#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dg8 n ASP 284 N 0.00 -0.24 0.00 1.67 5.75 -1.26 -0.26 116.55 122.20 3dg8 n ASP 284 Ca 0.00 0.93 0.00 0.00 -0.01 0.00 0.00 54.79 55.71 3dg8 n ASP 284 Cb 0.00 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 39.83 3dg8 n ASP 284 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3dg8 n GLU 285 N -4.85 0.00 0.00 0.11 -0.58 -1.26 -2.47 120.64 111.59 3dg8 n GLU 285 Ca 0.08 0.71 0.10 0.00 -0.42 0.00 0.00 57.16 57.62 3dg8 n GLU 285 Cb 0.25 -1.45 0.61 0.00 -0.57 0.00 0.00 31.44 30.28 3dg8 n GLU 285 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3dg8 n GLU 286 N -2.34 0.97 -0.10 3.49 4.71 -0.67 -3.68 120.64 123.02 3dg8 n GLU 286 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 57.03 3dg8 n GLU 286 Cb 0.00 -1.33 -0.04 0.00 -1.01 0.00 0.00 31.44 29.06 3dg8 n GLU 286 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 3dg8 h GLU 287 N 0.00 0.59 -0.54 3.49 4.57 -0.30 -2.05 114.58 120.35 3dg8 h GLU 287 Ca 0.00 -0.24 -0.11 0.00 -1.18 0.00 0.00 59.36 57.83 3dg8 h GLU 287 Cb 0.00 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 3dg8 h GLU 287 CO 0.00 0.81 -0.09 -0.44 -1.18 0.00 0.00 179.01 178.11 3dg8 h ASP 288 N 0.35 0.98 -0.82 1.04 3.32 -1.63 -2.46 116.42 117.20 3dg8 h ASP 288 Ca 0.07 -0.31 0.13 0.00 0.02 0.00 0.00 57.03 56.94 3dg8 h ASP 288 Cb 0.61 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.83 3dg8 h ASP 288 CO 0.04 1.08 0.54 0.44 -1.72 0.00 0.00 179.24 179.61 3dg8 h ASP 289 N 0.88 0.57 -0.62 6.45 3.32 -1.68 0.79 116.42 126.13 3dg8 h ASP 289 Ca 0.14 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 3dg8 h ASP 289 Cb 0.64 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 3dg8 h ASP 289 CO 0.04 0.30 0.28 0.15 -1.72 0.00 0.00 179.24 178.29 3dg8 h PHE 290 N 0.61 0.91 -0.54 4.55 3.57 -0.88 -1.72 116.94 123.44 3dg8 h PHE 290 Ca 0.40 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.81 3dg8 h PHE 290 Cb 0.69 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 3dg8 h PHE 290 CO -0.00 0.71 0.19 0.28 -2.23 0.00 0.00 178.31 177.26 3dg8 h VAL 291 N 0.86 1.21 -0.23 1.41 2.07 -0.77 -2.83 116.25 117.95 3dg8 h VAL 291 Ca 0.21 -0.67 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 3dg8 h VAL 291 Cb 0.16 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 3dg8 h VAL 291 CO -0.02 0.26 -0.08 1.88 0.02 0.00 0.00 177.57 179.62 3dg8 h TYR 292 N 0.77 0.53 0.00 1.57 0.05 -0.81 -2.91 116.97 116.18 3dg8 h TYR 292 Ca 0.18 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.84 3dg8 h TYR 292 Cb 0.19 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 37.81 3dg8 h TYR 292 CO 0.01 0.72 0.00 1.19 -1.05 0.00 0.00 178.16 179.03 3dg8 n PHE 293 N -4.54 0.01 -1.16 4.88 3.01 -0.69 -1.25 117.46 117.72 3dg8 n PHE 293 Ca -0.04 0.01 0.04 0.00 1.01 0.00 0.00 57.45 58.46 3dg8 n PHE 293 Cb 0.32 -0.51 0.23 0.00 -0.01 0.00 0.00 39.48 39.51 3dg8 n PHE 293 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3dg8 n ASN 294 N -1.51 3.36 0.25 4.37 3.02 -1.09 -4.68 115.26 118.98 3dg8 n ASN 294 Ca 0.02 -3.29 0.11 0.00 -0.03 0.00 0.00 54.58 51.39 3dg8 n ASN 294 Cb 0.10 -0.58 0.68 0.00 -0.61 0.00 0.00 39.78 39.37 3dg8 n ASN 294 CO 0.00 0.00 0.00 2.19 -2.62 0.00 0.00 177.26 176.83 3dg8 h PHE 295 N 1.44 0.00 -0.01 3.10 -0.00 -1.14 -2.84 116.94 117.49 3dg8 h PHE 295 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.06 3dg8 h PHE 295 Cb 1.54 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.49 3dg8 h PHE 295 CO 0.68 0.13 -0.54 -1.71 -0.00 0.00 0.00 178.31 176.87 3dg8 n ASN 296 N -3.84 1.76 -4.67 -0.68 5.15 -1.26 -4.99 115.26 106.73 3dg8 n ASN 296 Ca -0.02 -1.38 -0.38 0.00 -0.60 0.00 0.00 54.58 52.20 3dg8 n ASN 296 Cb 0.23 0.58 0.05 0.00 -0.53 0.00 0.00 39.78 40.11 3dg8 n ASN 296 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3dg8 n LYS 297 N -0.31 1.13 -2.14 1.20 4.76 -1.07 -4.90 118.16 116.83 3dg8 n LYS 297 Ca 0.08 0.43 -0.42 0.00 -2.87 0.00 0.00 58.31 55.53 3dg8 n LYS 297 Cb 0.42 -2.34 -0.03 0.00 -1.84 0.00 0.00 35.03 31.24 3dg8 n LYS 297 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3dg8 s GLU 298 N -2.91 4.28 0.21 1.97 2.56 -1.26 -4.92 118.70 118.63 3dg8 s GLU 298 Ca 0.76 2.09 -0.08 0.00 0.00 0.00 0.00 54.97 57.74 3dg8 s GLU 298 Cb -0.41 -3.45 0.16 0.00 2.00 0.00 0.00 34.13 32.43 3dg8 s GLU 298 CO 0.46 -0.56 1.79 0.87 -0.56 0.00 0.00 175.26 177.27 3dg8 h LYS 299 N 7.52 1.17 -6.70 4.30 1.57 -1.98 -3.44 116.57 119.01 3dg8 h LYS 299 Ca -0.40 -0.19 -0.67 0.00 -1.87 0.00 0.00 60.65 57.52 3dg8 h LYS 299 Cb 1.19 -0.20 -0.20 0.00 0.08 0.00 0.00 32.23 33.11 3dg8 h LYS 299 CO 0.89 0.93 -0.84 -2.00 -0.57 0.00 0.00 179.45 177.86 3dg8 s GLU 300 N -5.63 1.49 0.23 3.15 2.56 -1.26 -5.12 118.70 114.12 3dg8 s GLU 300 Ca -0.13 -1.47 -0.30 0.00 0.00 0.00 0.00 54.97 53.07 3dg8 s GLU 300 Cb 0.16 -1.86 -0.09 0.00 2.00 0.00 0.00 34.13 34.33 3dg8 s GLU 300 CO 0.83 0.41 1.18 -1.21 -0.56 0.00 0.00 175.26 175.91 3dg8 s GLU 301 N -2.49 4.52 0.04 4.30 0.41 -1.26 -4.96 118.70 119.26 3dg8 s GLU 301 Ca 0.19 1.89 -0.08 0.00 -0.41 0.00 0.00 54.97 56.56 3dg8 s GLU 301 Cb -0.09 -3.20 -0.02 0.00 -1.78 0.00 0.00 34.13 29.04 3dg8 s GLU 301 CO 0.09 -0.00 0.94 1.17 -0.49 0.00 0.00 175.26 176.96 3dg8 n LYS 302 N 1.88 -0.11 -1.22 1.61 4.81 -1.14 -0.92 118.16 123.06 3dg8 n LYS 302 Ca 0.02 0.93 -0.27 0.00 -0.87 0.00 0.00 58.31 58.12 3dg8 n LYS 302 Cb 0.44 -1.38 0.14 0.00 0.02 0.00 0.00 35.03 34.25 3dg8 n LYS 302 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3dg8 