N -0.90 1.47 -0.07 -3.70 1.01 -1.26 -0.67 121.20 117.08 1k93 s ILE 426 Ca -0.05 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.65 1k93 s ILE 426 Cb -0.01 -1.25 0.04 0.00 0.01 0.00 0.00 42.46 41.25 1k93 s ILE 426 CO 0.04 0.31 0.17 -0.62 0.00 0.00 0.00 174.94 174.83 1k93 s ASP 427 N -0.71 -0.14 -1.50 3.58 3.68 -0.97 -4.89 116.67 115.71 1k93 s ASP 427 Ca 0.07 0.34 -0.00 0.00 2.13 0.00 0.00 52.55 55.09 1k93 s ASP 427 Cb -0.08 0.24 0.00 0.00 -1.45 0.00 0.00 42.92 41.64 1k93 s ASP 427 CO 0.00 -0.14 0.01 -3.20 0.13 0.00 0.00 175.17 171.97 1k93 n ASN 428 N 4.10 0.88 -1.56 -0.34 5.15 -1.26 -1.02 115.26 121.22 1k93 n ASN 428 Ca -0.25 -1.23 -0.14 0.00 -0.60 0.00 0.00 54.58 52.36 1k93 n ASN 428 Cb 0.53 -1.53 -0.01 0.00 -0.53 0.00 0.00 39.78 38.24 1k93 n ASN 428 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1k93 n GLY 429 N -2.50 -0.19 3.16 8.20 0.00 -1.26 -5.04 105.19 107.55 1k93 n GLY 429 Ca -0.31 -0.31 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 1k93 n GLY 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k93 s LYS 430 N -4.68 0.96 -0.22 1.61 -0.14 -0.18 -5.13 119.74 111.95 1k93 s LYS 430 Ca 0.00 -0.79 -0.13 0.00 -1.36 0.00 0.00 55.97 53.68 1k93 s LYS 430 Cb -0.00 -0.98 -0.04 0.00 -1.68 0.00 0.00 37.83 35.12 1k93 s LYS 430 CO 0.00 0.24 0.28 0.21 -0.76 0.00 0.00 175.35 175.32 1k93 s LYS 431 N -1.21 4.13 0.09 1.68 2.20 -1.26 -2.30 119.74 123.07 1k93 s LYS 431 Ca 0.02 -0.03 0.07 0.00 -0.36 0.00 0.00 55.97 55.67 1k93 s LYS 431 Cb -0.08 -3.53 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 1k93 s LYS 431 CO 0.01 0.02 -0.18 0.71 -0.36 0.00 0.00 175.35 175.55 1k93 s TYR 432 N 1.16 1.59 -0.10 4.03 1.51 0.16 -1.30 117.35 124.39 1k93 s TYR 432 Ca 0.13 -0.44 0.03 0.00 -1.01 0.00 0.00 57.07 55.78 1k93 s TYR 432 Cb -0.14 -0.87 -0.01 0.00 -0.11 0.00 0.00 41.96 40.83 1k93 s TYR 432 CO 0.06 0.16 -0.20 0.71 -1.11 0.00 0.00 175.55 175.17 1k93 s TYR 433 N -1.24 2.65 0.83 2.71 1.51 -0.54 -0.69 117.35 122.58 1k93 s TYR 433 Ca 0.04 -0.82 -0.11 0.00 -1.01 0.00 0.00 57.07 55.18 1k93 s TYR 433 Cb -0.10 -1.74 0.09 0.00 -0.11 0.00 0.00 41.96 40.10 1k93 s TYR 433 CO 0.04 -0.29 1.10 -0.51 -1.11 0.00 0.00 175.55 174.78 1k93 s LEU 434 N 0.23 2.81 -0.13 -1.29 1.02 -0.27 -0.68 118.68 120.38 1k93 s LEU 434 Ca -0.13 1.82 -0.02 0.00 0.02 0.00 0.00 54.13 55.82 1k93 s LEU 434 Cb -0.16 -4.40 0.04 0.00 0.02 0.00 0.00 46.19 41.69 1k93 s LEU 434 CO 0.07 -2.38 0.02 -0.76 0.02 0.00 0.00 176.35 173.32 1k93 s LEU 435 N -6.12 0.85 0.32 1.79 1.43 -0.92 -0.12 118.68 115.92 1k93 s LEU 435 Ca 0.63 -0.43 -0.04 0.00 -1.03 0.00 0.00 54.13 53.26 1k93 s LEU 435 Cb -0.18 -0.51 -0.05 0.00 0.03 0.00 0.00 46.19 45.48 1k93 s LEU 435 CO 0.57 -0.25 0.57 -1.61 0.23 0.00 0.00 176.35 175.87 1k93 s GLU 436 N 1.92 3.60 -0.02 1.70 0.41 -0.21 -3.88 118.70 122.22 1k93 s GLU 436 Ca 0.02 -0.04 -0.27 0.00 -0.41 0.00 0.00 54.97 54.28 1k93 s GLU 436 Cb -0.14 -2.62 0.06 0.00 -1.78 0.00 0.00 34.13 29.64 1k93 s GLU 436 CO -0.07 0.16 0.59 -1.54 -0.49 0.00 0.00 175.26 173.92 1k93 s SER 437 N -3.42 -0.54 0.00 -0.19 1.04 -1.26 -2.18 113.70 107.15 1k93 s SER 437 Ca 0.43 0.49 0.00 0.00 0.48 0.00 0.00 55.95 57.36 1k93 s SER 437 Cb -0.10 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1k93 s SER 437 CO 0.32 -0.62 0.60 -0.46 0.98 0.00 0.00 173.24 174.07 1k93 n ASN 438 N 0.82 1.69 -4.81 7.02 2.04 -1.26 -4.75 115.26 116.00 1k93 n ASN 438 Ca -0.19 -1.45 -0.36 0.00 -0.44 0.00 0.00 54.58 52.14 1k93 n ASN 438 Cb 0.58 -0.36 -0.06 0.00 -2.53 0.00 0.00 39.78 37.40 1k93 n ASN 438 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 1k93 s ASN 439 N 0.57 7.07 0.00 0.53 3.84 -1.26 -4.99 114.94 120.71 1k93 s ASN 439 Ca 0.00 1.44 0.11 0.00 0.21 0.00 0.00 52.86 54.62 1k93 s ASN 439 Cb 0.00 -2.43 -0.02 0.00 -0.55 0.00 0.00 41.25 38.25 1k93 s ASN 439 CO 0.00 0.03 0.63 0.00 -2.79 0.00 0.00 177.10 174.97 1k93 n GLN 440 N 0.73 2.23 -0.08 0.43 0.00 -1.26 -4.57 117.38 114.86 1k93 n GLN 440 Ca -0.02 -0.55 -0.12 0.00 0.00 0.00 0.00 57.00 56.31 1k93 n GLN 440 Cb 0.51 -1.09 -0.15 0.00 0.00 0.00 0.00 30.24 29.51 1k93 n GLN 440 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1k93 n VAL 441 N -0.37 1.50 -4.41 -0.39 0.31 -1.26 -4.83 118.33 108.88 1k93 n VAL 441 Ca 0.04 -0.77 -0.24 0.00 -0.01 0.00 0.00 64.34 63.36 1k93 n VAL 441 Cb 0.22 -0.90 -0.09 0.00 -0.91 0.00 0.00 33.84 32.15 1k93 n VAL 441 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1k93 s TYR 442 N -2.53 2.45 -0.04 3.52 1.51 -1.26 -1.51 117.35 119.49 1k93 s TYR 442 Ca -0.14 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 55.57 1k93 s TYR 442 Cb 0.07 -1.22 0.01 0.00 -0.11 0.00 0.00 41.96 40.71 1k93 s TYR 442 CO 0.78 0.62 -0.08 -2.00 -1.11 0.00 0.00 175.55 173.76 1k93 s GLU 443 N -3.61 0.99 0.31 -0.62 2.12 -0.38 -4.82 118.70 112.68 1k93 s GLU 443 Ca 0.32 -0.24 0.11 0.00 0.36 0.00 0.00 54.97 55.51 1k93 s GLU 443 Cb -0.03 -0.92 -0.06 0.00 0.26 0.00 0.00 34.13 33.38 1k93 s GLU 443 CO 0.17 0.03 -0.15 -0.06 -0.54 0.00 0.00 175.26 174.72 1k93 s PHE 444 N 0.50 2.32 0.10 5.30 0.40 -1.25 -1.44 117.98 123.91 1k93 s PHE 444 Ca -0.08 -0.43 -0.25 0.00 -0.60 0.00 0.00 56.93 55.58 1k93 s PHE 444 Cb -0.11 -1.17 0.07 0.00 0.51 0.00 0.00 43.02 42.32 1k93 s PHE 444 CO 0.01 0.63 0.63 -0.98 0.70 0.00 0.00 175.22 176.22 1k93 s ARG 445 N -3.57 1.20 0.11 0.44 1.70 -0.76 -2.16 118.95 115.93 1k93 s ARG 445 Ca 0.31 -0.30 0.09 0.00 -0.47 0.00 0.00 55.73 55.35 1k93 s ARG 445 Cb -0.01 0.56 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 1k93 s ARG 445 CO 0.15 -0.50 -0.21 -1.50 -1.08 0.00 0.00 175.30 172.16 1k93 s ILE 446 N -3.16 1.80 0.22 4.99 2.07 0.15 -0.12 121.20 127.15 1k93 s ILE 446 Ca -0.01 -1.62 -0.26 0.00 -1.41 0.00 0.00 60.65 57.35 1k93 s ILE 446 Cb -0.01 -1.65 -0.09 0.00 0.13 0.00 0.00 42.46 40.85 1k93 s ILE 446 CO -0.08 -0.07 0.85 -0.55 -1.91 0.00 0.00 174.94 173.18 1k93 s SER 447 N -2.02 7.43 0.09 4.50 0.15 0.15 -1.46 113.70 122.54 1k93 s SER 447 Ca 0.08 1.75 -0.10 0.00 0.70 0.00 0.00 55.95 58.39 1k93 s SER 447 Cb -0.10 -2.54 -0.20 0.00 -1.71 0.00 0.00 66.02 61.47 1k93 s SER 447 CO 0.05 0.13 1.20 -0.78 1.20 0.00 0.00 173.24 175.04 1k93 h ASP 448 N 3.99 0.72 0.15 5.45 1.82 -1.54 -2.31 116.42 124.69 1k93 h ASP 448 Ca -0.46 -0.62 -0.01 0.00 -0.39 0.00 0.00 57.03 55.55 1k93 h ASP 448 Cb 1.20 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 40.99 1k93 h ASP 448 CO 0.66 1.43 -0.07 -0.33 -1.61 0.00 0.00 179.24 179.32 1k93 h GLU 449 N 0.27 -0.19 -0.10 0.28 5.08 -1.94 -3.38 114.58 114.60 1k93 h GLU 449 Ca -0.13 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1k93 h GLU 449 Cb 1.74 0.04 0.00 0.00 0.50 0.00 0.00 28.75 31.04 1k93 h GLU 449 CO 0.20 -0.13 0.00 0.27 -1.00 0.00 0.00 179.01 178.35 1k93 n ASN 450 N -2.84 2.95 -2.71 1.42 0.23 -1.26 -4.98 115.26 108.07 1k93 n ASN 450 Ca -0.02 -1.93 -0.19 0.00 -0.53 0.00 0.00 54.58 51.90 1k93 n ASN 450 Cb 0.08 -0.05 0.04 0.00 -2.08 0.00 0.00 39.78 37.77 1k93 n ASN 450 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1k93 n ASN 451 N 1.27 -5.54 -4.69 0.53 3.02 -0.87 -4.87 115.26 104.11 1k93 n ASN 451 Ca 0.14 -0.29 -0.39 0.00 -0.03 0.00 0.00 54.58 54.01 1k93 n ASN 451 Cb 0.56 -4.33 -0.06 0.00 -0.61 0.00 0.00 39.78 35.34 1k93 n ASN 451 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1k93 s GLU 452 N -5.65 4.29 0.15 3.52 2.02 -1.26 -2.08 118.70 119.69 1k93 s GLU 452 Ca 0.31 0.59 -0.21 0.00 0.02 0.00 0.00 54.97 55.68 1k93 s GLU 452 Cb -0.14 -3.50 -0.08 0.00 0.10 0.00 0.00 34.13 30.51 1k93 s GLU 452 CO 0.38 -0.04 0.68 0.08 0.02 0.00 0.00 175.26 176.38 1k93 s VAL 453 N 1.25 4.57 0.25 2.63 1.01 -0.99 -0.67 120.40 128.44 1k93 s VAL 453 Ca 0.29 1.39 0.04 0.00 0.00 0.00 0.00 61.98 63.70 1k93 s VAL 453 Cb -0.16 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 1k93 s VAL 453 CO 0.12 0.44 -0.00 -1.10 0.00 0.00 0.00 175.10 174.56 1k93 s GLN 454 N -1.39 1.41 0.13 2.72 -0.21 0.83 -2.13 119.66 121.01 1k93 s GLN 454 Ca 0.35 -1.72 -0.06 0.00 0.02 0.00 0.00 55.36 53.95 1k93 s GLN 454 Cb -0.20 -0.71 -0.02 0.00 1.00 0.00 0.00 33.01 33.08 1k93 s GLN 454 CO 0.22 -0.09 0.17 1.52 -2.12 0.00 0.00 175.29 174.99 1k93 s TYR 455 N -3.36 0.47 0.08 0.91 -0.00 -0.05 -1.82 117.35 113.59 1k93 s TYR 455 Ca 0.30 -0.87 -0.20 0.00 -0.00 0.00 0.00 57.07 56.30 1k93 s TYR 455 Cb 0.06 -0.20 0.05 0.00 -0.00 0.00 0.00 41.96 41.87 1k93 s TYR 455 CO 0.10 -0.59 0.47 -1.59 -0.00 0.00 0.00 175.55 173.94 1k93 s LYS 456 N -3.96 1.06 0.61 -3.49 -2.85 -0.52 -1.66 119.74 108.92 1k93 s LYS 456 Ca 0.15 -0.43 -0.15 0.00 -1.00 0.00 0.00 55.97 54.54 1k93 s LYS 456 Cb 0.05 0.48 -0.03 0.00 -2.06 0.00 0.00 37.83 36.27 1k93 s LYS 456 CO -0.03 -0.40 1.05 0.95 0.10 0.00 0.00 175.35 177.02 1k93 s THR 457 N -3.03 3.88 0.38 3.79 -4.23 -0.94 -1.25 115.64 114.22 1k93 s THR 457 Ca -0.02 0.83 -0.06 0.00 -1.18 0.00 0.00 61.69 61.26 1k93 s THR 457 Cb 0.00 -3.40 -0.05 0.00 1.34 0.00 0.00 72.50 70.39 1k93 s THR 457 CO -0.06 -0.58 0.68 -0.54 -0.54 0.00 0.00 174.62 173.58 1k93 s LYS 458 N -4.26 3.65 0.08 3.99 1.02 -0.57 -4.77 119.74 118.88 1k93 s LYS 458 Ca 0.62 0.18 -0.34 0.00 0.02 0.00 0.00 55.97 56.46 1k93 s LYS 458 Cb -0.15 -2.50 -0.13 0.00 -0.52 0.00 0.00 37.83 34.53 1k93 s LYS 458 CO 0.40 0.03 1.69 -1.91 -0.92 0.00 0.00 175.35 174.65 1k93 n GLU 459 N -1.41 2.21 0.00 1.68 4.07 -1.26 -1.30 120.64 124.63 1k93 n GLU 459 Ca -0.00 0.80 0.00 0.00 -0.06 0.00 0.00 57.16 57.90 1k93 n GLU 459 Cb 0.54 -2.61 0.00 0.00 -0.06 0.00 0.00 31.44 29.32 1k93 n GLU 459 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1k93 n GLY 460 N 3.79 2.89 3.88 8.31 0.00 -1.26 -5.01 105.19 117.78 1k93 n GLY 460 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1k93 n GLY 460 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k93 s LYS 461 N -0.20 3.79 0.03 1.61 -0.14 -0.42 -5.11 119.74 119.30 1k93 s LYS 461 Ca 0.00 0.24 0.07 0.00 -1.36 0.00 0.00 55.97 54.92 1k93 s LYS 461 Cb 0.00 -2.66 -0.02 0.00 -1.68 0.00 0.00 37.83 33.47 1k93 s LYS 461 CO 0.00 0.32 -0.20 -1.50 -0.76 0.00 0.00 175.35 173.21 1k93 s ILE 462 N -1.82 1.61 1.06 2.17 1.10 -1.26 -4.63 121.20 119.44 1k93 s ILE 462 Ca 0.47 -1.11 -0.12 0.00 -0.51 0.00 0.00 60.65 59.38 1k93 s ILE 462 Cb -0.11 -1.39 0.23 0.00 0.15 0.00 0.00 42.46 41.34 1k93 s ILE 462 CO 0.22 0.25 1.07 -0.89 -2.11 0.00 0.00 174.94 173.47 1k93 s THR 463 N -0.72 2.12 0.42 4.00 2.01 -0.68 -4.78 115.64 118.01 1k93 s THR 463 Ca 0.07 0.04 0.11 0.00 0.31 0.00 0.00 61.69 62.22 1k93 s THR 463 Cb -0.08 -2.16 0.19 0.00 0.01 0.00 0.00 72.50 70.45 1k93 s THR 463 CO 0.01 -0.05 1.97 0.58 -0.69 0.00 0.00 174.62 176.45 1k93 h VAL 464 N -2.28 1.14 -0.26 3.82 2.07 -1.93 0.46 116.25 119.27 1k93 h VAL 464 Ca -0.55 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1k93 h VAL 464 Cb 1.31 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1k93 h VAL 464 CO 0.49 0.19 0.00 0.18 0.02 0.00 0.00 177.57 178.45 1k93 n LEU 465 N -4.33 2.62 -3.49 2.57 4.77 -1.26 -4.88 117.00 112.99 1k93 n LEU 465 Ca -0.01 -1.32 -0.19 0.00 -0.03 0.00 0.00 56.01 54.46 1k93 n LEU 465 Cb 0.23 -0.47 0.07 0.00 -2.33 0.00 0.00 43.42 40.91 1k93 n LEU 465 CO 0.37 0.41 0.03 0.61 -1.33 0.00 0.00 177.39 177.48 1k93 n GLY 466 N 0.47 -0.55 3.75 -0.72 0.00 0.16 -5.01 105.19 103.30 1k93 n GLY 466 Ca 0.11 0.23 -0.31 0.00 0.00 0.00 0.00 46.02 46.05 1k93 n GLY 466 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k93 s GLU 467 N -5.39 2.17 -0.25 1.61 2.02 -1.25 -4.73 118.70 112.86 1k93 s GLU 467 Ca 0.13 -2.30 -0.25 0.00 0.02 0.00 0.00 54.97 52.57 1k93 s GLU 467 Cb -0.02 -1.62 0.07 0.00 0.10 0.00 0.00 34.13 32.65 1k93 s GLU 467 CO 0.77 -0.33 0.70 -1.59 0.02 0.00 0.00 175.26 174.82 1k93 s LYS 468 N -3.89 0.83 0.02 1.61 -2.85 -1.26 -1.68 119.74 112.51 1k93 s LYS 468 Ca 0.14 0.94 -0.28 0.00 -1.00 0.00 0.00 55.97 55.78 1k93 s LYS 468 Cb 0.03 0.40 0.10 0.00 -2.06 0.00 0.00 37.83 36.30 1k93 s LYS 468 CO 0.08 -0.11 0.84 -0.59 0.10 0.00 0.00 175.35 175.67 1k93 s PHE 469 N 0.30 -0.38 0.00 1.78 -0.12 -1.26 -5.02 117.98 113.28 1k93 s PHE 469 Ca -0.00 0.23 0.00 0.00 -0.05 0.00 0.00 56.93 57.10 1k93 s PHE 469 Cb -0.05 0.54 0.00 0.00 -0.63 0.00 0.00 43.02 42.89 1k93 s PHE 469 CO 0.01 -0.60 0.00 -1.71 -0.05 0.00 0.00 175.22 172.87 1k93 n ASN 470 N -0.27 0.00 -4.78 1.98 5.15 -1.26 -2.22 115.26 113.86 1k93 n ASN 470 Ca -0.10 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.53 1k93 n ASN 470 Cb 0.62 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.87 1k93 n ASN 470 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1k93 s TRP 471 N 2.66 2.74 -0.29 1.20 0.52 -1.26 -4.07 118.94 120.44 1k93 s TRP 471 Ca 0.00 1.55 -0.20 0.00 0.02 0.00 0.00 56.10 57.47 1k93 s TRP 471 Cb 0.00 -3.24 0.15 0.00 -1.15 0.00 0.00 33.47 29.23 1k93 s TRP 471 CO 0.00 -1.42 1.07 -0.98 0.02 0.00 0.00 176.95 175.64 1k93 s ARG 472 N -3.31 0.36 0.59 4.98 1.70 -0.67 -4.93 118.95 117.68 1k93 s ARG 472 Ca 0.71 0.53 -0.18 0.00 -0.47 0.00 0.00 55.73 56.32 1k93 s ARG 472 Cb -0.22 0.12 -0.06 0.00 -0.57 0.00 0.00 34.95 34.23 1k93 s ARG 472 CO 0.26 -0.06 0.87 0.09 -1.08 0.00 0.00 175.30 175.38 1k93 n ASN 473 N 2.92 0.38 -4.60 -2.89 4.13 -1.26 -0.87 115.26 113.07 1k93 n ASN 473 Ca -0.15 0.79 -0.40 0.00 1.68 0.00 0.00 54.58 56.50 1k93 n ASN 473 Cb 0.57 -1.34 -0.08 0.00 -1.54 0.00 0.00 39.78 37.38 1k93 n ASN 473 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1k93 s ILE 474 N -1.56 5.10 0.02 2.41 1.01 -0.90 -4.75 121.20 122.54 1k93 s ILE 474 Ca 0.74 0.67 -0.09 0.00 0.00 0.00 0.00 60.65 61.97 1k93 s ILE 474 Cb -0.42 -3.80 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 1k93 s ILE 474 CO 0.49 0.07 0.33 -1.61 0.00 0.00 0.00 174.94 174.21 1k93 s GLU 475 N 2.22 3.69 0.09 2.79 2.02 -1.26 -0.83 118.70 127.42 1k93 s GLU 475 Ca 0.18 0.10 0.08 0.00 0.02 0.00 0.00 54.97 55.35 1k93 s GLU 475 Cb -0.16 -3.08 -0.03 0.00 0.10 0.00 0.00 34.13 30.96 1k93 s GLU 475 CO 0.10 0.64 -0.20 0.14 0.02 0.00 0.00 175.26 175.96 1k93 s VAL 476 N -1.27 1.62 0.16 2.63 -7.23 0.84 -0.59 120.40 116.57 1k93 s VAL 476 Ca 0.28 -1.44 -0.32 0.00 -1.81 0.00 0.00 61.98 58.69 1k93 s VAL 476 Cb -0.14 -1.47 -0.10 0.00 0.56 0.00 0.00 36.38 35.23 1k93 s VAL 476 CO 0.15 -0.03 1.59 -0.04 -0.31 0.00 0.00 175.10 176.46 1k93 s MET 477 N -1.73 4.21 0.24 4.82 1.00 0.61 -1.47 119.30 126.98 1k93 s MET 477 Ca 0.06 2.38 0.06 0.00 0.00 0.00 0.00 55.69 58.19 1k93 s MET 477 Cb -0.10 -3.17 -0.05 0.00 0.00 0.00 0.00 34.83 31.51 1k93 s MET 477 CO 0.03 -0.63 -0.07 0.00 0.00 0.00 0.00 175.02 174.36 1k93 s ALA 478 N 1.24 2.05 0.35 3.03 0.00 0.89 -2.20 121.76 127.12 1k93 s ALA 478 Ca 0.71 -1.78 0.09 0.00 0.00 0.00 0.00 51.96 50.98 1k93 s ALA 478 Cb -0.44 0.20 -0.07 0.00 0.00 0.00 0.00 23.12 22.81 1k93 s ALA 478 CO 0.31 -0.09 -0.09 -1.59 0.00 0.00 0.00 175.76 174.31 1k93 s LYS 479 N -3.75 1.82 -0.06 0.00 -2.85 -0.31 -0.38 119.74 114.20 1k93 s LYS 479 Ca 0.26 -1.94 -0.19 0.00 -1.00 0.00 0.00 55.97 53.10 1k93 s LYS 479 Cb 0.03 -1.67 -0.05 0.00 -2.06 0.00 0.00 37.83 34.08 1k93 s LYS 479 CO 0.09 0.12 0.51 1.21 0.10 0.00 0.00 175.35 177.38 1k93 s ASN 480 N -3.61 6.80 -0.30 0.03 3.84 -0.60 -0.47 114.94 120.63 1k93 s ASN 480 Ca 0.33 0.96 -0.01 0.00 0.21 0.00 0.00 52.86 54.34 1k93 s ASN 480 Cb 0.03 -2.31 0.13 0.00 -0.55 0.00 0.00 41.25 38.55 1k93 s ASN 480 CO 0.16 0.07 0.25 -0.69 -2.79 0.00 0.00 177.10 174.11 1k93 s VAL 481 N 0.13 -0.26 -1.04 -5.21 1.01 0.82 -4.86 120.40 110.99 1k93 s VAL 481 Ca 0.28 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.50 1k93 s VAL 481 Cb -0.16 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.26 1k93 s VAL 481 CO 0.13 -0.60 0.89 -0.62 0.00 0.00 0.00 175.10 174.90 1k93 n GLU 482 N 5.07 -5.94 -0.71 2.72 -0.58 -1.26 -2.66 120.64 117.28 1k93 n GLU 482 Ca -0.01 0.68 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 1k93 n GLU 482 Cb 0.44 -5.24 0.00 0.00 -0.57 0.00 0.00 31.44 26.07 1k93 n GLU 482 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1k93 n GLY 483 N -1.42 1.22 3.49 0.62 0.00 -1.26 -5.01 105.19 102.84 1k93 n GLY 483 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 1k93 n GLY 483 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1k93 s VAL 484 N -3.33 2.88 -0.31 1.61 -7.23 -1.09 -5.10 120.40 107.84 1k93 s VAL 484 Ca 0.00 -1.43 -0.22 0.00 -1.81 0.00 0.00 61.98 58.52 1k93 s VAL 484 Cb 0.00 -2.30 -0.00 0.00 0.56 0.00 0.00 36.38 34.63 1k93 s VAL 484 CO 0.00 0.14 0.71 -0.76 -0.31 0.00 0.00 175.10 174.88 1k93 s LEU 485 N -2.02 4.12 -0.11 1.32 1.02 -1.26 -0.12 118.68 121.62 1k93 s LEU 485 Ca 0.18 0.54 0.02 0.00 0.02 0.00 0.00 54.13 54.89 1k93 s LEU 485 Cb -0.11 -2.95 -0.01 0.00 0.02 0.00 0.00 46.19 43.15 1k93 s LEU 485 CO 0.10 -0.55 -0.19 -0.54 0.02 0.00 0.00 176.35 175.18 1k93 s LYS 486 N 2.78 3.19 0.46 1.70 1.02 0.38 -4.88 119.74 124.39 1k93 s LYS 486 Ca 0.29 -0.80 -0.23 0.00 0.02 0.00 0.00 55.97 55.25 1k93 s LYS 486 Cb -0.15 -2.44 -0.09 0.00 -0.52 0.00 0.00 37.83 34.63 1k93 s LYS 486 CO 0.12 0.19 0.96 -0.35 -0.92 0.00 0.00 175.35 175.35 1k93 n PRO 487 N 3.54 1.20 -3.92 -1.68 -0.04 -1.26 -1.17 135.00 131.67 1k93 n PRO 487 Ca -0.19 0.44 -0.21 0.00 -0.04 0.00 0.00 63.50 63.49 1k93 n PRO 487 Cb 0.53 -2.03 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 1k93 n PRO 487 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1k93 s LEU 488 N -0.67 3.68 0.36 1.53 1.43 -0.93 -3.93 118.68 120.14 1k93 s LEU 488 Ca 0.66 -0.40 -0.03 0.00 -1.03 0.00 0.00 54.13 53.33 1k93 s LEU 488 Cb -0.52 -2.27 0.01 0.00 0.03 0.00 0.00 46.19 43.44 1k93 s LEU 488 CO 0.55 -0.24 0.51 0.28 0.23 0.00 0.00 176.35 177.67 1k93 s THR 489 N -2.24 0.00 1.01 5.49 -1.32 -0.74 -3.83 115.64 114.01 1k93 s THR 489 Ca 0.38 -1.56 -0.13 0.00 -1.21 0.00 0.00 61.69 59.17 1k93 s THR 489 Cb -0.07 -2.69 0.12 0.00 -1.51 0.00 0.00 72.50 68.35 1k93 s THR 489 CO 0.26 0.00 0.61 0.00 -2.21 0.00 0.00 174.62 173.28 1k93 n ALA 490 N -0.58 -2.48 -4.34 11.08 0.00 -1.25 -2.08 120.51 120.86 1k93 n ALA 490 Ca 0.00 -0.81 -0.19 0.00 0.00 0.00 0.00 53.44 52.44 1k93 n ALA 490 Cb 0.61 -1.88 -0.04 0.00 0.00 0.00 0.00 19.45 18.14 1k93 n ALA 490 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1k93 n ASP 491 N -2.69 2.21 -4.58 0.00 3.85 -1.26 -4.27 116.55 109.80 1k93 n ASP 491 Ca 0.06 -2.40 -0.39 0.00 -0.71 0.00 0.00 54.79 51.36 1k93 n ASP 491 Cb 0.55 0.39 -0.11 0.00 -1.35 0.00 0.00 41.12 40.60 1k93 n ASP 491 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1k93 s TYR 492 N -2.30 3.22 -0.26 2.11 2.02 0.78 -4.91 117.35 118.01 1k93 s TYR 492 Ca 0.05 0.08 -0.10 0.00 -0.37 0.00 0.00 57.07 56.73 1k93 s TYR 492 Cb 0.00 -2.41 -0.05 0.00 -0.40 0.00 0.00 41.96 39.10 1k93 s TYR 492 CO 0.04 -0.20 0.16 -0.51 -1.57 0.00 0.00 175.55 173.46 1k93 s ASP 493 N 1.75 5.87 0.07 2.29 -0.00 -1.26 -4.46 116.67 120.92 1k93 s ASP 493 Ca 0.07 -0.02 -0.30 0.00 -0.00 0.00 0.00 52.55 52.30 1k93 s ASP 493 Cb -0.16 -2.08 -0.05 0.00 -0.00 0.00 0.00 42.92 40.63 1k93 s ASP 493 CO 0.11 -0.02 1.13 -0.76 -0.00 0.00 0.00 175.17 175.64 1k93 s LEU 494 N 1.54 4.39 -0.08 1.23 1.02 -1.26 -0.43 118.68 125.09 1k93 s LEU 494 Ca 0.07 1.95 -0.20 0.00 0.02 0.00 0.00 54.13 55.97 1k93 s LEU 494 Cb -0.15 -3.58 -0.29 0.00 0.02 0.00 0.00 46.19 42.19 1k93 s LEU 494 CO 0.08 -0.38 0.72 0.15 0.02 0.00 0.00 176.35 176.94 1k93 h PHE 495 N 6.52 0.45 -3.22 0.29 3.04 0.46 -0.89 116.94 123.59 1k93 h PHE 495 Ca -0.42 -0.33 0.02 0.00 3.98 0.00 0.00 57.97 61.22 1k93 h PHE 495 Cb 1.22 -0.02 -0.07 0.00 2.56 0.00 0.00 35.95 39.64 1k93 h PHE 495 CO 0.66 1.40 0.11 0.00 -2.02 0.00 0.00 178.31 178.46 1k93 s ALA 496 N -2.44 -0.92 -0.05 2.41 0.00 -0.72 -2.42 121.76 117.62 1k93 s ALA 496 Ca -0.17 -0.44 -0.02 0.00 0.00 0.00 0.00 51.96 51.33 1k93 s ALA 496 Cb 0.02 0.92 0.03 0.00 0.00 0.00 0.00 23.12 24.09 1k93 s ALA 496 CO 0.79 -0.95 0.09 -0.51 0.00 0.00 0.00 175.76 175.17 1k93 s LEU 497 N -2.94 0.29 -0.30 0.00 1.43 -1.26 -1.97 118.68 113.94 1k93 s LEU 497 Ca 0.14 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.41 1k93 s LEU 497 Cb -0.04 0.02 0.08 0.00 0.03 0.00 0.00 46.19 46.28 1k93 s LEU 497 CO 0.06 -0.22 0.01 0.00 0.23 0.00 0.00 176.35 176.43 1k93 s ALA 498 N 1.93 2.36 0.15 4.21 0.00 -0.21 -4.82 121.76 125.39 1k93 s ALA 498 Ca 0.01 -1.97 -0.03 0.00 0.00 0.00 0.00 51.96 49.97 1k93 s ALA 498 Cb -0.12 -1.72 -0.05 0.00 0.00 0.00 0.00 23.12 21.23 1k93 s ALA 498 CO -0.04 -1.49 0.37 -1.25 0.00 0.00 0.00 175.76 173.34 1k93 s PRO 499 N 1.19 3.57 0.38 0.00 0.04 -1.24 0.11 135.00 139.03 1k93 s PRO 499 Ca 0.04 -0.21 -0.25 0.00 0.04 0.00 0.00 61.00 60.62 1k93 s PRO 499 Cb -0.19 -2.86 -0.09 0.00 0.04 0.00 0.00 34.50 31.40 1k93 s PRO 499 CO -0.10 0.46 1.07 -1.54 0.04 0.00 0.00 177.00 176.93 1k93 s SER 500 N -2.69 6.81 0.23 6.66 1.04 -1.00 0.83 113.70 125.57 1k93 s SER 500 Ca 0.40 2.12 -0.14 0.00 0.48 0.00 0.00 55.95 58.81 1k93 s SER 500 Cb -0.12 -2.60 0.27 0.00 0.10 0.00 0.00 66.02 63.68 1k93 s SER 500 CO 0.27 -0.46 1.59 -0.07 0.98 0.00 0.00 173.24 175.55 1k93 h LEU 501 N 2.75 -0.91 -0.68 2.42 -0.00 -1.89 0.34 115.31 117.34 1k93 h LEU 501 Ca -0.48 0.24 0.14 0.00 -0.00 0.00 0.00 57.88 57.79 1k93 h LEU 501 Cb 1.22 0.54 -0.12 0.00 -0.00 0.00 0.00 40.66 42.29 1k93 h LEU 501 CO 0.63 -0.27 -0.08 0.71 -0.00 0.00 0.00 178.44 179.43 1k93 h THR 502 N -0.04 0.37 0.00 0.22 1.35 -1.92 0.83 112.91 113.72 1k93 h THR 502 Ca 0.34 -0.02 -0.00 0.00 -0.55 0.00 0.00 66.41 66.18 1k93 h THR 502 Cb 0.57 0.31 -0.00 0.00 -1.73 0.00 0.00 68.15 67.30 1k93 h THR 502 CO -0.80 0.01 -0.00 -0.08 -0.25 0.00 0.00 175.52 174.40 1k93 h GLU 503 N 0.05 0.00 0.03 4.72 4.57 -0.65 -1.02 114.58 122.28 1k93 h GLU 503 Ca 0.35 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 58.29 1k93 h GLU 503 Cb 0.57 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 1k93 h GLU 503 CO -0.65 0.00 -1.20 0.82 -1.18 0.00 0.00 179.01 176.81 1k93 h ILE 504 N 0.00 1.50 -0.44 2.32 2.04 0.14 -3.28 117.51 119.79 1k93 h ILE 504 Ca -0.00 -3.20 0.09 0.00 1.00 0.00 0.00 64.86 62.75 1k93 h ILE 504 Cb 0.01 2.79 -0.09 0.00 -0.74 0.00 0.00 36.82 38.79 1k93 h ILE 504 CO 0.00 0.87 -0.14 0.50 0.00 0.00 0.00 178.15 179.38 1k93 h LYS 505 N 0.02 -0.04 0.00 2.37 1.63 0.44 0.53 116.57 121.51 1k93 h LYS 505 Ca -0.09 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 1k93 h LYS 505 Cb 1.86 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.50 1k93 h LYS 505 CO 0.14 -0.03 0.02 1.63 -3.45 0.00 0.00 179.45 177.76 1k93 n LYS 506 N -5.35 0.00 -0.00 1.90 5.02 -1.14 0.11 118.16 118.70 1k93 n LYS 506 Ca 0.03 0.06 0.09 0.00 -2.02 0.00 0.00 58.31 56.47 1k93 n LYS 506 Cb 0.26 -1.52 -0.12 0.00 -0.02 0.00 0.00 35.03 33.63 1k93 n LYS 506 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1k93 n GLN 507 N -0.95 0.77 -3.34 1.97 -0.06 0.19 -4.93 117.38 111.02 1k93 n GLN 507 Ca 0.00 -0.08 -0.38 0.00 -2.00 0.00 0.00 57.00 54.54 1k93 n GLN 507 Cb 0.02 -1.40 -0.06 0.00 -4.06 0.00 0.00 30.24 24.74 1k93 n GLN 507 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 1k93 s ILE 508 N -2.99 4.90 0.02 1.69 1.01 0.31 -4.99 121.20 121.15 1k93 s ILE 508 Ca 0.01 1.07 -0.30 0.00 0.00 0.00 0.00 60.65 61.43 1k93 s ILE 508 Cb 0.13 -3.83 -0.07 0.00 0.01 0.00 0.00 42.46 38.70 1k93 s ILE 508 CO 0.77 0.52 1.63 -2.16 0.00 0.00 0.00 174.94 175.70 1k93 s PRO 509 N -0.80 4.20 0.00 2.79 0.04 -1.26 -4.84 135.00 135.13 1k93 s PRO 509 Ca 0.27 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.55 1k93 s PRO 509 Cb -0.18 -3.75 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1k93 s PRO 509 CO 0.16 -0.76 0.17 0.94 0.04 0.00 0.00 177.00 177.55 1k93 n GLN 510 N 6.17 0.10 0.00 4.56 -0.06 -1.26 -1.03 117.38 125.85 1k93 n GLN 510 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.16 1k93 n GLN 510 Cb 0.42 -1.45 0.00 0.00 -4.06 0.00 0.00 30.24 25.14 1k93 n GLN 510 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1k93 n LYS 511 N 1.75 2.62 0.01 3.69 5.02 -1.26 -4.50 118.16 125.48 1k93 n LYS 511 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1k93 n LYS 511 Cb 0.05 -0.30 -0.14 0.00 -0.02 0.00 0.00 35.03 34.62 1k93 n LYS 511 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1k93 h GLU 512 N 0.00 0.21 -0.19 1.97 5.08 -1.47 0.17 114.58 120.36 1k93 h GLU 512 Ca 0.00 -0.37 -0.13 0.00 -1.00 0.00 0.00 59.36 57.87 1k93 h GLU 512 Cb 0.00 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1k93 h GLU 512 CO 0.00 1.05 -0.43 2.35 -1.00 0.00 0.00 179.01 180.98 1k93 h TRP 513 N 0.06 0.54 -0.02 4.33 7.01 -1.62 -2.94 115.95 123.31 1k93 h TRP 513 Ca -0.37 -0.16 -0.02 0.00 2.11 0.00 0.00 58.89 60.46 1k93 h TRP 513 Cb 2.03 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 28.98 1k93 h TRP 513 CO 0.06 0.81 -0.05 -0.44 -2.79 0.00 0.00 178.44 176.03 1k93 h ASP 514 N 0.37 0.08 0.00 2.65 3.45 -1.78 -1.32 116.42 119.87 1k93 h ASP 514 Ca 0.03 -0.57 0.00 0.00 0.43 0.00 0.00 57.03 56.92 1k93 h ASP 514 Cb 0.91 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.65 1k93 h ASP 514 CO 0.08 0.63 0.17 1.17 -1.57 0.00 0.00 179.24 179.72 1k93 n LYS 515 N -4.75 0.03 -0.06 3.56 4.81 0.05 -1.38 118.16 120.42 1k93 n LYS 515 Ca -0.08 0.43 -0.10 0.00 -0.87 0.00 0.00 58.31 57.68 1k93 n LYS 515 Cb 0.31 -1.78 -0.05 0.00 0.02 0.00 0.00 35.03 33.53 1k93 n LYS 515 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1k93 n VAL 516 N -1.59 0.70 0.22 3.15 0.31 -1.12 -4.58 118.33 115.42 1k93 n VAL 516 Ca -0.00 -0.24 0.06 0.00 -0.01 0.00 0.00 64.34 64.15 1k93 n VAL 516 Cb 0.18 -1.17 0.50 0.00 -0.91 0.00 0.00 33.84 32.43 1k93 n VAL 516 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 1k93 h VAL 517 N -0.15 1.02 -2.91 2.52 3.04 -0.83 -3.27 116.25 115.66 1k93 h VAL 517 Ca -0.29 -0.89 -0.79 0.00 -1.01 0.00 0.00 66.70 63.72 1k93 h VAL 517 Cb 1.38 1.50 -0.26 0.00 -2.01 0.00 0.00 31.29 31.90 1k93 h VAL 517 CO -0.09 0.24 0.86 0.59 -1.01 0.00 0.00 177.57 178.15 1k93 n ASN 518 N -4.02 5.83 -3.95 3.17 5.03 -0.48 -4.97 115.26 115.87 1k93 n ASN 518 Ca -0.02 -3.20 -0.12 0.00 0.87 0.00 0.00 54.58 52.12 1k93 n ASN 518 Cb 0.32 -1.36 -0.07 0.00 -1.02 