n ASN 303 N -3.49 5.06 0.03 3.14 4.13 -0.73 -4.72 115.26 118.67 3dg8 n ASN 303 Ca 0.01 -3.61 -0.09 0.00 1.68 0.00 0.00 54.58 52.56 3dg8 n ASN 303 Cb 0.07 -0.88 -0.06 0.00 -1.54 0.00 0.00 39.78 37.36 3dg8 n ASN 303 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 3dg8 h LYS 304 N 1.30 -0.38 0.00 3.52 1.63 -1.22 -1.96 116.57 119.46 3dg8 h LYS 304 Ca 0.61 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.43 3dg8 h LYS 304 Cb 2.13 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.84 3dg8 h LYS 304 CO 1.23 -0.25 0.00 -0.91 -3.45 0.00 0.00 179.45 176.07 3dg8 h ASN 305 N -0.40 0.00 0.28 4.20 2.35 -1.84 0.43 115.58 120.60 3dg8 h ASN 305 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3dg8 h ASN 305 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 3dg8 h ASN 305 CO -0.22 0.00 -1.41 -1.54 -1.65 0.00 0.00 177.43 172.61 3dg8 n SER 306 N -2.52 0.45 -0.09 5.81 3.41 -1.01 -4.36 113.62 115.31 3dg8 n SER 306 Ca -0.01 -0.15 -0.09 0.00 -0.26 0.00 0.00 58.87 58.36 3dg8 n SER 306 Cb 0.12 1.26 -0.14 0.00 -0.26 0.00 0.00 64.21 65.19 3dg8 n SER 306 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3dg8 n ILE 307 N -2.13 1.21 -0.32 -1.33 2.08 -0.77 -5.05 119.36 113.05 3dg8 n ILE 307 Ca -0.01 -0.72 0.00 0.00 0.56 0.00 0.00 62.75 62.58 3dg8 n ILE 307 Cb 0.49 -0.59 0.00 0.00 -0.75 0.00 0.00 39.64 38.79 3dg8 n ILE 307 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 3dg8 n HIS 308 N -2.68 0.00 0.00 1.39 8.25 0.11 -4.78 115.22 117.50 3dg8 n HIS 308 Ca -0.29 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.17 3dg8 n HIS 308 Cb 1.06 -0.32 0.00 0.00 1.12 0.00 0.00 29.99 31.85 3dg8 n HIS 308 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3dg8 n PRO 309 N -2.00 0.00 0.00 -0.41 -0.02 -1.26 -3.93 135.00 127.38 3dg8 n PRO 309 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.57 3dg8 n PRO 309 Cb 0.00 0.00 0.53 0.00 -0.02 0.00 0.00 33.50 34.01 3dg8 n PRO 309 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3dg8 n ASN 310 N 0.00 0.00 0.15 2.55 2.85 -1.26 -0.22 115.26 119.33 3dg8 n ASN 310 Ca 0.00 -0.60 0.09 0.00 -0.11 0.00 0.00 54.58 53.96 3dg8 n ASN 310 Cb 0.00 0.00 0.06 0.00 1.24 0.00 0.00 39.78 41.08 3dg8 n ASN 310 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 3dg8 h ASP 311 N 0.00 0.00 -0.62 1.20 3.32 -1.87 -3.27 116.42 115.18 3dg8 h ASP 311 Ca 0.00 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.70 3dg8 h ASP 311 Cb 0.00 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 39.36 3dg8 h ASP 311 CO 0.00 0.13 0.44 0.49 -1.72 0.00 0.00 179.24 178.59 3dg8 n PHE 312 N -2.94 1.95 -0.26 4.55 3.72 0.69 -4.69 117.46 120.48 3dg8 n PHE 312 Ca 0.01 -1.56 0.00 0.00 -0.05 0.00 0.00 57.45 55.85 3dg8 n PHE 312 Cb 