0.00 0.00 39.78 37.64 1k93 n ASN 518 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1k93 s THR 519 N -1.45 0.00 0.00 3.41 -1.32 -1.23 -4.85 115.64 110.19 1k93 s THR 519 Ca 0.33 -1.73 0.00 0.00 -1.21 0.00 0.00 61.69 59.08 1k93 s THR 519 Cb -0.01 -2.41 0.00 0.00 -1.51 0.00 0.00 72.50 68.57 1k93 s THR 519 CO 0.02 0.00 0.02 -0.81 -2.21 0.00 0.00 174.62 171.64 1k93 n PRO 520 N -0.37 0.00 -1.56 7.08 -0.04 -1.26 -4.92 135.00 133.93 1k93 n PRO 520 Ca 0.01 0.00 -0.47 0.00 -0.04 0.00 0.00 63.50 63.00 1k93 n PRO 520 Cb 0.64 -0.21 -0.03 0.00 -0.04 0.00 0.00 33.50 33.86 1k93 n PRO 520 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1k93 n ASN 521 N -0.11 0.97 0.04 3.54 3.02 -1.26 -4.88 115.26 116.58 1k93 n ASN 521 Ca 0.00 1.16 -0.09 0.00 -0.03 0.00 0.00 54.58 55.61 1k93 n ASN 521 Cb 0.00 -1.21 0.05 0.00 -0.61 0.00 0.00 39.78 38.01 1k93 n ASN 521 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1k93 h SER 522 N 2.49 0.53 -0.49 6.41 4.64 -2.00 -2.83 113.55 122.30 1k93 h SER 522 Ca -0.40 -0.32 -0.12 0.00 -0.47 0.00 0.00 61.79 60.49 1k93 h SER 522 Cb 1.36 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 1k93 h SER 522 CO 0.64 1.04 -0.14 0.25 -0.87 0.00 0.00 176.83 177.75 1k93 h LEU 523 N 0.33 0.99 -1.71 5.97 5.85 -2.01 -1.70 115.31 123.04 1k93 h LEU 523 Ca -0.01 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 1k93 h LEU 523 Cb 1.21 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 1k93 h LEU 523 CO 0.12 1.12 -0.17 -0.08 -0.34 0.00 0.00 178.44 179.09 1k93 h GLU 524 N 0.87 0.00 0.19 1.25 4.57 -1.92 -2.60 114.58 116.94 1k93 h GLU 524 Ca 0.13 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 1k93 h GLU 524 Cb 0.71 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.30 1k93 h GLU 524 CO 0.05 0.17 -0.09 -0.22 -1.18 0.00 0.00 179.01 177.74 1k93 h LYS 525 N 0.00 -0.25 0.35 1.92 3.64 -1.08 -2.99 116.57 118.17 1k93 h LYS 525 Ca -0.00 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1k93 h LYS 525 Cb 0.32 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1k93 h LYS 525 CO 0.02 0.15 -0.35 0.37 -2.27 0.00 0.00 179.45 177.38 1k93 h GLN 526 N -0.81 -0.70 0.00 1.90 4.15 -1.31 0.22 115.11 118.56 1k93 h GLN 526 Ca -0.03 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1k93 h GLN 526 Cb 0.52 0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.37 1k93 h GLN 526 CO 0.04 -0.47 0.25 1.17 -1.93 0.00 0.00 178.83 177.90 1k93 n LYS 527 N -5.46 0.09 -0.08 1.69 4.81 -0.99 -0.03 118.16 118.19 1k93 n LYS 527 Ca -0.10 0.56 -0.11 0.00 -0.87 0.00 0.00 58.31 57.79 1k93 n LYS 527 Cb 0.36 -2.05 -0.15 0.00 0.02 0.00 0.00 35.03 33.21 1k93 n LYS 527 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1k93 n GLY 528 N -1.28 -0.89 0.20 3.14 0.00 -0.12 -2.78 105.19 103.47 1k93 n GLY 528 Ca -0.01 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.60 1k93 n GLY 528 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1k93 h VAL 529 N 0.00 1.31 0.54 1.61 2.07 0.10 -2.43 116.25 119.46 1k93 h VAL 529 Ca -0.50 -1.76 -0.02 0.00 0.82 0.00 0.00 66.70 65.24 1k93 h VAL 529 Cb 2.14 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 33.81 1k93 h VAL 529 CO 0.03 0.55 -0.38 0.74 0.02 0.00 0.00 177.57 178.53 1k93 h THR 530 N 0.39 0.00 0.00 2.57 2.02 -0.61 -0.25 112.91 117.02 1k93 h THR 530 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1k93 h THR 530 Cb 1.15 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 1k93 h THR 530 CO 0.11 0.00 0.07 0.78 0.37 0.00 0.00 175.52 176.85 1k93 h ASN 531 N -0.88 0.00 0.15 4.18 2.35 -1.57 0.68 115.58 120.49 1k93 h ASN 531 Ca -0.07 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.48 1k93 h ASN 531 Cb 0.72 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.11 1k93 h ASN 531 CO 0.04 0.00 -0.88 -0.07 -1.65 0.00 0.00 177.43 174.88 1k93 h LEU 532 N 0.00 0.49 0.13 1.61 3.38 -0.86 -1.25 115.31 118.81 1k93 h LEU 532 Ca 0.00 -0.95 0.01 0.00 0.09 0.00 0.00 57.88 57.03 1k93 h LEU 532 Cb 0.14 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 1k93 h LEU 532 CO 0.00 1.42 -0.50 0.25 0.09 0.00 0.00 178.44 179.71 1k93 h LEU 533 N -0.34 -1.49 -1.53 1.67 6.46 0.84 0.24 115.31 121.17 1k93 h LEU 533 Ca -0.16 0.15 0.21 0.00 -0.12 0.00 0.00 57.88 57.97 1k93 h LEU 533 Cb 1.68 0.55 -0.07 0.00 -0.73 0.00 0.00 40.66 42.09 1k93 h LEU 533 CO 0.16 -0.53 0.61 0.40 -0.62 0.00 0.00 178.44 178.46 1k93 h ILE 534 N -0.72 0.65 -0.34 4.05 2.04 -1.27 0.56 117.51 122.48 1k93 h ILE 534 Ca -0.01 -0.13 -0.11 0.00 1.00 0.00 0.00 64.86 65.61 1k93 h ILE 534 Cb 0.72 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1k93 h ILE 534 CO -0.26 0.07 -0.22 0.50 0.00 0.00 0.00 178.15 178.24 1k93 h LYS 535 N 0.38 0.75 0.00 2.37 3.11 0.58 -0.35 116.57 123.42 1k93 h LYS 535 Ca 0.48 -0.35 -0.07 0.00 -2.81 0.00 0.00 60.65 57.90 1k93 h LYS 535 Cb 1.25 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 32.45 1k93 h LYS 535 CO -0.18 0.97 -1.61 0.66 -2.81 0.00 0.00 179.45 176.48 1k93 n TYR 536 N -4.27 0.00 -0.11 1.91 4.01 0.40 -4.63 117.16 114.46 1k93 n TYR 536 Ca -0.03 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.53 1k93 n TYR 536 Cb 0.43 -0.37 -0.06 0.00 -0.31 0.00 0.00 39.34 39.03 1k93 n TYR 536 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1k93 n GLY 537 N 2.02 -0.50 0.16 2.72 0.00 0.19 -4.62 105.19 105.16 1k93 n GLY 537 Ca -0.08 -0.25 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 1k93 n GLY 537 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1k93 h ILE 538 N -1.00 0.72 -3.02 -0.61 2.04 -1.59 -3.47 117.51 110.59 1k93 h ILE 538 Ca -0.31 -0.91 -0.58 0.00 1.00 0.00 0.00 64.86 64.05 1k93 h ILE 538 Cb 1.27 1.16 0.16 0.00 -0.74 0.00 0.00 36.82 38.67 1k93 h ILE 538 CO -0.19 0.17 -0.24 1.21 0.00 0.00 0.00 178.15 179.10 1k93 n GLU 539 N -5.01 0.67 -3.89 2.37 2.13 -0.14 -4.98 120.64 111.79 1k93 n GLU 539 Ca -0.08 0.26 -0.11 0.00 0.66 0.00 0.00 57.16 57.89 1k93 n GLU 539 Cb 0.26 -1.80 -0.11 0.00 0.27 0.00 0.00 31.44 30.06 1k93 n GLU 539 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1k93 s ARG 540 N -2.15 0.36 0.04 5.31 0.52 -1.26 -4.41 118.95 117.37 1k93 s ARG 540 Ca 0.69 -0.35 0.01 0.00 -0.52 0.00 0.00 55.73 55.56 1k93 s ARG 540 Cb -0.47 0.15 -0.02 0.00 0.52 0.00 0.00 34.95 35.12 1k93 s ARG 540 CO 0.54 -0.08 -0.05 0.15 0.02 0.00 0.00 175.30 175.88 1k93 s LYS 541 N -1.11 0.46 0.12 3.54 1.02 -0.69 -4.90 119.74 118.18 1k93 s LYS 541 Ca -0.12 -0.77 -0.31 0.00 0.02 0.00 0.00 55.97 54.79 1k93 s LYS 541 Cb -0.07 -0.07 -0.07 0.00 -0.52 0.00 0.00 37.83 37.10 1k93 s LYS 541 CO 0.01 -0.01 1.27 -1.25 -0.92 0.00 0.00 175.35 174.45 1k93 s PRO 542 N -1.87 4.41 0.16 -1.68 0.04 -1.26 -1.79 135.00 133.00 1k93 s PRO 542 Ca -0.10 1.92 0.08 0.00 0.04 0.00 0.00 61.00 62.95 1k93 s PRO 542 Cb -0.08 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 31.15 1k93 s PRO 542 CO -0.01 -0.27 -0.08 0.34 0.04 0.00 0.00 177.00 177.01 1k93 s ASP 543 N 0.76 4.37 0.09 6.66 2.15 -0.40 -4.93 116.67 125.38 1k93 s ASP 543 Ca 0.59 -0.49 -0.23 0.00 0.43 0.00 0.00 52.55 52.84 1k93 s ASP 543 Cb -0.33 -0.80 -0.08 0.00 -0.30 0.00 0.00 42.92 41.41 1k93 s ASP 543 CO 0.32 0.12 1.38 0.77 -0.17 0.00 0.00 175.17 177.60 1k93 h SER 544 N 3.08 -1.33 0.00 -0.34 4.64 -1.96 -3.13 113.55 114.50 1k93 h SER 544 Ca -0.47 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1k93 h SER 544 Cb 1.19 0.55 0.00 0.00 -0.31 0.00 0.00 62.40 63.83 1k93 h SER 544 CO 0.54 -0.27 -0.93 0.35 -0.87 0.00 0.00 176.83 175.64 1k93 n THR 545 N -4.58 0.00 0.51 2.95 -2.24 -1.26 -4.52 114.28 105.13 1k93 n THR 545 Ca -0.02 -0.23 0.07 0.00 -2.27 0.00 0.00 64.05 61.59 1k93 n THR 545 Cb 0.24 0.60 0.20 0.00 -2.10 0.00 0.00 70.33 69.27 1k93 n THR 545 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1k93 n LYS 546 N -1.52 2.17 0.00 -0.78 5.02 -1.26 -4.60 118.16 117.20 1k93 n LYS 546 Ca -0.00 -1.63 0.00 0.00 -2.02 0.00 0.00 58.31 54.66 1k93 n LYS 546 Cb 0.16 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 1k93 n LYS 546 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k93 n GLY 547 N 1.12 0.88 3.65 0.72 0.00 -1.18 -0.63 105.19 109.74 1k93 n GLY 547 Ca 0.15 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 1k93 n GLY 547 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k93 s THR 548 N 0.00 4.50 0.20 2.61 2.01 -1.26 -1.28 115.64 122.43 1k93 s THR 548 Ca 0.00 1.77 -0.13 0.00 0.31 0.00 0.00 61.69 63.64 1k93 s THR 548 Cb 0.00 -4.32 0.00 0.00 0.01 0.00 0.00 72.50 68.19 1k93 s THR 548 CO 0.00 -0.36 0.42 -1.48 -0.69 0.00 0.00 174.62 172.51 1k93 s LEU 549 N 3.57 0.49 0.76 4.42 0.05 -0.74 -4.50 118.68 122.74 1k93 s LEU 549 Ca 0.47 -0.78 -0.01 0.00 0.05 0.00 0.00 54.13 53.86 1k93 s LEU 549 Cb -0.14 1.65 0.15 0.00 -2.05 0.00 0.00 46.19 45.80 1k93 s LEU 549 CO 0.13 -1.02 1.05 -0.94 -0.55 0.00 0.00 176.35 175.01 1k93 s SER 550 N -2.96 4.10 0.05 1.48 1.04 -1.26 -1.70 113.70 114.45 1k93 s SER 550 Ca 0.17 -0.48 -0.12 0.00 0.48 0.00 0.00 55.95 55.99 1k93 s SER 550 Cb 0.01 0.23 -0.32 0.00 0.10 0.00 0.00 66.02 66.04 1k93 s SER 550 CO 0.02 -2.05 1.07 0.78 0.98 0.00 0.00 173.24 174.04 1k93 h ASN 551 N -0.67 0.74 0.34 7.02 2.35 -1.87 -2.31 115.58 121.17 1k93 h ASN 551 Ca -0.35 -0.76 -0.04 0.00 -0.55 0.00 0.00 56.30 54.61 1k93 h ASN 551 Cb 1.26 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 1k93 h ASN 551 CO 0.36 1.59 -0.17 4.11 -1.65 0.00 0.00 177.43 181.67 1k93 h TRP 552 N 0.16 0.00 -0.19 1.19 5.08 -1.95 -1.77 115.95 118.46 1k93 h TRP 552 Ca -0.21 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 59.60 1k93 h TRP 552 Cb 2.06 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 28.22 1k93 h TRP 552 CO 0.11 0.17 -0.52 1.96 -1.28 0.00 0.00 178.44 178.87 1k93 h GLN 553 N 0.00 0.70 -0.95 0.12 4.20 -1.93 -1.17 115.11 116.08 1k93 h GLN 553 Ca -0.00 -0.49 0.05 0.00 0.06 0.00 0.00 58.65 58.27 1k93 h GLN 553 Cb 0.39 0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.18 1k93 h GLN 553 CO 0.02 1.11 0.61 0.87 -0.67 0.00 0.00 178.83 180.77 1k93 h LYS 554 N 0.40 1.11 0.02 1.46 1.57 -0.79 0.34 116.57 120.68 1k93 h LYS 554 Ca -0.01 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1k93 h LYS 554 Cb 1.14 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1k93 h LYS 554 CO 0.11 0.74 -0.01 1.96 -0.57 0.00 0.00 179.45 181.68 1k93 h GLN 555 N 1.15 -0.03 -0.97 3.15 4.20 -1.24 -1.23 115.11 120.14 1k93 h GLN 555 Ca 0.39 0.00 0.13 0.00 0.06 0.00 0.00 58.65 59.24 1k93 h GLN 555 Cb 0.08 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 27.79 1k93 h GLN 555 CO -0.15 0.31 0.62 1.98 -0.67 0.00 0.00 178.83 180.92 1k93 h MET 556 N -0.37 0.86 0.69 1.46 4.05 -0.76 0.33 114.93 121.19 1k93 h MET 556 Ca -0.00 -0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.33 1k93 h MET 556 Cb 0.35 -0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 30.96 1k93 h MET 556 CO 0.01 0.57 -0.42 1.25 0.23 0.00 0.00 176.91 178.55 1k93 h LEU 557 N 0.89 -1.06 -0.80 3.39 5.85 0.01 -1.31 115.31 122.28 1k93 h LEU 557 Ca 0.49 0.06 0.16 0.00 0.84 0.00 0.00 57.88 59.43 1k93 h LEU 557 Cb 0.59 0.31 -0.10 0.00 0.37 0.00 0.00 40.66 41.83 1k93 h LEU 557 CO -0.26 -0.65 0.34 0.44 -0.34 0.00 0.00 178.44 177.97 1k93 h ASP 558 N -1.04 0.33 0.36 1.25 5.19 -0.18 -1.19 116.42 121.15 1k93 h ASP 558 Ca -0.09 0.12 -0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1k93 h ASP 558 Cb 0.83 0.08 -0.02 0.00 0.18 0.00 0.00 39.33 40.40 1k93 h ASP 558 CO 0.10 0.10 -0.36 0.03 -3.12 0.00 0.00 179.24 175.99 1k93 h ARG 559 N 0.47 -0.72 -0.66 3.56 2.47 -0.20 -0.24 114.38 119.06 1k93 h ARG 559 Ca 0.45 0.05 0.13 0.00 -1.26 0.00 0.00 59.98 59.35 1k93 h ARG 559 Cb 0.72 0.16 -0.09 0.00 -1.65 0.00 0.00 29.97 29.11 1k93 h ARG 559 CO -0.42 -0.48 0.16 -0.07 0.56 0.00 0.00 179.97 179.71 1k93 h LEU 560 N -0.75 0.03 -0.69 3.04 3.38 -0.22 0.20 115.31 120.30 1k93 h LEU 560 Ca -0.03 0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1k93 h LEU 560 Cb 0.68 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1k93 h LEU 560 CO -0.06 0.01 -0.11 0.78 0.09 0.00 0.00 178.44 179.14 1k93 h ASN 561 N 0.28 0.89 -0.18 -0.43 2.35 -1.07 -2.88 115.58 114.54 1k93 h ASN 561 Ca 0.36 -0.28 0.02 0.00 -0.55 0.00 0.00 56.30 55.85 1k93 h ASN 561 Cb 0.55 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 1k93 h ASN 561 CO -0.44 1.01 0.05 -0.33 -1.65 0.00 0.00 177.43 176.08 1k93 h GLU 562 N 0.80 0.13 -0.63 0.81 5.08 0.87 -1.71 114.58 119.94 1k93 h GLU 562 Ca 0.13 -0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.61 1k93 h GLU 562 Cb 0.63 -0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.75 1k93 h GLU 562 CO 0.04 0.08 0.06 0.00 -1.00 0.00 0.00 179.01 178.20 1k93 h ALA 563 N 1.12 0.68 -0.00 3.43 0.00 -0.49 -1.08 119.26 122.92 1k93 h ALA 563 Ca 0.08 0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.98 1k93 h ALA 563 Cb 0.06 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1k93 h ALA 563 CO -0.10 -0.36 -0.82 -0.39 0.00 0.00 0.00 179.25 177.58 1k93 h VAL 564 N 0.17 1.51 -0.31 0.00 -1.51 -1.36 -2.79 116.25 111.97 1k93 h VAL 564 Ca 0.33 -2.59 -0.01 0.00 -1.23 0.00 0.00 66.70 63.21 1k93 h VAL 564 Cb 0.53 2.42 -0.02 0.00 -2.13 0.00 0.00 31.29 32.10 1k93 h VAL 564 CO -0.49 0.75 0.16 0.11 -1.23 0.00 0.00 177.57 176.86 1k93 h LYS 565 N 0.08 0.42 0.37 5.19 1.57 -0.52 -1.87 116.57 121.80 1k93 h LYS 565 Ca -0.03 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1k93 h LYS 565 Cb 1.43 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.64 1k93 h LYS 565 CO 0.12 0.32 -0.27 1.88 -0.57 0.00 0.00 179.45 180.93 1k93 h TYR 566 N 0.42 -0.71 0.00 -1.35 0.99 -0.95 -2.36 116.97 113.02 1k93 h TYR 566 Ca 0.11 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.84 1k93 h TYR 566 Cb 0.03 0.26 0.00 0.00 1.00 0.00 0.00 36.73 38.03 1k93 h TYR 566 CO 0.00 -0.41 0.00 1.79 -0.00 0.00 0.00 178.16 179.55 1k93 h THR 567 N -0.63 0.00 0.00 -2.88 1.35 -1.29 -3.45 112.91 106.00 1k93 h THR 567 Ca -0.03 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 1k93 h THR 567 Cb 0.54 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 1k93 h THR 567 CO 0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 1k93 n GLY 568 N -1.06 1.46 3.53 5.82 0.00 -0.89 -5.08 105.19 108.97 1k93 n GLY 568 Ca -0.03 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.45 1k93 n GLY 568 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1k93 n TYR 569 N 0.00 1.74 -0.71 1.61 9.36 -1.02 -4.82 117.16 123.32 1k93 n TYR 569 Ca 0.00 0.43 0.08 0.00 3.32 0.00 0.00 57.90 61.74 1k93 n TYR 569 Cb 0.00 -2.48 0.32 0.00 -0.63 0.00 0.00 39.34 36.55 1k93 n TYR 569 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1k93 n THR 570 N 6.05 2.02 0.60 2.97 -2.24 -1.26 -4.43 114.28 117.99 1k93 n THR 570 Ca 0.37 -1.37 0.12 0.00 -2.27 0.00 0.00 64.05 60.89 1k93 n THR 570 Cb 0.16 0.01 0.14 0.00 -2.10 0.00 0.00 70.33 68.54 1k93 n THR 570 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k93 n GLY 571 N 0.58 -1.35 0.00 3.38 0.00 -1.23 -4.97 105.19 101.60 1k93 n GLY 571 Ca 0.23 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1k93 n GLY 571 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k93 n GLY 572 N 1.36 0.38 3.84 -0.02 0.00 -1.26 -4.54 105.19 104.95 1k93 n GLY 572 Ca 0.03 -1.43 -0.32 0.00 0.00 0.00 0.00 46.02 44.30 1k93 n GLY 572 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k93 s ASP 573 N -4.00 6.80 -0.00 1.61 1.01 -1.26 -4.87 116.67 115.95 1k93 s ASP 573 Ca 0.00 1.37 0.04 0.00 0.71 0.00 0.00 52.55 54.67 1k93 s ASP 573 Cb 0.00 -2.41 -0.05 0.00 1.01 0.00 0.00 42.92 41.47 1k93 s ASP 573 CO 0.00 -0.25 0.13 0.55 0.21 0.00 0.00 175.17 175.81 1k93 n VAL 574 N -0.47 0.00 -4.70 -1.27 3.14 -1.26 -4.32 118.33 109.45 1k93 n VAL 574 Ca 0.04 -0.26 -0.28 0.00 -2.96 0.00 0.00 64.34 60.88 1k93 n VAL 574 Cb 0.53 0.72 -0.17 0.00 -1.06 0.00 0.00 33.84 33.87 1k93 n VAL 574 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1k93 s VAL 575 N -1.81 1.52 -0.02 1.55 1.01 -1.26 -0.15 120.40 121.23 1k93 s VAL 575 Ca 0.00 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.33 1k93 s VAL 575 Cb 0.03 -1.36 0.05 0.00 0.00 0.00 0.00 36.38 35.10 1k93 s VAL 575 CO 0.17 0.44 0.93 0.59 0.00 0.00 0.00 175.10 177.22 1k93 n ASN 576 N 3.89 1.51 -3.70 3.32 3.02 -1.26 -4.95 115.26 117.08 1k93 n ASN 576 Ca -0.20 -2.00 0.02 0.00 -0.03 0.00 0.00 54.58 52.36 1k93 n ASN 576 Cb 0.52 -0.10 0.01 0.00 -0.61 0.00 0.00 39.78 39.60 1k93 n ASN 576 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 1k93 s HIS 577 N -1.08 -0.00 0.00 3.10 -3.43 -1.26 -4.36 115.29 108.25 1k93 s HIS 577 Ca 0.06 -0.12 0.00 0.00 -0.80 0.00 0.00 55.06 54.20 1k93 s HIS 577 Cb 0.05 0.56 0.00 0.00 -1.43 0.00 0.00 32.58 31.76 1k93 s HIS 577 CO 0.01 -0.31 0.00 0.41 -2.00 0.00 0.00 174.74 172.85 1k93 n GLY 578 N -0.70 -2.68 4.00 -1.38 0.00 0.20 -4.82 105.19 99.81 1k93 n GLY 578 Ca -0.02 -0.90 -0.18 0.00 0.00 0.00 0.00 46.02 44.91 1k93 n GLY 578 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k93 s THR 579 N -0.22 3.41 0.51 2.61 -4.23 -1.26 -4.51 115.64 111.94 1k93 s THR 579 Ca 0.00 -0.93 0.30 0.00 -1.18 0.00 0.00 61.69 59.88 1k93 s THR 579 Cb 0.00 -3.18 0.34 0.00 1.34 0.00 0.00 72.50 71.00 1k93 s THR 579 CO 0.00 -0.08 2.18 -0.08 -0.54 0.00 0.00 174.62 176.10 1k93 h GLU 580 N 0.65 0.00 0.00 3.99 4.57 -0.80 -2.23 114.58 120.76 1k93 h GLU 580 Ca -0.43 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 1k93 h GLU 580 Cb 1.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1k93 h GLU 580 CO 0.49 0.05 0.00 1.04 -1.18 0.00 0.00 179.01 179.42 1k93 n GLN 581 N -3.67 0.14 -0.09 1.92 1.13 -1.20 -1.59 117.38 114.02 1k93 n GLN 581 Ca -0.02 0.19 0.03 0.00 -1.94 0.00 0.00 57.00 55.26 1k93 n GLN 581 Cb 0.15 -1.50 0.08 0.00 0.11 0.00 0.00 30.24 29.08 1k93 n GLN 581 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1k93 n ASP 582 N -1.36 2.38 -4.38 1.08 8.00 -0.84 -3.78 116.55 117.66 1k93 n ASP 582 Ca 0.06 -1.88 -0.45 0.00 0.71 0.00 0.00 54.79 53.22 1k93 n ASP 582 Cb 0.13 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.12 41.10 1k93 n ASP 582 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1k93 s ASN 583 N -0.92 6.92 0.17 -2.24 2.47 -0.62 -4.82 114.94 115.89 1k93 s ASN 583 Ca 0.13 -2.83 0.20 0.00 0.42 0.00 0.00 52.86 50.78 1k93 s ASN 583 Cb 0.07 -2.28 -0.03 0.00 -1.45 0.00 0.00 41.25 37.56 1k93 s ASN 583 CO 0.09 -0.63 1.01 -0.33 -3.72 0.00 0.00 177.10 173.52 1k93 h GLU 584 N 7.63 0.00 0.13 0.43 5.08 -1.86 -3.28 114.58 122.71 1k93 h GLU 584 Ca 0.17 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.34 1k93 h GLU 584 Cb 0.97 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.24 1k93 h GLU 584 CO 0.96 0.12 -0.82 0.93 -1.00 0.00 0.00 179.01 179.19 1k93 h GLU 585 N 0.00 0.27 -2.20 2.33 5.08 -1.98 -3.40 114.58 114.68 1k93 h GLU 585 Ca -0.06 -0.46 -0.56 0.00 -1.00 0.00 0.00 59.36 57.28 1k93 h GLU 585 Cb 1.22 0.17 -0.41 0.00 0.50 0.00 0.00 28.75 30.22 1k93 h GLU 585 CO 0.02 1.22 -0.81 1.19 -1.00 0.00 0.00 179.01 179.63 1k93 n PHE 586 N -4.14 2.88 -1.95 4.33 3.01 -1.26 -0.69 117.46 119.63 1k93 n PHE 586 Ca -0.15 -3.95 -0.43 0.00 1.01 0.00 0.00 57.45 53.94 1k93 n PHE 586 Cb 0.81 -0.47 -0.03 0.00 -0.01 0.00 0.00 39.48 39.78 1k93 n PHE 586 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1k93 s PRO 587 N -3.12 3.89 0.96 -1.08 0.04 -1.23 -4.99 135.00 129.47 1k93 s PRO 587 Ca 0.46 2.01 -0.15 0.00 0.04 0.00 0.00 61.00 63.36 1k93 s PRO 587 Cb 0.29 -4.08 0.18 0.00 0.04 0.00 0.00 34.50 30.94 1k93 s PRO 587 CO -0.12 -1.20 1.24 -1.21 0.04 0.00 0.00 177.00 175.75 1k93 s GLU 588 N 4.64 0.67 -0.27 4.56 0.41 -1.26 -4.89 118.70 122.56 1k93 s GLU 588 Ca 0.78 -0.16 -0.01 0.00 -0.41 0.00 0.00 54.97 55.18 1k93 s GLU 588 Cb -0.31 -1.83 0.15 0.00 -1.78 0.00 0.00 34.13 30.36 1k93 s GLU 588 CO 0.32 -2.43 0.41 0.21 -0.49 0.00 0.00 175.26 173.27 1k93 s LYS 589 N -5.67 0.40 0.17 1.61 2.20 -1.26 -5.07 119.74 112.11 1k93 s LYS 589 Ca 0.70 0.40 -0.03 0.00 -0.36 0.00 0.00 55.97 56.68 1k93 s LYS 589 Cb -0.08 -0.32 -0.05 0.00 -1.51 0.00 0.00 37.83 35.88 1k93 s LYS 589 CO 0.53 -0.81 0.38 -0.51 -0.36 0.00 0.00 175.35 174.58 1k93 s ASP 590 N 2.57 6.44 0.06 1.43 1.01 -1.26 -5.01 116.67 121.92 1k93 s ASP 590 Ca 0.12 0.51 -0.15 0.00 0.71 0.00 0.00 52.55 53.74 1k93 s ASP 590 Cb -0.14 -2.06 -0.24 0.00 1.01 0.00 0.00 42.92 41.49 1k93 s ASP 590 CO -0.22 0.01 1.16 0.78 0.21 0.00 0.00 175.17 177.11 1k93 h ASN 591 N 2.48 0.87 -3.15 0.27 2.35 -1.95 -3.39 115.58 113.05 1k93 h ASN 591 Ca -0.47 -0.76 -0.67 0.00 -0.55 0.00 0.00 56.30 53.86 1k93 h ASN 591 Cb 1.17 -0.27 -0.35 0.00 0.05 0.00 0.00 38.32 38.93 1k93 h ASN 591 CO 0.71 1.52 -0.85 -1.61 -1.65 0.00 0.00 177.43 175.54 1k93 s GLU 592 N -3.24 2.90 -0.15 0.81 2.02 -1.26 -2.52 118.70 117.27 1k93 s GLU 592 Ca -0.10 -0.88 -0.06 0.00 0.02 0.00 0.00 54.97 53.94 1k93 s GLU 592 Cb 0.06 -2.60 -0.04 0.00 0.10 0.00 0.00 34.13 31.65 1k93 s GLU 592 CO 0.91 -0.25 0.07 0.42 0.02 0.00 0.00 175.26 176.43 1k93 s ILE 593 N 1.27 4.84 -0.32 -1.63 -1.09 -1.25 -3.92 121.20 119.10 1k93 s ILE 593 Ca 0.04 -0.03 -0.18 0.00 -2.23 0.00 0.00 60.65 58.24 1k93 s ILE 593 Cb -0.14 -3.14 -0.01 0.00 -1.58 0.00 0.00 42.46 37.60 1k93 s ILE 593 CO -0.12 0.53 0.53 0.12 -1.23 0.00 0.00 174.94 174.77 1k93 s PHE 594 N -0.20 3.20 -0.05 3.97 5.36 -0.69 -1.46 117.98 128.12 1k93 s PHE 594 Ca 0.08 0.34 -0.01 0.00 -0.96 0.00 0.00 56.93 56.38 1k93 s PHE 594 Cb -0.12 -2.90 -0.04 0.00 -0.34 0.00 0.00 43.02 39.63 1k93 s PHE 594 CO 0.01 -0.48 0.03 0.42 -1.46 0.00 0.00 175.22 173.74 1k93 s ILE 595 N 2.42 4.42 -0.23 3.12 1.01 -0.01 -0.17 121.20 131.77 1k93 s ILE 595 Ca 0.20 -0.35 -0.00 0.00 0.00 0.00 0.00 60.65 60.50 1k93 s ILE 595 Cb -0.15 -2.93 0.06 0.00 0.01 0.00 0.00 42.46 39.45 1k93 s ILE 595 CO 0.12 0.49 -0.03 -0.63 0.00 0.00 0.00 174.94 174.90 1k93 s ILE 596 N -1.01 1.28 0.51 2.92 1.01 0.22 -0.79 121.20 125.35 1k93 s ILE 596 Ca 0.17 -1.07 -0.08 0.00 0.00 0.00 0.00 60.65 59.68 1k93 s ILE 596 Cb -0.12 -1.61 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 1k93 s ILE 596 CO 0.07 -0.13 0.86 0.54 0.00 0.00 0.00 174.94 176.28 1k93 s ASN 597 N 1.51 6.29 0.58 3.58 2.20 -1.03 -0.64 114.94 127.43 1k93 s ASN 597 Ca -0.05 1.11 0.12 0.00 -0.94 0.00 0.00 52.86 53.10 1k93 s ASN 597 Cb -0.18 -2.33 0.63 0.00 -2.00 0.00 0.00 41.25 37.37 1k93 s ASN 597 CO -0.07 -0.65 1.31 1.55 -2.94 0.00 0.00 177.10 176.31 1k93 h PRO 598 N 0.19 0.00 0.00 3.55 0.13 -1.82 1.27 132.00 135.32 1k93 h PRO 598 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1k93 h PRO 598 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1k93 h PRO 598 CO 0.62 0.00 -0.01 0.93 -0.23 0.00 0.00 178.00 179.31 1k93 h GLU 599 N 0.00 0.00 0.00 0.86 3.07 -1.91 -2.97 114.58 113.63 1k93 h GLU 599 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1k93 h GLU 599 Cb 1.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 1k93 h GLU 599 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 1k93 n GLY 600 N 1.21 0.65 3.76 -3.84 0.00 0.44 -4.93 105.19 102.48 1k93 n GLY 600 Ca 0.05 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 1k93 n GLY 600 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k93 s GLU 601 N -1.11 4.11 -0.05 1.61 2.02 -1.24 -4.88 118.70 119.16 1k93 s GLU 601 Ca 0.00 0.15 -0.25 0.00 0.02 0.00 0.00 54.97 54.88 1k93 s GLU 601 Cb 0.00 -3.36 -0.03 0.00 0.10 0.00 0.00 34.13 30.83 1k93 s GLU 601 CO 0.00 0.37 0.78 -0.06 0.02 0.00 0.00 175.26 176.37 1k93 s PHE 602 N 0.04 3.60 0.15 1.61 2.99 -1.26 -2.46 117.98 122.65 1k93 s PHE 602 Ca 0.18 1.37 0.05 0.00 0.00 0.00 0.00 56.93 58.53 1k93 s PHE 602 Cb -0.14 -2.89 -0.04 0.00 0.00 0.00 0.00 43.02 39.95 1k93 s PHE 602 CO 0.06 0.06 -0.10 0.42 -0.00 0.00 0.00 175.22 175.65 1k93 s ILE 603 N 0.88 1.20 -0.23 0.64 -1.09 0.03 -1.85 121.20 120.79 1k93 s ILE 603 Ca 0.41 -2.07 -0.06 0.00 -2.23 0.00 0.00 60.65 56.70 1k93 s ILE 603 Cb -0.19 -1.87 0.11 0.00 -1.58 0.00 0.00 42.46 38.94 1k93 s ILE 603 CO 0.21 -0.73 0.45 -0.22 -1.23 0.00 0.00 174.94 173.42 1k93 s LEU 604 N -3.18 -0.77 0.51 2.97 0.20 -1.12 -0.83 118.68 116.47 1k93 s LEU 604 Ca 0.17 0.88 -0.19 0.00 0.69 0.00 0.00 54.13 55.69 1k93 s LEU 604 Cb 0.02 1.49 -0.07 0.00 -0.43 0.00 0.00 46.19 47.20 1k93 s LEU 604 CO 0.01 -0.25 1.03 0.42 -0.29 0.00 0.00 176.35 177.27 1k93 s THR 605 N 2.66 3.91 -0.08 3.68 -4.23 -0.53 -2.41 115.64 118.64 1k93 s THR 605 Ca 0.03 1.08 0.11 0.00 -1.18 0.00 0.00 61.69 61.73 1k93 s THR 605 Cb -0.13 -3.47 -0.24 0.00 1.34 0.00 0.00 72.50 70.01 1k93 s THR 605 CO -0.15 -0.36 0.54 0.29 -0.54 0.00 0.00 174.62 174.40 1k93 n LYS 606 N -1.29 0.65 -3.61 3.99 4.76 -1.26 -3.81 118.16 117.59 1k93 n LYS 606 Ca 0.09 0.25 -0.12 0.00 -2.87 0.00 0.00 58.31 55.66 1k93 n LYS 606 Cb 0.53 -1.75 -0.05 0.00 -1.84 0.00 0.00 35.03 31.92 1k93 n LYS 606 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1k93 s ASN 607 N -6.14 -0.34 0.18 4.39 4.22 -1.05 -4.34 114.94 111.86 1k93 s ASN 607 Ca -0.08 -0.03 -0.24 0.00 -2.14 0.00 0.00 52.86 50.37 1k93 s ASN 607 Cb 0.08 0.47 0.06 0.00 1.28 0.00 0.00 41.25 43.13 1k93 s ASN 607 CO 0.81 -0.75 1.47 1.87 -2.04 0.00 0.00 177.10 178.46 1k93 n TRP 608 N 0.22 -0.23 -0.31 1.54 -0.00 -1.20 0.10 117.44 117.55 1k93 n TRP 608 Ca -0.18 1.18 0.10 0.00 -0.00 0.00 0.00 57.50 58.60 1k93 n TRP 608 Cb 0.61 -0.69 0.27 0.00 -0.00 0.00 0.00 31.31 31.50 1k93 n TRP 608 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 1k93 h GLU 609 N 0.00 0.60 -0.48 5.87 3.07 -1.96 0.23 114.58 121.90 1k93 h GLU 609 Ca 0.23 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.36 59.00 1k93 h GLU 609 Cb 0.46 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.22 1k93 h GLU 609 CO -0.91 0.40 0.11 1.98 -1.40 0.00 0.00 179.01 179.18 1k93 h MET 610 N 0.62 0.78 -0.54 2.33 4.05 0.27 -2.42 114.93 120.02 1k93 h MET 610 Ca 0.51 -0.19 0.06 0.00 -0.28 0.00 0.00 59.70 59.80 1k93 h MET 610 Cb 0.80 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.47 1k93 h MET 610 CO -0.40 0.77 0.36 1.15 0.23 0.00 0.00 176.91 179.02 1k93 h THR 611 N 0.66 0.99 0.00 -0.77 