0.60 -0.78 0.07 0.00 -0.94 0.00 0.00 39.48 38.43 3dg8 n PHE 312 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3dg8 h GLN 313 N 0.86 -0.03 -0.74 -1.08 4.20 -1.67 0.13 115.11 116.78 3dg8 h GLN 313 Ca 0.40 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 59.06 3dg8 h GLN 313 Cb 1.87 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 29.62 3dg8 h GLN 313 CO 0.76 -0.02 0.27 0.82 -0.67 0.00 0.00 178.83 180.00 3dg8 h ILE 314 N -0.03 1.25 -0.48 2.54 2.04 -1.88 -0.71 117.51 120.24 3dg8 h ILE 314 Ca 0.34 -0.82 -0.11 0.00 1.00 0.00 0.00 64.86 65.27 3dg8 h ILE 314 Cb 0.56 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3dg8 h ILE 314 CO -0.78 0.33 -0.13 0.22 0.00 0.00 0.00 178.15 177.79 3dg8 h TYR 315 N 1.08 1.05 0.00 1.37 3.20 -1.25 -3.06 116.97 119.36 3dg8 h TYR 315 Ca 0.25 -0.23 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3dg8 h TYR 315 Cb 0.24 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.25 3dg8 h TYR 315 CO 0.02 1.02 -0.03 0.09 -1.64 0.00 0.00 178.16 177.62 3dg8 n ASN 316 N -4.21 0.79 0.18 -2.11 3.02 0.26 -3.34 115.26 109.86 3dg8 n ASN 316 Ca 0.00 0.55 0.08 0.00 -0.03 0.00 0.00 54.58 55.18 3dg8 n ASN 316 Cb 0.40 -0.75 0.11 0.00 -0.61 0.00 0.00 39.78 38.94 3dg8 n ASN 316 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3dg8 h SER 317 N 0.00 0.00 -2.65 6.41 4.64 -1.02 -3.45 113.55 117.48 3dg8 h SER 317 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 3dg8 h SER 317 Cb 0.73 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.83 3dg8 h SER 317 CO 0.00 0.23 1.04 -0.76 -0.87 0.00 0.00 176.83 176.47 3dg8 s LEU 318 N -6.33 4.35 -0.12 5.97 1.43 -1.21 -4.90 118.68 117.86 3dg8 s LEU 318 Ca 0.06 2.36 -0.25 0.00 -1.03 0.00 0.00 54.13 55.26 3dg8 s LEU 318 Cb 0.06 -3.55 -0.22 0.00 0.03 0.00 0.00 46.19 42.52 3dg8 s LEU 318 CO 0.70 -0.90 0.70 0.50 0.23 0.00 0.00 176.35 177.59 3dg8 h LYS 319 N 8.98 -0.01 -4.99 1.70 1.63 -1.91 -3.44 116.57 118.52 3dg8 h LYS 319 Ca -0.41 0.00 -0.67 0.00 -0.85 0.00 0.00 60.65 58.72 3dg8 h LYS 319 Cb 1.19 0.00 -0.32 0.00 -0.60 0.00 0.00 32.23 32.50 3dg8 h LYS 319 CO 0.94 0.80 -0.78 0.71 -3.45 0.00 0.00 179.45 177.67 3dg8 s TYR 320 N -2.31 2.93 -0.69 1.91 2.02 -1.26 -5.04 117.35 114.91 3dg8 s TYR 320 Ca -0.16 -1.41 0.05 0.00 -0.37 0.00 0.00 57.07 55.18 3dg8 s TYR 320 Cb -0.02 -2.02 0.18 0.00 -0.40 0.00 0.00 41.96 39.70 3dg8 s TYR 320 CO 0.59 -0.70 0.53 1.63 -1.57 0.00 0.00 175.55 176.03 3dg8 n LYS 321 N 4.69 1.89 0.00 -0.62 5.02 -1.26 -4.88 118.16 122.99 3dg8 n LYS 321 Ca -0.19 -4.47 0.12 0.00 -2.02 0.00 0.00 58.31 51.75 3dg8 n LYS 321 Cb 0.49 -2.26 0.16 0.00 -0.02 0.00 0.00 35.03 33.41 3dg8 n LYS 321 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3dg8 n TYR 322 N 1.79 0.00 -1.92 2.13 