2.02 0.17 0.26 112.91 116.25 1k93 h THR 611 Ca 0.15 -0.18 -0.10 0.00 0.77 0.00 0.00 66.41 67.06 1k93 h THR 611 Cb 0.34 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1k93 h THR 611 CO 0.00 0.09 -0.46 1.23 0.37 0.00 0.00 175.52 176.75 1k93 h GLY 612 N 0.51 0.00 1.30 2.16 0.00 -0.59 -2.57 103.07 103.88 1k93 h GLY 612 Ca 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.24 1k93 h GLY 612 CO -0.06 0.00 -1.41 3.21 0.00 0.00 0.00 176.54 178.28 1k93 h ARG 613 N 0.00 0.54 -0.35 4.80 3.08 -0.66 -2.08 114.38 119.70 1k93 h ARG 613 Ca -0.00 -0.86 -0.05 0.00 0.07 0.00 0.00 59.98 59.13 1k93 h ARG 613 Cb 1.00 0.31 -0.02 0.00 0.08 0.00 0.00 29.97 31.34 1k93 h ARG 613 CO 0.06 1.41 0.02 0.35 -1.07 0.00 0.00 179.97 180.74 1k93 h PHE 614 N 0.17 0.56 0.00 3.04 3.57 -1.06 0.64 116.94 123.87 1k93 h PHE 614 Ca -0.23 -0.05 -0.17 0.00 3.53 0.00 0.00 57.97 61.05 1k93 h PHE 614 Cb 2.10 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 40.65 1k93 h PHE 614 CO 0.12 0.54 -0.79 0.82 -2.23 0.00 0.00 178.31 176.76 1k93 h ILE 615 N 0.52 1.38 -0.17 1.41 2.04 -1.50 -2.68 117.51 118.52 1k93 h ILE 615 Ca 0.11 -2.90 -0.16 0.00 1.00 0.00 0.00 64.86 62.92 1k93 h ILE 615 Cb 0.31 2.65 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 1k93 h ILE 615 CO 0.01 0.78 -0.51 -0.08 0.00 0.00 0.00 178.15 178.34 1k93 h GLU 616 N 0.00 0.65 0.00 2.37 4.81 -0.71 -0.46 114.58 121.24 1k93 h GLU 616 Ca -0.01 -0.47 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1k93 h GLU 616 Cb 1.59 0.08 0.00 0.00 0.63 0.00 0.00 28.75 31.04 1k93 h GLU 616 CO 0.10 1.09 -0.58 1.17 -0.73 0.00 0.00 179.01 180.06 1k93 n LYS 617 N -4.16 0.09 0.00 1.92 0.00 0.16 -2.99 118.16 113.17 1k93 n LYS 617 Ca -0.07 0.02 0.00 0.00 0.00 0.00 0.00 58.31 58.26 1k93 n LYS 617 Cb 0.60 -1.55 0.00 0.00 0.00 0.00 0.00 35.03 34.08 1k93 n LYS 617 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1k93 n ASN 618 N -1.67 0.41 0.00 3.14 4.13 -1.01 -4.73 115.26 115.53 1k93 n ASN 618 Ca 0.05 -0.90 0.00 0.00 1.68 0.00 0.00 54.58 55.41 1k93 n ASN 618 Cb 0.37 0.06 0.00 0.00 -1.54 0.00 0.00 39.78 38.67 1k93 n ASN 618 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1k93 n ILE 619 N -0.06 0.00 0.20 2.41 5.41 -0.86 -4.50 119.36 121.96 1k93 n ILE 619 Ca 0.00 0.00 0.02 0.00 1.00 0.00 0.00 62.75 63.77 1k93 n ILE 619 Cb 0.11 -0.31 0.10 0.00 -0.71 0.00 0.00 39.64 38.83 1k93 n ILE 619 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1k93 n THR 620 N -1.39 0.64 0.38 1.39 -2.24 -0.24 -1.22 114.28 111.60 1k93 n THR 620 Ca 0.00 0.16 0.04 0.00 -2.27 0.00 0.00 64.05 61.98 1k93 n THR 620 Cb 0.00 -1.10 -0.05 0.00 -2.10 0.00 0.00 70.33 67.08 1k93 n THR 620 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k93 n GLY 621 N -0.89 0.07 2.62 3.38 0.00 -1.16 -4.75 105.19 104.46 1k93 n GLY 621 Ca 0.02 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 1k93 n GLY 621 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k93 n LYS 622 N -1.29 2.71 -3.57 1.61 4.76 -0.36 -4.96 118.16 117.06 1k93 n LYS 622 Ca 0.01 -4.29 -0.22 0.00 -2.87 0.00 0.00 58.31 50.95 1k93 n LYS 622 Cb 0.15 -2.02 0.05 0.00 -1.84 0.00 0.00 35.03 31.37 1k93 n LYS 622 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1k93 n ASP 623 N -0.25 -3.38 -4.23 4.39 8.00 -1.25 -4.87 116.55 114.96 1k93 n ASP 623 Ca 0.30 -0.82 -0.15 0.00 0.71 0.00 0.00 54.79 54.83 1k93 n ASP 623 Cb 0.60 -4.27 -0.10 0.00 -0.02 0.00 0.00 41.12 37.33 1k93 n ASP 623 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1k93 s TYR 624 N -3.53 1.24 -0.20 1.24 1.51 -1.22 -3.70 117.35 112.69 1k93 s TYR 624 Ca 0.21 -0.71 -0.24 0.00 -1.01 0.00 0.00 57.07 55.32 1k93 s TYR 624 Cb -0.05 -0.64 -0.02 0.00 -0.11 0.00 0.00 41.96 41.14 1k93 s TYR 624 CO 0.80 0.07 0.77 -1.17 -1.11 0.00 0.00 175.55 174.91 1k93 s LEU 625 N -2.94 4.14 -0.07 -1.29 2.96 0.24 -4.74 118.68 116.99 1k93 s LEU 625 Ca 0.13 1.04 -0.09 0.00 -0.22 0.00 0.00 54.13 54.99 1k93 s LEU 625 Cb 0.01 -3.12 0.02 0.00 0.50 0.00 0.00 46.19 43.59 1k93 s LEU 625 CO 0.01 -0.39 0.24 -0.47 -1.32 0.00 0.00 176.35 174.42 1k93 s TYR 626 N 2.25 -0.21 -0.08 5.38 5.04 -1.26 -3.71 117.35 124.77 1k93 s TYR 626 Ca 0.35 0.47 -0.05 0.00 -2.44 0.00 0.00 57.07 55.40 1k93 s TYR 626 Cb -0.16 0.07 0.03 0.00 0.35 0.00 0.00 41.96 42.25 1k93 s TYR 626 CO 0.11 -0.20 0.19 1.52 -1.34 0.00 0.00 175.55 175.83 1k93 s TYR 627 N -0.35 -0.22 0.11 4.97 -0.85 -1.26 -5.04 117.35 114.70 1k93 s TYR 627 Ca -0.05 0.56 -0.02 0.00 -0.52 0.00 0.00 57.07 57.05 1k93 s TYR 627 Cb -0.03 0.02 -0.05 0.00 0.38 0.00 0.00 41.96 42.28 1k93 s TYR 627 CO 0.01 -0.15 0.29 -0.59 -1.52 0.00 0.00 175.55 173.59 1k93 s PHE 628 N 0.68 3.50 0.04 -3.49 -0.12 -1.26 -4.93 117.98 112.40 1k93 s PHE 628 Ca -0.05 0.39 -0.34 0.00 -0.05 0.00 0.00 56.93 56.88 1k93 s PHE 628 Cb -0.06 -1.87 -0.18 0.00 -0.63 0.00 0.00 43.02 40.28 1k93 s PHE 628 CO -0.04 0.51 0.87 -1.71 -0.05 0.00 0.00 175.22 174.80 1k93 n ASN 629 N 0.14 -0.25 0.21 1.98 5.15 -1.25 -4.84 115.26 116.40 1k93 n ASN 629 Ca -0.04 1.05 0.15 0.00 -0.60 0.00 0.00 54.58 55.14 1k93 n ASN 629 Cb 0.51 -0.84 0.55 0.00 -0.53 0.00 0.00 39.78 39.47 1k93 n ASN 629 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1k93 h ARG 630 N 2.34 0.00 0.01 1.20 3.08 -1.95 -2.87 114.38 116.18 1k93 h ARG 630 Ca -0.42 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.44 1k93 h ARG 630 Cb 1.30 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.33 1k93 h ARG 630 CO 0.58 0.00 -0.90 0.77 -1.07 0.00 0.00 179.97 179.35 1k93 h SER 631 N 0.00 0.05 -2.52 7.04 0.02 -1.88 -3.46 113.55 112.80 1k93 h SER 631 Ca 0.00 -0.05 -0.56 0.00 -0.84 0.00 0.00 61.79 60.34 1k93 h SER 631 Cb 0.54 -0.02 0.21 0.00 0.14 0.00 0.00 62.40 63.27 1k93 h SER 631 CO 0.00 0.92 -1.13 -1.22 -1.14 0.00 0.00 176.83 174.26 1k93 n TYR 632 N -3.51 -2.99 -1.35 3.45 0.53 -1.09 -1.26 117.16 110.95 1k93 n TYR 632 Ca -0.01 0.22 -0.13 0.00 -1.02 0.00 0.00 57.90 56.96 1k93 n TYR 632 Cb 0.84 -1.67 -0.05 0.00 -1.03 0.00 0.00 39.34 37.43 1k93 n TYR 632 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 1k93 n ASN 633 N 1.60 -5.36 -3.41 7.72 5.03 0.18 -4.90 115.26 116.11 1k93 n ASN 633 Ca 0.05 0.31 -0.17 0.00 0.87 0.00 0.00 54.58 55.64 1k93 n ASN 633 Cb 0.52 -4.15 -0.07 0.00 -1.02 0.00 0.00 39.78 35.06 1k93 n ASN 633 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1k93 s LYS 634 N -3.03 1.75 -0.66 3.52 1.02 -0.39 -5.06 119.74 116.89 1k93 s LYS 634 Ca 0.00 -1.90 -0.16 0.00 0.02 0.00 0.00 55.97 53.93 1k93 s LYS 634 Cb 0.00 0.35 0.16 0.00 -0.52 0.00 0.00 37.83 37.82 1k93 s LYS 634 CO 0.00 -0.66 0.63 0.42 -0.92 0.00 0.00 175.35 174.82 1k93 s ILE 635 N -3.41 5.31 0.18 2.17 1.01 -1.26 -4.26 121.20 120.94 1k93 s ILE 635 Ca 0.38 -1.81 -0.30 0.00 0.00 0.00 0.00 60.65 58.92 1k93 s ILE 635 Cb 0.02 -4.41 -0.17 0.00 0.01 0.00 0.00 42.46 37.91 1k93 s ILE 635 CO 0.24 -0.97 0.68 0.00 0.00 0.00 0.00 174.94 174.89 1k93 n ALA 636 N 4.92 -2.61 -0.01 9.38 0.00 0.07 -4.80 120.51 127.45 1k93 n ALA 636 Ca -0.02 0.46 -0.12 0.00 0.00 0.00 0.00 53.44 53.75 1k93 n ALA 636 Cb 0.43 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1k93 n ALA 636 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1k93 h PRO 637 N 1.51 0.66 0.33 0.00 0.11 -1.77 -1.33 132.00 131.50 1k93 h PRO 637 Ca -0.33 -0.46 -0.02 0.00 0.11 0.00 0.00 66.00 65.30 1k93 h PRO 637 Cb 1.42 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.61 1k93 h PRO 637 CO 0.59 1.08 -0.16 0.78 -0.21 0.00 0.00 178.00 180.08 1k93 h GLY 638 N 0.91 -0.46 -2.24 -0.55 0.00 -1.20 -3.36 103.07 96.18 1k93 h GLY 638 Ca -0.01 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.49 1k93 h GLY 638 CO 0.12 -0.17 0.00 1.16 0.00 0.00 0.00 176.54 177.66 1k93 n ASN 639 N -3.45 3.57 -0.13 0.19 2.04 -0.97 -4.96 115.26 111.56 1k93 n ASN 639 Ca -0.05 -1.98 -0.02 0.00 -0.44 0.00 0.00 54.58 52.09 1k93 n ASN 639 Cb 0.17 -0.37 -0.01 0.00 -2.53 0.00 0.00 39.78 37.04 1k93 n ASN 639 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1k93 n LYS 640 N 1.32 -1.95 -1.69 -3.83 4.76 -0.50 -4.92 118.16 111.35 1k93 n LYS 640 Ca 0.20 0.55 -0.38 0.00 -2.87 0.00 0.00 58.31 55.81 1k93 n LYS 640 Cb 0.56 -4.99 0.05 0.00 -1.84 0.00 0.00 35.03 28.81 1k93 n LYS 640 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1k93 n ALA 641 N 1.00 0.93 -3.65 7.82 0.00 -1.25 -4.46 120.51 120.91 1k93 n ALA 641 Ca -0.02 0.06 -0.28 0.00 0.00 0.00 0.00 53.44 53.21 1k93 n ALA 641 Cb 0.50 -2.25 -0.11 0.00 0.00 0.00 0.00 19.45 17.59 1k93 n ALA 641 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1k93 s TYR 642 N -1.38 2.23 -0.09 0.00 5.04 -1.26 -0.76 117.35 121.14 1k93 s TYR 642 Ca 0.75 -2.74 -0.19 0.00 -2.44 0.00 0.00 57.07 52.45 1k93 s TYR 642 Cb -0.42 -1.81 -0.04 0.00 0.35 0.00 0.00 41.96 40.04 1k93 s TYR 642 CO 0.47 -0.71 0.52 0.42 -1.34 0.00 0.00 175.55 174.91 1k93 s ILE 643 N -0.47 5.12 0.08 3.14 1.01 -1.26 -4.93 121.20 123.90 1k93 s ILE 643 Ca 0.27 1.06 0.00 0.00 0.00 0.00 0.00 60.65 61.98 1k93 s ILE 643 Cb -0.05 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.52 1k93 s ILE 643 CO -0.15 0.34 0.24 -1.61 0.00 0.00 0.00 174.94 173.76 1k93 s GLU 644 N 0.46 3.45 0.03 2.79 2.02 -1.26 0.48 118.70 126.68 1k93 s GLU 644 Ca 0.28 -0.45 -0.14 0.00 0.02 0.00 0.00 54.97 54.68 1k93 s GLU 644 Cb -0.16 -3.01 0.02 0.00 0.10 0.00 0.00 34.13 31.08 1k93 s GLU 644 CO 0.13 0.58 0.30 -0.46 0.02 0.00 0.00 175.26 175.83 1k93 s TRP 645 N -1.57 -0.11 -0.39 1.61 -0.11 -1.26 -4.86 118.94 112.26 1k93 s TRP 645 Ca 0.35 0.00 -0.28 0.00 1.22 0.00 0.00 56.10 57.40 1k93 s TRP 645 Cb -0.13 0.09 0.02 0.00 -1.50 0.00 0.00 33.47 31.95 1k93 s TRP 645 CO 0.28 -0.48 1.03 0.99 -4.62 0.00 0.00 176.95 174.15 1k93 s THR 646 N -2.35 4.45 -0.44 5.86 2.01 -1.26 -4.84 115.64 119.06 1k93 s THR 646 Ca -0.06 1.36 -0.01 0.00 0.31 0.00 0.00 61.69 63.29 1k93 s THR 646 Cb -0.02 -4.44 0.12 0.00 0.01 0.00 0.00 72.50 68.17 1k93 s THR 646 CO -0.02 -0.67 0.22 -0.62 -0.69 0.00 0.00 174.62 172.84 1k93 s ASP 647 N 1.99 5.07 0.39 3.53 -1.08 -1.26 -4.97 116.67 120.34 1k93 s ASP 647 Ca 0.43 -2.30 0.24 0.00 -0.52 0.00 0.00 52.55 50.40 1k93 s ASP 647 Cb -0.11 -1.77 1.35 0.00 -1.46 0.00 0.00 42.92 40.93 1k93 s ASP 647 CO 0.22 -0.45 1.60 -0.65 0.52 0.00 0.00 175.17 176.41 1k93 h PRO 648 N 7.63 0.07 -0.89 4.34 0.11 -2.00 0.33 132.00 141.60 1k93 h PRO 648 Ca -0.09 -0.00 0.23 0.00 0.11 0.00 0.00 66.00 66.25 1k93 h PRO 648 Cb 1.01 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.05 1k93 h PRO 648 CO 0.66 0.05 0.61 0.82 -0.21 0.00 0.00 178.00 179.93 1k93 h ILE 649 N 0.07 0.62 0.06 4.15 2.04 -2.00 -0.13 117.51 122.33 1k93 h ILE 649 Ca 0.83 -0.07 -0.29 0.00 1.00 0.00 0.00 64.86 66.33 1k93 h ILE 649 Cb 2.34 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 1k93 h ILE 649 CO -0.62 0.04 -1.54 0.74 0.00 0.00 0.00 178.15 176.78 1k93 h THR 650 N 0.21 1.11 0.01 -0.27 2.02 -0.77 -2.37 112.91 112.85 1k93 h THR 650 Ca 0.45 -2.83 0.00 0.00 0.77 0.00 0.00 66.41 64.79 1k93 h THR 650 Cb 1.41 2.65 -0.00 0.00 -1.74 0.00 0.00 68.15 70.47 1k93 h THR 650 CO -0.10 0.75 -0.03 0.50 0.37 0.00 0.00 175.52 177.01 1k93 h LYS 651 N 0.04 -0.04 -0.54 6.66 3.64 -0.99 -1.55 116.57 123.79 1k93 h LYS 651 Ca -0.23 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.31 1k93 h LYS 651 Cb 1.97 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.78 1k93 h LYS 651 CO 0.12 -0.02 0.40 0.00 -2.27 0.00 0.00 179.45 177.68 1k93 h ALA 652 N -1.52 2.47 0.00 5.00 0.00 -1.46 -2.69 119.26 121.06 1k93 h ALA 652 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1k93 h ALA 652 Cb 0.04 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1k93 h ALA 652 CO -0.01 -0.68 0.64 -0.22 0.00 0.00 0.00 179.25 178.98 1k93 h LYS 653 N 0.00 0.00 0.65 0.00 3.64 -0.71 -0.90 116.57 119.25 1k93 h LYS 653 Ca 0.26 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.60 1k93 h LYS 653 Cb 1.06 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1k93 h LYS 653 CO -0.00 0.00 -0.32 0.82 -2.27 0.00 0.00 179.45 177.67 1k93 h ILE 654 N 0.00 0.34 -2.56 2.00 2.04 -1.56 -3.24 117.51 114.53 1k93 h ILE 654 Ca 0.00 0.00 -0.80 0.00 1.00 0.00 0.00 64.86 65.06 1k93 h ILE 654 Cb 1.29 0.34 -0.28 0.00 -0.74 0.00 0.00 36.82 37.42 1k93 h ILE 654 CO 0.00 0.00 0.82 0.59 0.00 0.00 0.00 178.15 179.56 1k93 n ASN 655 N -5.48 6.73 -3.28 1.72 5.03 -0.34 -4.33 115.26 115.31 1k93 n ASN 655 Ca -0.13 -3.56 -0.10 0.00 0.87 0.00 0.00 54.58 51.66 1k93 n ASN 655 Cb 0.36 -1.18 -0.05 0.00 -1.02 0.00 0.00 39.78 37.90 1k93 n ASN 655 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1k93 s THR 656 N -3.57 -0.60 0.06 3.41 2.01 -1.23 -4.49 115.64 111.24 1k93 s THR 656 Ca 0.36 -0.66 -0.36 0.00 0.31 0.00 0.00 61.69 61.34 1k93 s THR 656 Cb 0.13 -0.40 -0.19 0.00 0.01 0.00 0.00 72.50 72.05 1k93 s THR 656 CO -0.01 -0.36 0.89 -0.38 -0.69 0.00 0.00 174.62 174.07 1k93 n ILE 657 N 4.21 0.60 -1.52 1.82 5.41 -1.26 -4.87 119.36 123.75 1k93 n ILE 657 Ca 0.12 -0.15 -0.35 0.00 1.00 0.00 0.00 62.75 63.37 1k93 n ILE 657 Cb 0.50 0.00 0.09 0.00 -0.71 0.00 0.00 39.64 39.52 1k93 n ILE 657 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1k93 s PRO 658 N -0.30 2.25 0.39 0.38 0.04 -1.26 -5.03 135.00 131.46 1k93 s PRO 658 Ca 0.81 1.84 -0.06 0.00 0.04 0.00 0.00 61.00 63.63 1k93 s PRO 658 Cb -1.15 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 31.51 1k93 s PRO 658 CO 0.56 -1.77 0.69 0.99 0.04 0.00 0.00 177.00 177.51 1k93 s THR 659 N -1.83 4.93 0.18 1.26 2.01 -1.26 -4.88 115.64 116.05 1k93 s THR 659 Ca 0.76 0.20 -0.16 0.00 0.31 0.00 0.00 61.69 62.81 1k93 s THR 659 Cb -0.31 -3.79 0.15 0.00 0.01 0.00 0.00 72.50 68.56 1k93 s THR 659 CO 0.43 -0.57 1.65 -1.28 -0.69 0.00 0.00 174.62 174.17 1k93 h SER 660 N 1.00 -0.45 -0.38 3.53 0.87 -1.82 -1.84 113.55 114.44 1k93 h SER 660 Ca -0.48 0.15 0.03 0.00 -1.23 0.00 0.00 61.79 60.26 1k93 h SER 660 Cb 1.20 0.30 -0.03 0.00 -0.44 0.00 0.00 62.40 63.43 1k93 h SER 660 CO 0.63 -0.16 0.20 0.00 -0.53 0.00 0.00 176.83 176.97 1k93 h ALA 661 N 1.49 0.48 0.00 6.23 0.00 -1.95 -1.39 119.26 124.12 1k93 h ALA 661 Ca 0.23 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1k93 h ALA 661 Cb 0.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1k93 h ALA 661 CO -0.50 -0.16 0.00 0.39 0.00 0.00 0.00 179.25 178.98 1k93 n GLU 662 N -4.91 0.16 0.00 0.00 1.02 -0.70 -1.55 120.64 114.66 1k93 n GLU 662 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1k93 n GLU 662 Cb 0.09 -1.01 0.00 0.00 -0.02 0.00 0.00 31.44 30.50 1k93 n GLU 662 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1k93 n PHE 663 N -0.41 0.00 0.04 -0.32 7.35 -0.68 -4.37 117.46 119.07 1k93 n PHE 663 Ca 0.00 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.57 1k93 n PHE 663 Cb 0.00 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 39.70 1k93 n PHE 663 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1k93 h ILE 664 N 0.00 1.24 0.00 -2.13 2.04 -1.00 -2.86 117.51 114.79 1k93 h ILE 664 Ca 0.00 -2.95 -0.07 0.00 1.00 0.00 0.00 64.86 62.84 1k93 h ILE 664 Cb 0.34 2.70 -0.01 0.00 -0.74 0.00 0.00 36.82 39.10 1k93 h ILE 664 CO 0.00 0.78 -0.33 0.11 0.00 0.00 0.00 178.15 178.71 1k93 h LYS 665 N 0.03 0.00 0.00 2.37 1.57 -1.53 -2.79 116.57 116.22 1k93 h LYS 665 Ca -0.19 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.52 1k93 h LYS 665 Cb 1.94 0.00 0.01 0.00 0.08 0.00 0.00 32.23 34.26 1k93 h LYS 665 CO 0.13 0.33 -0.28 -0.91 -0.57 0.00 0.00 179.45 178.16 1k93 h ASN 666 N 0.00 0.24 -0.05 0.86 -0.26 -1.75 -2.96 115.58 111.65 1k93 h ASN 666 Ca -0.00 -0.79 0.01 0.00 -0.56 0.00 0.00 56.30 54.96 1k93 h ASN 666 Cb 1.01 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 38.19 1k93 h ASN 666 CO 0.04 1.00 0.17 -0.07 -1.06 0.00 0.00 177.43 177.51 1k93 h LEU 667 N -0.49 0.00 0.07 1.61 3.38 -1.50 -0.05 115.31 118.33 1k93 h LEU 667 Ca -0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1k93 h LEU 667 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1k93 h LEU 667 CO 0.05 0.00 -0.03 -1.28 0.09 0.00 0.00 178.44 177.27 1k93 h SER 668 N 0.00 -0.08 -0.14 -0.43 0.87 -1.33 -1.76 113.55 110.67 1k93 h SER 668 Ca 0.02 -0.45 -0.01 0.00 -1.23 0.00 0.00 61.79 60.12 1k93 h SER 668 Cb 0.36 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1k93 h SER 668 CO -0.00 0.43 0.03 0.28 -0.53 0.00 0.00 176.83 177.05 1k93 h SER 669 N -0.63 0.22 0.11 6.23 0.02 -0.95 -2.29 113.55 116.26 1k93 h SER 669 Ca -0.01 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1k93 h SER 669 Cb 0.53 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1k93 h SER 669 CO 0.02 0.39 0.00 0.00 -1.14 0.00 0.00 176.83 176.10 1k93 n ILE 670 N -4.83 0.06 0.47 3.27 3.06 -0.44 -1.81 119.36 119.14 1k93 n ILE 670 Ca -0.05 0.02 0.11 0.00 -2.50 0.00 0.00 62.75 60.33 1k93 n ILE 670 Cb 0.16 -0.63 0.05 0.00 0.54 0.00 0.00 39.64 39.76 1k93 n ILE 670 CO 0.00 0.00 0.00 -1.14 -2.50 0.00 0.00 176.55 172.91 1k93 n ARG 671 N -1.07 0.36 0.01 9.51 0.63 -0.66 -3.96 116.66 121.47 1k93 n ARG 671 Ca 0.17 0.03 -0.17 0.00 -0.92 0.00 0.00 57.85 56.95 1k93 n ARG 671 Cb 0.11 -1.65 -0.07 0.00 0.45 0.00 0.00 32.46 31.30 1k93 n ARG 671 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1k93 h ARG 672 N 0.00 0.72 -0.01 -0.14 2.47 -1.19 -3.02 114.38 113.21 1k93 h ARG 672 Ca 0.00 -0.65 0.00 0.00 -1.26 0.00 0.00 59.98 58.07 1k93 h ARG 672 Cb 0.79 0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1k93 h ARG 672 CO 0.00 1.25 0.00 0.43 0.56 0.00 0.00 179.97 182.21 1k93 n SER 673 N -3.89 0.01 -3.71 7.04 7.64 -1.25 -4.49 113.62 114.97 1k93 n SER 673 Ca -0.08 -0.41 -0.11 0.00 1.01 0.00 0.00 58.87 59.27 1k93 n SER 673 Cb 0.79 -0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.88 1k93 n SER 673 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1k93 s SER 674 N -1.75 -0.47 1.00 6.43 0.15 -1.14 -5.14 113.70 112.78 1k93 s SER 674 Ca 0.00 0.83 -0.18 0.00 0.70 0.00 0.00 55.95 57.30 1k93 s SER 674 Cb 0.00 0.75 -0.15 0.00 -1.71 0.00 0.00 66.02 64.91 1k93 s SER 674 CO 0.00 -0.18 -0.87 -3.20 1.20 0.00 0.00 173.24 170.19 1k93 n ASN 675 N 3.88 -5.68 -4.32 5.45 5.15 -1.26 -4.90 115.26 113.58 1k93 n ASN 675 Ca -0.21 0.16 -0.30 0.00 -0.60 0.00 0.00 54.58 53.63 1k93 n ASN 675 Cb 0.56 -0.74 -0.15 0.00 -0.53 0.00 0.00 39.78 38.91 1k93 n ASN 675 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1k93 s VAL 676 N -2.01 2.07 0.00 3.44 0.11 -1.26 -4.99 120.40 117.76 1k93 s VAL 676 Ca 0.40 -1.25 0.00 0.00 -2.93 0.00 0.00 61.98 58.20 1k93 s VAL 676 Cb -0.15 -1.74 0.00 0.00 -1.53 0.00 0.00 36.38 32.96 1k93 s VAL 676 CO 0.81 0.45 0.00 0.61 -3.33 0.00 0.00 175.10 173.64 1k93 n GLY 677 N 2.08 -2.05 2.68 6.54 0.00 -1.26 -5.12 105.19 108.06 1k93 n GLY 677 Ca -0.16 0.63 -0.27 0.00 0.00 0.00 0.00 46.02 46.22 1k93 n GLY 677 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k93 s VAL 678 N -0.15 0.23 0.24 1.61 1.01 -1.26 -5.01 120.40 117.08 1k93 s VAL 678 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.58 1k93 s VAL 678 Cb 0.00 -0.80 0.21 0.00 0.00 0.00 0.00 36.38 35.79 1k93 s VAL 678 CO 0.00 -0.23 1.83 0.22 0.00 0.00 0.00 175.10 176.92 1k93 h TYR 679 N 8.33 0.93 -2.91 5.22 3.20 -1.99 -3.40 116.97 126.35 1k93 h TYR 679 Ca -0.16 0.03 -0.52 0.00 3.14 0.00 0.00 58.73 61.22 1k93 h TYR 679 Cb 1.13 -0.29 0.05 0.00 1.54 0.00 0.00 36.73 39.16 1k93 h TYR 679 CO 0.23 0.44 0.89 0.21 -1.64 0.00 0.00 178.16 178.28 1k93 s LYS 680 N -6.05 4.20 -0.81 1.82 2.20 -1.26 -3.05 119.74 116.78 1k93 s LYS 680 Ca -0.12 2.42 -0.02 0.00 -0.36 0.00 0.00 55.97 57.89 1k93 s LYS 680 Cb 0.19 -3.12 -0.02 0.00 -1.51 0.00 0.00 37.83 33.37 1k93 s LYS 680 CO 0.79 -0.61 0.75 -3.47 -0.36 0.00 0.00 175.35 172.45 1k93 n ASP 681 N 3.60 -7.40 0.27 1.43 -0.08 -1.26 -4.88 116.55 108.22 1k93 n ASP 681 Ca 0.13 -0.25 0.14 0.00 -1.51 0.00 0.00 54.79 53.30 1k93 n ASP 681 Cb 0.38 -5.22 0.72 0.00 2.34 0.00 0.00 41.12 39.34 1k93 n ASP 681 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1k93 h SER 682 N 0.03 0.00 -2.58 1.67 0.02 -1.74 -3.44 113.55 107.50 1k93 h SER 682 Ca -0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1k93 h SER 682 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 1k93 h SER 682 CO 0.33 0.10 0.00 0.61 -1.14 0.00 0.00 176.83 176.74 1k93 n GLY 683 N -0.43 0.37 0.09 -3.77 0.00 -1.26 -5.03 105.19 95.16 1k93 n GLY 683 Ca -0.01 -1.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.02 1k93 n GLY 683 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1k93 n ASP 684 N -2.44 0.93 -4.67 1.61 -0.08 -1.26 -4.87 116.55 105.77 1k93 n ASP 684 Ca 0.00 0.31 -0.42 0.00 -1.51 0.00 0.00 54.79 53.16 1k93 n ASP 684 Cb 0.00 -0.01 -0.03 0.00 2.34 0.00 0.00 41.12 43.42 1k93 n ASP 684 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1k93 s LYS 685 N -2.57 4.21 0.00 -0.67 1.02 -1.26 -4.88 119.74 115.59 1k93 s LYS 685 Ca -0.09 2.13 0.28 0.00 0.02 0.00 0.00 55.97 58.32 1k93 s LYS 685 Cb 0.07 -3.79 1.14 0.00 -0.52 0.00 0.00 37.83 34.74 1k93 s LYS 685 CO 0.81 -0.75 1.80 -0.25 -0.92 0.00 0.00 175.35 176.04 1k93 n ASP 686 N 6.34 1.06 0.00 2.83 8.00 -1.26 -3.65 116.55 129.87 1k93 n ASP 686 Ca 0.16 -1.19 0.08 0.00 0.71 0.00 0.00 54.79 54.54 1k93 n ASP 686 Cb 0.43 0.01 0.46 0.00 -0.02 0.00 0.00 41.12 42.00 1k93 n ASP 686 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1k93 n GLU 687 N -0.29 0.83 -3.95 -1.24 1.02 -1.26 -4.79 120.64 110.96 1k93 n GLU 687 Ca 0.18 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.23 1k93 n GLU 687 Cb 0.31 -1.29 -0.08 0.00 -0.02 0.00 0.00 31.44 30.36 1k93 n GLU 687 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1k93 s PHE 688 N -2.00 0.36 -0.00 -0.32 5.36 -1.24 -5.08 117.98 115.05 1k93 s PHE 688 Ca 0.23 -0.77 0.00 0.00 -0.96 0.00 0.00 56.93 55.43 1k93 s PHE 688 Cb 0.11 -0.15 0.01 0.00 -0.34 0.00 0.00 43.02 42.64 1k93 s PHE 688 CO 0.18 -0.58 0.76 0.00 -1.46 0.00 0.00 175.22 174.12 1k93 n ALA 689 N -0.09 2.46 -3.35 11.12 0.00 -1.26 -4.57 120.51 124.82 1k93 n ALA 689 Ca -0.11 -0.52 -0.15 0.00 0.00 0.00 0.00 53.44 52.66 1k93 n ALA 689 Cb 0.63 -0.32 -0.08 0.00 0.00 0.00 0.00 19.45 19.68 1k93 n ALA 689 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1k93 s LYS 690 N 0.00 0.76 -0.61 0.00 2.20 -1.26 -4.39 119.74 116.44 1k93 s LYS 690 Ca 0.00 0.11 -0.02 0.00 -0.36 0.00 0.00 55.97 55.69 1k93 s LYS 690 Cb 0.01 0.35 0.16 0.00 -1.51 0.00 0.00 37.83 36.84 1k93 s LYS 690 CO -0.00 -0.20 0.42 0.15 -0.36 0.00 0.00 175.35 175.36 1k93 s LYS 691 N -0.98 2.51 0.01 4.03 1.02 -1.26 -5.07 119.74 120.00 1k93 s LYS 691 Ca -0.10 -2.53 -0.11 0.00 0.02 0.00 0.00 55.97 53.25 1k93 s LYS 691 Cb -0.03 -3.70 -0.06 0.00 -0.52 0.00 0.00 37.83 33.52 1k93 s LYS 691 CO 0.05 -1.17 0.28 -1.91 -0.92 0.00 0.00 175.35 171.69 1k93 n GLU 692 N 3.47 0.00 -3.75 1.68 4.07 -1.26 -1.29 120.64 123.55 1k93 n GLU 692 Ca 0.07 0.00 -0.23 0.00 -0.06 0.00 0.00 57.16 56.95 1k93 n GLU 692 Cb 0.37 -0.41 0.03 0.00 -0.06 0.00 0.00 31.44 31.37 1k93 n GLU 692 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1k93 n SER 693 N 0.46 -1.44 0.00 4.31 7.64 -1.26 -4.14 113.62 119.19 1k93 n SER 693 Ca 0.06 -0.84 0.00 0.00 1.01 0.00 0.00 58.87 59.10 1k93 n SER 693 Cb 0.03 -3.92 0.00 0.00 -1.01 0.00 0.00 64.21 59.31 1k93 n SER 693 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1k93 n VAL 694 N -4.33 0.00 0.99 0.44 0.24 -0.41 -3.98 118.33 111.28 1k93 n VAL 694 Ca -0.27 0.60 0.14 0.00 -2.04 0.00 0.00 64.34 62.77 1k93 n VAL 694 Cb 0.66 -1.52 0.54 0.00 -1.47 0.00 0.00 33.84 32.05 1k93 n VAL 694 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1k93 n LYS 695 N -0.15 0.00 -0.21 7.34 4.81 -1.26 -3.79 118.16 124.90 1k93 n LYS 695 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.43 1k93 n LYS 695 Cb 0.00 -1.50 0.10 0.00 0.02 0.00 0.00 35.03 33.64 1k93 n LYS 695 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 1k93 h LYS 696 N 0.00 0.54 -0.42 1.64 1.79 -1.98 -2.53 116.57 115.61 1k93 h LYS 696 Ca 0.00 -0.03 0.08 0.00 -2.18 0.00 0.00 60.65 58.52 1k93 h LYS 696 Cb 0.50 -0.12 -0.09 0.00 -1.58 0.00 0.00 32.23 30.94 1k93 h LYS 696 CO 0.00 0.36 -0.31 0.82 -1.08 0.00 0.00 179.45 179.23 1k93 h ILE 697 N 0.55 0.24 -0.09 1.86 2.04 -1.69 -1.16 117.51 119.26 1k93 h ILE 697 Ca 0.29 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.15 1k93 h ILE 697 Cb 0.26 0.24 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1k93 h ILE 697 CO -0.23 0.00 0.03 0.00 0.00 0.00 0.00 178.15 177.95 1k93 h ALA 698 N 0.84 0.12 -0.61 1.87 0.00 -1.75 -2.98 119.26 116.75 1k93 h ALA 698 Ca 0.18 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.10 1k93 h ALA 698 Cb 0.53 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.18 1k93 h ALA 698 CO -0.55 -0.27 -0.01 0.78 0.00 0.00 0.00 179.25 179.20 1k93 h GLY 699 N -0.03 0.63 2.00 0.00 0.00 -1.03 1.33 103.07 105.96 1k93 h GLY 699 Ca 0.03 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1k93 h GLY 699 CO -0.00 -0.20 0.00 -1.72 0.00 0.00 0.00 176.54 174.62 1k93 n TYR 700 N -5.29 0.07 0.00 5.60 0.53 -0.48 -0.28 117.16 117.32 1k93 n TYR 700 Ca 0.09 0.03 -0.21 0.00 -1.02 0.00 0.00 57.90 56.78 1k93 n TYR 700 Cb 0.35 -0.55 -0.14 0.00 -1.03 0.00 0.00 39.34 37.97 1k93 n TYR 700 CO 0.00 0.00 0.00 -0.07 -1.02 0.00 0.00 176.86 175.77 1k93 h LEU 701 N 0.00 0.37 -2.09 7.72 3.38 0.18 -3.04 115.31 121.82 1k93 h LEU 701 Ca 0.00 -0.85 -0.02 0.00 0.09 0.00 0.00 57.88 57.10 1k93 h LEU 701 Cb 0.09 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1k93 h LEU 701 CO 0.00 1.60 -0.08 -1.28 0.09 0.00 0.00 178.44 178.78 1k93 h SER 702 N -0.33 0.00 0.21 -0.43 0.87 0.14 -2.03 113.55 111.98 1k93 h SER 702 Ca -0.30 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 59.98 1k93 h SER 702 Cb 1.74 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 63.73 1k93 h SER 702 CO 0.05 0.08 -1.24 0.44 -0.53 0.00 0.00 176.83 175.63 1k93 h ASP 703 N 0.00 0.73 -0.99 6.23 3.32 -1.20 -3.30 116.42 121.21 1k93 h ASP 703 Ca -0.00 -0.92 0.10 0.00 0.02 0.00 0.00 57.03 56.23 1k93 h ASP 703 Cb 0.18 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 39.42 1k93 h ASP 703 CO 0.01 1.60 0.63 0.22 -1.72 0.00 0.00 179.24 179.97 1k93 h TYR 704 N -0.01 1.14 -2.21 4.55 3.20 -1.25 -2.57 116.97 119.82 1k93 h TYR 704 Ca -0.21 0.03 -0.77 0.00 3.14 0.00 0.00 58.73 60.92 1k93 h TYR 704 Cb 1.97 -0.36 -0.29 0.00 1.54 0.00 0.00 36.73 39.58 1k93 h TYR 704 CO 0.15 0.49 0.79 0.66 -1.64 0.00 0.00 178.16 178.61 1k93 n TYR 705 N -4.60 2.97 -3.39 -3.82 4.02 -1.02 -4.98 117.16 106.34 1k93 n TYR 705 Ca 0.18 -2.73 -0.40 0.00 -0.01 0.00 0.00 57.90 54.94 1k93 n TYR 705 Cb 0.30 -1.09 -0.09 0.00 -0.02 0.00 0.00 39.34 38.45 1k93 n TYR 705 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1k93 s ASN 706 N -1.63 6.23 0.58 7.72 2.47 -0.97 -4.95 114.94 124.38 1k93 s ASN 706 Ca 0.42 0.14 0.27 0.00 0.42 0.00 0.00 52.86 54.11 1k93 s ASN 706 Cb 0.23 -2.21 1.64 0.00 -1.45 0.00 0.00 41.25 39.47 1k93 s ASN 706 CO -0.16 -0.23 2.15 0.28 -3.72 0.00 0.00 177.10 175.41 1k93 h SER 707 N 8.27 0.00 0.00 -4.21 0.02 -1.91 -3.04 113.55 112.68 1k93 h SER 707 Ca -0.31 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.23 1k93 h SER 707 Cb 1.16 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1k93 h SER 707 CO 0.66 0.00 1.91 0.00 -1.14 0.00 0.00 176.83 178.25 1k93 n ALA 708 N -2.37 6.27 0.00 3.77 0.00 -1.26 -2.81 120.51 124.10 1k93 n ALA 708 Ca 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 53.44 51.00 1k93 n ALA 708 Cb 0.24 -2.86 0.00 0.00 0.00 0.00 0.00 19.45 16.83 1k93 n ALA 708 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1k93 n ASN 709 N 3.26 2.91 -0.19 0.00 4.13 -1.15 -4.74 115.26 119.49 1k93 n ASN 709 Ca 0.55 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.81 1k93 n ASN 709 Cb 0.45 0.58 0.00 0.00 -1.54 0.00 0.00 39.78 39.27 1k93 n ASN 709 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1k93 n HIS 710 N -0.88 0.00 -0.02 3.10 1.44 -1.12 -1.29 115.22 116.44 1k93 n HIS 710 Ca 0.00 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.72 1k93 n HIS 710 Cb 0.01 -0.01 0.02 0.00 0.12 0.00 0.00 29.99 30.13 1k93 n HIS 710 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 1k93 n ILE 711 N -0.20 0.95 -4.51 0.61 -5.35 -1.26 -5.02 119.36 104.58 1k93 n ILE 711 Ca 0.00 -0.98 -0.26 0.00 -0.27 0.00 0.00 62.75 61.25 1k93 n ILE 711 Cb 0.04 0.53 -0.10 0.00 -1.74 0.00 0.00 39.64 38.36 1k93 n ILE 711 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1k93 s PHE 712 N -0.96 2.43 0.71 4.28 0.40 -0.41 -5.13 117.98 119.30 1k93 s PHE 712 Ca 0.03 -0.49 -0.11 0.00 -0.60 0.00 0.00 56.93 55.76 1k93 s PHE 712 Cb 0.02 -1.41 0.02 0.00 0.51 0.00 0.00 43.02 42.16 1k93 s PHE 712 CO 0.02 0.56 1.08 -1.54 0.70 0.00 0.00 175.22 176.05 1k93 s SER 713 N -3.63 5.32 0.14 1.36 1.04 -1.26 -4.81 113.70 111.86 1k93 s SER 713 Ca 0.33 1.29 -0.20 0.00 0.48 0.00 0.00 55.95 57.85 1k93 s SER 713 Cb 0.02 -2.12 0.01 0.00 0.10 0.00 0.00 66.02 64.03 1k93 s SER 713 CO 0.17 -1.44 1.68 1.56 0.98 0.00 0.00 173.24 176.19 1k93 h GLN 714 N -0.72 -0.07 -0.65 4.02 1.08 -1.99 0.90 115.11 117.68 1k93 h GLN 714 Ca -0.45 0.00 0.14 0.00 -1.45 0.00 0.00 58.65 56.89 1k93 h GLN 714 Cb 1.24 0.02 -0.12 0.00 -0.05 0.00 0.00 27.48 28.57 1k93 h GLN 714 CO 0.61 -0.05 -0.09 0.93 -0.95 0.00 0.00 178.83 179.29 1k93 h GLU 715 N -0.07 0.04 -0.00 1.46 3.07 -2.00 0.11 114.58 117.20 1k93 h GLU 715 Ca 0.12 -0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.99 1k93 h GLU 715 Cb 0.25 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1k93 h GLU 715 CO -0.27 0.03 -0.05 -0.22 -1.40 0.00 0.00 179.01 177.09 1k93 h LYS 716 N 0.05 -0.09 -0.06 2.33 1.63 -1.57 -1.83 116.57 117.03 1k93 h LYS 716 Ca 0.33 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 60.17 1k93 h LYS 716 Cb 0.53 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.12 1k93 h LYS 716 CO -0.63 -0.06 -0.41 0.87 -3.45 0.00 0.00 179.45 175.78 1k93 h LYS 717 N -0.09 -0.51 -0.55 1.90 1.57 0.12 -1.25 116.57 117.76 1k93 h LYS 717 Ca 0.02 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.91 1k93 h LYS 717 Cb 0.12 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.48 1k93 h LYS 717 CO -0.06 -0.34 0.24 0.00 -0.57 0.00 0.00 179.45 178.72 1k93 h ARG 718 N -0.53 0.43 0.00 3.15 3.08 -0.79 -1.71 114.38 118.01 1k93 h ARG 718 Ca 0.06 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1k93 h ARG 718 Cb 0.63 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1k93 h ARG 718 CO -0.35 0.28 0.00 1.63 -1.07 0.00 0.00 179.97 180.47 1k93 n LYS 719 N -4.95 0.00 -0.06 0.04 4.76 -0.70 -0.83 118.16 116.42 1k93 n LYS 719 Ca 0.06 0.49 0.25 0.00 -2.87 0.00 0.00 58.31 56.25 1k93 n LYS 719 Cb 0.21 -1.32 0.72 0.00 -1.84 0.00 0.00 35.03 32.79 1k93 n LYS 719 CO 0.00 0.00 0.00 -0.84 -1.37 0.00 0.00 177.40 175.19 1k93 h ILE 720 N 0.00 0.44 0.10 -0.18 3.07 -1.23 -1.28 117.51 118.43 1k93 h ILE 720 Ca 0.00 0.00 -0.17 0.00 1.55 0.00 0.00 64.86 66.24 1k93 h ILE 720 Cb 0.00 0.56 0.02 0.00 -0.27 0.00 0.00 36.82 37.13 1k93 h ILE 720 CO 0.00 0.00 -0.71 0.28 -1.05 0.00 0.00 178.15 176.67 1k93 h SER 721 N 0.00 0.45 -0.01 2.16 0.02 -1.13 -0.13 113.55 114.91 1k93 h SER 721 Ca 0.33 -0.92 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1k93 h SER 721 Cb 1.50 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 63.89 1k93 h SER 721 CO -0.00 1.32 0.13 0.40 -1.14 0.00 0.00 176.83 177.54 1k93 h ILE 722 N -0.36 0.03 0.00 3.27 2.04 0.17 0.15 117.51 122.81 1k93 h ILE 722 Ca -0.12 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 1k93 h ILE 722 Cb 1.53 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.48 1k93 h ILE 722 CO 0.13 0.00 -0.37 0.15 0.00 0.00 0.00 178.15 178.07 1k93 h PHE 723 N 0.00 0.00 -1.23 1.37 3.57 -1.32 -3.12 116.94 116.20 1k93 h PHE 723 Ca 0.00 0.00 0.36 0.00 3.53 0.00 0.00 57.97 61.86 1k93 h PHE 723 Cb 0.27 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.96 1k93 h PHE 723 CO 0.00 0.02 0.89 0.00 -2.23 0.00 0.00 178.31 176.98 1k93 h ARG 724 N -1.00 0.01 0.17 1.11 3.08 -0.42 0.25 114.38 117.58 1k93 h ARG 724 Ca -0.00 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1k93 h ARG 724 Cb 0.37 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1k93 h ARG 724 CO -0.00 0.01 -0.08 0.78 -1.07 0.00 0.00 179.97 179.60 1k93 h GLY 725 N 0.01 -0.24 -0.81 0.04 0.00 -0.87 -2.72 103.07 98.48 1k93 h GLY 725 Ca 0.59 0.09 0.40 0.00 0.00 0.00 0.00 47.33 48.41 1k93 h GLY 725 CO -0.02 -0.09 0.98 -2.22 0.00 0.00 0.00 176.54 175.20 1k93 h ILE 726 N -0.43 0.30 0.69 2.60 2.04 -1.13 0.36 117.51 121.94 1k93 h ILE 726 Ca -0.02 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 1k93 h ILE 726 Cb 0.17 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1k93 h ILE 726 CO 0.04 0.01 -0.43 1.56 0.00 0.00 0.00 178.15 179.32 1k93 h GLN 727 N 0.04 -1.02 -0.03 2.37 4.20 -0.48 -0.33 115.11 119.86 1k93 h GLN 727 Ca 0.68 0.07 -0.08 0.00 0.06 0.00 0.00 58.65 59.38 1k93 h GLN 727 Cb 2.61 0.23 -0.01 0.00 0.30 0.00 0.00 27.48 30.61 1k93 h GLN 727 CO -0.06 -0.68 -0.35 0.00 -0.67 0.00 0.00 178.83 177.07 1k93 h ALA 728 N -0.86 1.37 0.00 3.87 0.00 -0.13 -1.57 119.26 121.94 1k93 h ALA 728 Ca -0.09 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 1k93 h ALA 728 Cb 0.86 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1k93 h ALA 728 CO 0.09 0.47 -0.02 -0.92 0.00 0.00 0.00 179.25 178.87 1k93 h TYR 729 N 0.05 0.00 0.00 0.00 3.20 -0.28 -0.92 116.97 119.01 1k93 h TYR 729 Ca 0.00 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 1k93 h TYR 729 Cb 0.65 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.92 1k93 h TYR 729 CO 0.00 0.02 -0.17 -0.97 -1.64 0.00 0.00 178.16 175.40 1k93 h ASN 730 N 0.00 0.00 -0.24 -2.11 -1.24 -0.06 -2.95 115.58 108.98 1k93 h ASN 730 Ca -0.00 -0.68 0.04 0.00 0.71 0.00 0.00 56.30 56.37 1k93 h ASN 730 Cb 0.26 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.27 1k93 h ASN 730 CO 0.00 0.94 -0.01 -0.33 -1.29 0.00 0.00 177.43 176.74 1k93 h GLU 731 N -1.00 0.06 -0.93 6.67 4.39 -1.18 0.20 114.58 122.78 1k93 h GLU 731 Ca -0.04 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.75 1k93 h GLU 731 Cb 0.80 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.37 1k93 h GLU 731 CO -0.03 0.04 0.60 0.82 -1.16 0.00 0.00 179.01 179.28 1k93 h ILE 732 N 0.06 1.00 0.35 3.13 2.04 -1.33 -2.22 117.51 120.53 1k93 h ILE 732 Ca 0.12 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1k93 h ILE 732 Cb 0.15 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.14 1k93 h ILE 732 CO -0.21 0.18 -0.39 -0.33 0.00 0.00 0.00 178.15 177.41 1k93 h GLU 733 N 0.98 -0.74 0.00 2.37 4.39 -0.80 -2.19 114.58 118.58 1k93 h GLU 733 Ca 0.43 0.05 0.00 0.00 0.34 0.00 0.00 59.36 60.18 1k93 h GLU 733 Cb 0.35 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 1k93 h GLU 733 CO -0.19 -0.49 0.00 0.27 -1.16 0.00 0.00 179.01 177.44 1k93 n ASN 734 N -5.48 0.00 0.10 1.42 0.23 -0.72 -1.88 115.26 108.94 1k93 n ASN 734 Ca -0.10 -0.03 -0.23 0.00 -0.53 0.00 0.00 54.58 53.69 1k93 n ASN 734 Cb 0.38 -0.29 -0.15 0.00 -2.08 0.00 0.00 39.78 37.64 1k93 n ASN 734 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1k93 h VAL 735 N 0.00 1.32 0.00 3.53 2.07 -0.97 -2.96 116.25 119.24 1k93 h VAL 735 Ca 0.00 -2.62 0.00 0.00 0.82 0.00 0.00 66.70 64.90 1k93 h VAL 735 Cb 0.21 3.06 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 1k93 h VAL 735 CO 0.00 0.78 0.00 0.18 0.02 0.00 0.00 177.57 178.55 1k93 n LEU 736 N -3.85 0.73 -0.08 2.57 4.77 -0.87 -1.34 117.00 118.93 1k93 n LEU 736 Ca -0.17 0.66 0.14 0.00 -0.03 0.00 0.00 56.01 56.62 1k93 n LEU 736 Cb 1.00 -0.55 0.62 0.00 -2.33 0.00 0.00 43.42 42.17 1k93 n LEU 736 CO 0.55 -0.53 0.88 1.17 -1.33 0.00 0.00 177.39 178.13 1k93 n LYS 737 N -2.29 0.55 0.00 3.23 3.00 -0.79 -4.74 118.16 117.12 1k93 n LYS 737 Ca 0.02 -0.16 0.00 0.00 -0.00 0.00 0.00 58.31 58.18 1k93 n LYS 737 Cb 0.26 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.79 1k93 n LYS 737 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1k93 n SER 738 N -1.09 0.00 -4.85 3.14 7.64 -0.45 -5.04 113.62 112.96 1k93 n SER 738 Ca 0.13 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.66 1k93 n SER 738 Cb 0.28 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.42 1k93 n SER 738 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1k93 s LYS 739 N 2.02 3.90 0.00 1.43 2.47 -1.26 -4.94 119.74 123.36 1k93 s LYS 739 Ca 0.00 0.38 -0.03 0.00 -1.56 0.00 0.00 55.97 54.76 1k93 s LYS 739 Cb 0.00 -2.94 -0.14 0.00 -1.46 0.00 0.00 37.83 33.29 1k93 s LYS 739 CO 0.00 0.50 2.50 1.04 0.16 0.00 0.00 175.35 179.54 1k93 n GLN 740 N 0.79 1.31 0.00 4.03 3.00 -1.26 -4.78 117.38 120.47 1k93 n GLN 740 Ca -0.06 -0.53 0.00 0.00 -0.01 0.00 0.00 57.00 56.40 1k93 n GLN 740 Cb 0.52 -1.65 0.00 0.00 0.00 0.00 0.00 30.24 29.11 1k93 n GLN 740 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1k93 n ILE 741 N 2.30 0.00 -3.44 5.09 2.08 -1.26 -2.90 119.36 121.23 1k93 n ILE 741 Ca 0.23 0.00 -0.42 0.00 0.56 0.00 0.00 62.75 63.12 1k93 n ILE 741 Cb 0.61 0.00 -0.10 0.00 -0.75 0.00 0.00 39.64 39.40 1k93 n ILE 741 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1k93 s ALA 742 N 0.00 3.48 0.29 -1.39 0.00 -1.26 -4.98 121.76 117.90 1k93 s ALA 742 Ca 0.00 -1.51 0.05 0.00 0.00 0.00 0.00 51.96 50.49 1k93 s ALA 742 Cb 0.00 -2.86 0.78 0.00 0.00 0.00 0.00 23.12 21.04 1k93 s ALA 742 CO 0.00 -1.31 1.43 -2.30 0.00 0.00 0.00 175.76 173.58 1k93 n PRO 743 N 5.28 -0.07 0.00 0.00 -0.02 -1.14 -0.36 135.00 138.68 1k93 n PRO 743 Ca -0.10 1.35 0.13 0.00 -2.02 0.00 0.00 63.50 62.85 1k93 n PRO 743 Cb 0.48 -2.19 0.23 0.00 -0.02 0.00 0.00 33.50 32.00 1k93 n PRO 743 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1k93 n GLU 744 N -5.30 1.90 0.12 -0.52 1.02 -1.26 -3.46 120.64 113.14 1k93 n GLU 744 Ca 0.24 -1.44 -0.02 0.00 -0.02 0.00 0.00 57.16 55.92 1k93 n GLU 744 Cb 0.78 -1.47 0.08 0.00 -0.02 0.00 0.00 31.44 30.81 1k93 n GLU 744 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1k93 h TYR 745 N 3.52 0.00 -0.39 -0.32 -1.99 -1.07 -2.85 116.97 113.86 1k93 h TYR 745 Ca 0.00 0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.78 1k93 h TYR 745 Cb 0.79 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.50 1k93 h TYR 745 CO 0.00 0.70 0.27 -0.22 -0.00 0.00 0.00 178.16 178.90 1k93 h LYS 746 N 0.00 0.34 -0.11 4.88 3.11 -1.50 -2.21 116.57 121.08 1k93 h LYS 746 Ca -0.01 -0.02 -0.13 0.00 -2.81 0.00 0.00 60.65 57.69 1k93 h LYS 746 Cb 1.32 -0.08 0.00 0.00 -1.00 0.00 0.00 32.23 32.48 1k93 h LYS 746 CO 0.09 0.22 -0.43 -0.91 -2.81 0.00 0.00 179.45 175.61 1k93 h ASN 747 N 0.35 0.57 -0.97 4.20 4.21 -1.68 -2.43 115.58 119.84 1k93 h ASN 747 Ca 0.17 -0.62 0.23 0.00 1.21 0.00 0.00 56.30 57.28 1k93 h ASN 747 Cb 0.23 -0.17 -0.08 0.00 -1.12 0.00 0.00 38.32 37.19 1k93 h ASN 747 CO -0.04 1.10 0.63 0.22 -1.29 0.00 0.00 177.43 178.05 1k93 h TYR 748 N 0.07 0.59 0.14 1.19 3.20 -1.42 0.11 116.97 120.84 1k93 h TYR 748 Ca -0.02 0.02 -0.22 0.00 3.14 0.00 0.00 58.73 61.65 1k93 h TYR 748 Cb 1.07 -0.18 0.01 0.00 1.54 0.00 0.00 36.73 39.18 1k93 h TYR 748 CO 0.11 0.12 -1.02 0.74 -1.64 0.00 0.00 178.16 176.47 1k93 h PHE 749 N 0.41 0.53 -0.12 -3.82 0.05 -1.51 -0.26 116.94 112.22 1k93 h PHE 749 Ca 0.52 -0.39 0.03 0.00 3.82 0.00 0.00 57.97 61.96 1k93 h PHE 749 Cb 1.31 -0.02 -0.00 0.00 2.00 0.00 0.00 35.95 39.23 1k93 h PHE 749 CO -0.00 1.39 0.17 -0.56 -0.18 0.00 0.00 178.31 179.13 1k93 h GLN 750 N -0.33 0.00 0.02 1.51 3.07 -0.84 0.42 115.11 118.96 1k93 h GLN 750 Ca -0.20 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.54 1k93 h GLN 750 Cb 1.70 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.26 1k93 h GLN 750 CO 0.13 0.00 -0.01 -0.92 0.09 0.00 0.00 178.83 178.12 1k93 h TYR 751 N 0.00 -0.03 -0.17 0.06 3.20 -0.76 -2.85 116.97 116.43 1k93 h TYR 751 Ca 0.06 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.98 1k93 h TYR 751 Cb 0.39 0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.61 1k93 h TYR 751 CO 0.00 0.37 -0.25 -0.07 -1.64 0.00 0.00 178.16 176.57 1k93 h LEU 752 N -0.99 -0.80 -1.27 2.82 3.38 -0.02 0.41 115.31 118.85 1k93 h LEU 752 Ca -0.00 0.13 0.31 0.00 0.09 0.00 0.00 57.88 58.41 1k93 h LEU 752 Cb 0.41 0.36 -0.12 0.00 0.09 0.00 0.00 40.66 41.41 1k93 h LEU 752 CO 0.01 -0.30 0.69 0.11 0.09 0.00 0.00 178.44 179.03 1k93 h LYS 753 N -0.30 0.32 -0.32 1.13 1.57 -0.33 0.82 116.57 119.45 1k93 h LYS 753 Ca 0.11 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.78 1k93 h LYS 753 Cb 0.47 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1k93 h LYS 753 CO -0.34 0.21 -0.15 1.49 -0.57 0.00 0.00 179.45 180.09 1k93 h GLU 754 N 0.33 0.67 0.16 3.15 4.81 -0.02 -0.64 114.58 123.04 1k93 h GLU 754 Ca 0.68 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.61 1k93 h GLU 754 Cb 1.76 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 31.12 1k93 h GLU 754 CO -0.40 0.88 -0.08 0.00 -0.73 0.00 0.00 179.01 178.69 1k93 h ARG 755 N 0.44 -0.20 -0.82 1.92 3.08 0.22 -1.90 114.38 117.13 1k93 h ARG 755 Ca 0.07 0.01 0.16 0.00 0.07 0.00 0.00 59.98 60.29 1k93 h ARG 755 Cb 0.68 0.05 -0.10 0.00 0.08 0.00 0.00 29.97 30.68 1k93 h ARG 755 CO 0.05 0.08 0.37 0.82 -1.07 0.00 0.00 179.97 180.21 1k93 h ILE 756 N -0.48 0.65 0.24 2.04 1.08 0.29 -0.19 117.51 121.14 1k93 h ILE 756 Ca -0.02 -0.17 -0.00 0.00 -0.39 0.00 0.00 64.86 64.27 1k93 h ILE 756 Cb 0.38 0.10 -0.01 0.00 -3.07 0.00 0.00 36.82 34.22 1k93 h ILE 756 CO 0.04 0.09 -0.19 0.74 -0.69 0.00 0.00 178.15 178.13 1k93 h THR 757 N 0.50 0.58 -0.25 -0.27 2.02 -0.90 -1.55 112.91 113.04 1k93 h THR 757 Ca 0.46 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.65 1k93 h THR 757 Cb 0.71 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1k93 h THR 757 CO -0.41 0.00 0.14 0.78 0.37 0.00 0.00 175.52 176.40 1k93 h ASN 758 N -0.45 0.23 -0.19 4.18 2.35 -0.45 0.31 115.58 121.56 1k93 h ASN 758 Ca -0.01 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.79 1k93 h ASN 758 Cb 0.40 -0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.66 1k93 h ASN 758 CO -0.01 0.17 -0.20 -0.61 -1.65 0.00 0.00 177.43 175.13 1k93 h GLN 759 N 0.30 -0.22 0.62 0.81 5.75 -0.96 0.17 115.11 121.58 1k93 h GLN 759 Ca 0.10 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1k93 h GLN 759 Cb -0.00 0.05 0.01 0.00 1.07 0.00 0.00 27.48 28.60 1k93 h GLN 759 CO -0.05 -0.14 -0.30 0.28 -2.65 0.00 0.00 178.83 175.97 1k93 h VAL 760 N -0.22 0.00 0.00 2.39 2.07 -1.06 -0.51 116.25 118.92 1k93 h VAL 760 Ca 0.12 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1k93 h VAL 760 Cb 0.40 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1k93 h VAL 760 CO -0.32 0.00 0.36 -0.61 0.02 0.00 0.00 177.57 177.02 1k93 h GLN 761 N -0.85 0.00 0.00 1.57 5.75 -0.83 0.32 115.11 121.06 1k93 h GLN 761 Ca -0.08 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.35 1k93 h GLN 761 Cb 0.63 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.17 1k93 h GLN 761 CO 0.14 0.00 -0.38 1.25 -2.65 0.00 0.00 178.83 177.19 1k93 h LEU 762 N 0.00 0.00 -1.86 -2.39 5.85 0.26 -3.16 115.31 114.02 1k93 h LEU 762 Ca 0.00 -0.75 -0.01 0.00 0.84 0.00 0.00 57.88 57.95 1k93 h LEU 762 Cb 0.72 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.74 1k93 h LEU 762 CO 0.00 1.10 -0.07 -0.07 -0.34 0.00 0.00 178.44 179.06 1k93 h LEU 763 N -1.00 0.00 0.09 2.25 3.38 0.11 -2.10 115.31 118.05 1k93 h LEU 763 Ca -0.10 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1k93 h LEU 763 Cb 1.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1k93 h LEU 763 CO -0.06 0.07 -0.04 -0.07 0.09 0.00 0.00 178.44 178.43 1k93 h LEU 764 N 0.00 -0.11 -1.66 1.67 3.38 -1.28 -2.97 115.31 114.34 1k93 h LEU 764 Ca 0.00 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1k93 h LEU 764 Cb 0.12 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1k93 h LEU 764 CO 0.01 0.37 0.00 0.71 0.09 0.00 0.00 178.44 179.62 1k93 h THR 765 N -0.62 0.00 0.00 0.22 1.35 -1.44 0.57 112.91 112.99 1k93 h THR 765 Ca -0.01 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1k93 h THR 765 Cb 0.50 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1k93 h THR 765 CO 0.02 0.00 -0.10 -0.74 -0.25 0.00 0.00 175.52 174.45 1k93 h HIS 766 N 0.00 0.00 0.00 4.73 6.17 -1.23 -3.42 115.15 121.40 1k93 h HIS 766 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 1k93 h HIS 766 Cb 0.10 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.03 1k93 h HIS 766 CO 0.00 0.00 0.00 1.04 0.71 0.00 0.00 177.93 179.68 1k93 n GLN 767 N -2.59 0.00 0.00 5.26 1.13 0.18 -5.11 117.38 116.25 1k93 n GLN 767 Ca 0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.11 1k93 n GLN 767 Cb 0.48 -0.15 0.00 0.00 0.11 0.00 0.00 30.24 30.68 1k93 n GLN 767 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1k93 n LYS 768 N -2.03 0.00 0.01 -1.09 4.81 -0.27 -5.12 118.16 114.48 1k93 n LYS 768 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1k93 n LYS 768 Cb 0.00 -0.17 0.00 0.00 0.02 0.00 0.00 35.03 34.88 1k93 n LYS 768 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1k93 n PHE 773 N -1.10 -0.13 -0.32 5.64 7.35 -1.26 -4.76 117.46 122.88 1k93 n PHE 773 Ca 0.00 0.02 0.29 0.00 -0.76 0.00 0.00 57.45 57.00 1k93 n PHE 773 Cb 0.00 0.12 0.54 0.00 0.35 0.00 0.00 39.48 40.49 1k93 n PHE 773 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1k93 h LYS 774 N 0.00 0.04 0.00 -4.13 1.79 -1.99 -1.39 116.57 110.89 1k93 h LYS 774 Ca 0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1k93 h LYS 774 Cb 0.00 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 1k93 h LYS 774 CO 0.00 0.02 0.00 1.28 -1.08 0.00 0.00 179.45 179.67 1k93 n LEU 775 N -5.27 0.00 0.16 2.94 4.77 -1.26 -1.46 117.00 116.89 1k93 n LEU 775 Ca 0.35 0.47 0.07 0.00 -0.03 0.00 0.00 56.01 56.87 1k93 n LEU 775 Cb 1.19 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 42.68 1k93 n LEU 775 CO 0.01 0.00 0.79 0.18 -1.33 0.00 0.00 177.39 177.04 1k93 n LEU 776 N -0.82 0.38 -0.54 2.23 4.32 -0.61 -1.99 117.00 119.97 1k93 n LEU 776 Ca 0.00 0.60 0.00 0.00 -0.02 0.00 0.00 56.01 56.59 1k93 n LEU 776 Cb 0.00 -0.58 0.00 0.00 -1.62 0.00 0.00 43.42 41.22 1k93 n LEU 776 CO 0.00 -0.73 0.27 0.00 -1.22 0.00 0.00 177.39 175.71 1k93 n TYR 777 N -2.07 0.02 -0.05 -1.77 9.36 -0.53 -3.59 117.16 118.53 1k93 n TYR 777 Ca -0.01 -0.04 -0.11 0.00 3.32 0.00 0.00 57.90 61.07 1k93 n TYR 777 Cb 0.24 -0.11 -0.04 0.00 -0.63 0.00 0.00 39.34 38.80 1k93 n TYR 777 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1k93 n LYS 778 N 0.03 0.21 -0.38 2.98 4.76 -0.84 -4.69 118.16 120.23 1k93 n LYS 778 Ca 0.00 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 1k93 n LYS 778 Cb 0.27 -0.85 0.00 0.00 -1.84 0.00 0.00 35.03 32.61 1k93 n LYS 778 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1k93 n GLN 779 N -3.43 0.80 -4.23 1.97 10.64 -1.24 -4.81 117.38 117.09 1k93 n GLN 779 Ca -0.19 0.00 -0.16 0.00 -1.83 0.00 0.00 57.00 54.82 1k93 n GLN 779 Cb 0.64 -1.10 -0.11 0.00 -0.86 0.00 0.00 30.24 28.81 1k93 n GLN 779 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 1k93 s LEU 780 N 0.00 2.44 0.28 2.61 0.05 -1.26 -4.72 118.68 118.08 1k93 s LEU 780 Ca 0.00 -0.86 -0.04 0.00 0.05 0.00 0.00 54.13 53.28 1k93 s LEU 780 Cb 0.00 -0.44 -0.05 0.00 -2.05 0.00 0.00 46.19 43.65 1k93 s LEU 780 CO 0.00 -0.22 0.53 0.20 -0.55 0.00 0.00 176.35 176.31 1k93 s ASN 781 N -2.63 6.42 0.00 1.48 0.02 -1.26 -4.97 114.94 114.01 1k93 s ASN 781 Ca 0.10 0.65 0.00 0.00 -1.02 0.00 0.00 52.86 52.59 1k93 s ASN 781 Cb -0.03 -2.12 0.00 0.00 0.02 0.00 0.00 41.25 39.13 1k93 s ASN 781 CO 0.02 -0.18 0.16 0.49 0.02 0.00 0.00 177.10 177.60 1k93 n PHE 782 N -0.95 0.00 0.00 2.20 3.01 -1.26 -4.98 117.46 115.48 1k93 n PHE 782 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1k93 n PHE 782 Cb 0.54 0.08 0.00 0.00 -0.01 0.00 0.00 39.48 40.09 1k93 n PHE 782 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1k93 n THR 783 N 0.00 0.00 -0.67 4.37 -2.24 -1.26 -4.95 114.28 109.53 1k93 n THR 783 Ca 0.00 0.50 0.00 0.00 -2.27 0.00 0.00 64.05 62.28 1k93 n THR 783 Cb 0.45 -1.41 0.00 0.00 -2.10 0.00 0.00 70.33 67.27 1k93 n THR 783 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1k93 n GLU 784 N -1.86 3.62 0.00 -0.78 4.71 -1.26 -5.12 120.64 119.95 1k93 n GLU 784 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1k93 n GLU 784 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1k93 n GLU 784 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1k93 n ASN 785 N 0.00 0.00 0.00 1.62 0.23 -1.26 -5.04 115.26 110.80 1k93 n ASN 785 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1k93 n ASN 785 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1k93 n ASN 785 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1k93 n GLU 786 N 0.00 0.71 -0.07 -3.83 -0.58 -1.26 -4.79 120.64 110.82 1k93 n GLU 786 Ca 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.73 1k93 n GLU 786 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 30.86 1k93 n GLU 786 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1k93 n THR 787 N 0.00 0.22 0.00 2.62 -1.04 -1.26 -2.89 114.28 111.92 1k93 n THR 787 Ca 0.00 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1k93 n THR 787 Cb 0.00 -1.55 0.00 0.00 -1.82 0.00 0.00 70.33 66.96 1k93 n THR 787 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1k93 n ASP 788 N 3.73 3.62 -0.01 8.00 4.64 -1.26 -4.63 116.55 130.65 1k93 n ASP 788 Ca 0.03 0.00 -0.21 0.00 -1.38 0.00 0.00 54.79 53.23 1k93 n ASP 788 Cb 0.04 0.49 -0.14 0.00 -1.04 0.00 0.00 41.12 40.47 1k93 n ASP 788 CO 0.00 0.00 0.00 0.78 -0.82 0.00 0.00 177.20 177.16 1k93 h ASN 789 N 0.00 0.33 0.00 1.67 -0.26 -1.88 -3.30 115.58 112.15 1k93 h ASN 789 Ca 0.00 -0.83 0.00 0.00 -0.56 0.00 0.00 56.30 54.91 1k93 h ASN 789 Cb 0.47 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.62 1k93 h ASN 789 CO 0.00 1.60 0.15 0.15 -1.06 0.00 0.00 177.43 178.26 1k93 h PHE 790 N -0.38 0.00 0.16 1.19 3.57 -1.84 -2.99 116.94 116.66 1k93 h PHE 790 Ca -0.30 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.19 1k93 h PHE 790 Cb 1.70 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.44 1k93 h PHE 790 CO 0.13 0.00 -0.08 0.93 -2.23 0.00 0.00 178.31 177.06 1k93 h GLU 791 N 0.00 -0.21 -1.02 1.11 3.07 -1.82 -2.97 114.58 112.74 1k93 h GLU 791 Ca 0.00 0.01 0.25 0.00 -0.50 0.00 0.00 59.36 59.13 1k93 h GLU 791 Cb 0.30 0.05 -0.09 0.00 -0.84 0.00 0.00 28.75 28.16 1k93 h GLU 791 CO 0.00 -0.14 0.66 0.28 -1.40 0.00 0.00 179.01 178.40 1k93 h VAL 792 N -0.76 0.56 0.15 3.13 2.07 -1.66 -2.31 116.25 117.42 1k93 h VAL 792 Ca -0.02 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 1k93 h VAL 792 Cb 0.17 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 1k93 h VAL 792 CO 0.04 0.08 -0.22 0.15 0.02 0.00 0.00 177.57 177.63 1k93 h PHE 793 N 0.42 -0.63 -0.67 1.57 3.57 -1.59 -2.72 116.94 116.90 1k93 h PHE 793 Ca 0.58 0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.28 1k93 h PHE 793 Cb 1.42 0.25 -0.12 0.00 2.79 0.00 0.00 35.95 40.29 1k93 h PHE 793 CO -0.00 -0.28 0.05 1.04 -2.23 0.00 0.00 178.31 176.89 1k93 n GLN 794 N -3.69 -0.05 -0.09 1.11 1.13 -0.87 0.74 117.38 115.66 1k93 n GLN 794 Ca -0.05 0.99 -0.14 0.00 -1.94 0.00 0.00 57.00 55.87 1k93 n GLN 794 Cb 0.19 -1.59 -0.04 0.00 0.11 0.00 0.00 30.24 28.91 1k93 n GLN 794 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1k93 h LYS 795 N 0.00 0.82 -0.77 -1.09 1.57 -1.58 -3.24 116.57 112.28 1k93 h LYS 795 Ca 0.42 -0.47 0.13 0.00 -1.87 0.00 0.00 60.65 58.86 1k93 h LYS 795 Cb 0.91 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 33.16 1k93 h LYS 795 CO -0.61 1.11 0.36 0.82 -0.57 0.00 0.00 179.45 180.55 1k93 h ILE 796 N 0.59 0.73 -0.63 1.86 1.08 0.64 -0.98 117.51 120.80 1k93 h ILE 796 Ca 0.04 -0.19 0.06 0.00 -0.39 0.00 0.00 64.86 64.38 1k93 h ILE 796 Cb 1.01 0.14 -0.05 0.00 -3.07 0.00 0.00 36.82 34.84 1k93 h ILE 796 CO 0.10 0.10 0.34 0.16 -0.69 0.00 0.00 178.15 178.15 1k93 h ILE 797 N 0.55 0.95 0.00 -0.67 -0.00 -1.53 -3.52 117.51 113.28 1k93 h ILE 797 Ca 0.41 -0.21 0.00 0.00 -0.00 0.00 0.00 64.86 65.06 1k93 h ILE 797 Cb 0.56 0.27 0.00 0.00 -0.00 0.00 0.00 36.82 37.65 1k93 h ILE 797 CO -0.35 0.11 0.00 0.47 -0.00 0.00 0.00 178.15 178.38