4.01 -1.26 -4.88 117.16 117.03 3dg8 n TYR 322 Ca 0.22 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.55 3dg8 n TYR 322 Cb 0.37 -0.02 -0.02 0.00 -0.31 0.00 0.00 39.34 39.36 3dg8 n TYR 322 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3dg8 s HIS 323 N -2.25 2.92 0.54 -0.72 2.46 -1.26 -4.88 115.29 112.10 3dg8 s HIS 323 Ca 0.25 0.92 0.26 0.00 0.47 0.00 0.00 55.06 56.96 3dg8 s HIS 323 Cb 0.19 -3.92 1.42 0.00 -0.13 0.00 0.00 32.58 30.14 3dg8 s HIS 323 CO 0.44 -3.05 2.00 -1.35 -2.47 0.00 0.00 174.74 170.31 3dg8 h PRO 324 N 5.03 0.00 0.00 2.88 0.11 -1.97 -1.25 132.00 136.80 3dg8 h PRO 324 Ca -0.46 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dg8 h PRO 324 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3dg8 h PRO 324 CO 0.79 0.00 -0.01 1.49 -0.21 0.00 0.00 178.00 180.06 3dg8 h GLU 325 N 0.00 0.00 0.00 1.05 4.81 -1.97 -0.88 114.58 117.60 3dg8 h GLU 325 Ca 0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 3dg8 h GLU 325 Cb 0.96 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.34 3dg8 h GLU 325 CO -0.00 0.01 0.00 0.66 -0.73 0.00 0.00 179.01 178.95 3dg8 n TYR 326 N -3.93 0.59 0.16 0.92 4.01 -0.47 -1.18 117.16 117.26 3dg8 n TYR 326 Ca -0.03 0.25 0.01 0.00 -0.16 0.00 0.00 57.90 57.97 3dg8 n TYR 326 Cb 0.09 -0.91 0.31 0.00 -0.31 0.00 0.00 39.34 38.53 3dg8 n TYR 326 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 3dg8 h GLN 327 N 0.00 0.04 0.00 -0.72 4.20 -1.33 0.23 115.11 117.53 3dg8 h GLN 327 Ca 0.00 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 3dg8 h GLN 327 Cb 0.23 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3dg8 h GLN 327 CO 0.00 0.45 -0.33 -0.92 -0.67 0.00 0.00 178.83 177.36 3dg8 h TYR 328 N 0.04 0.00 -0.80 2.96 3.20 -1.31 -3.30 116.97 117.76 3dg8 h TYR 328 Ca 0.00 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.88 3dg8 h TYR 328 Cb 0.74 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.97 3dg8 h TYR 328 CO 0.00 1.08 0.53 -0.07 -1.64 0.00 0.00 178.16 178.06 3dg8 h LEU 329 N -1.00 0.91 -1.76 2.82 3.38 -1.36 -1.94 115.31 116.35 3dg8 h LEU 329 Ca -0.09 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3dg8 h LEU 329 Cb 1.04 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 3dg8 h LEU 329 CO -0.05 0.65 -0.14 0.78 0.09 0.00 0.00 178.44 179.77 3dg8 h ASN 330 N 1.07 0.00 -0.10 -0.43 2.35 -0.71 -0.74 115.58 117.03 3dg8 h ASN 330 Ca 0.30 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.83 3dg8 h ASN 330 Cb -0.10 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.27 3dg8 h ASN 330 CO -0.07 0.14 -0.75 0.40 -1.65 0.00 0.00 177.43 175.50 3dg8 h ILE 331 N 0.00 1.29 -0.57 2.81 2.04 -1.45 -0.69 117.51 120.94 3dg8 h ILE 331 Ca -0.00 -1.97 -0.01 0.00 1.00 0.00 0.00 64.86 63.88 3dg8 h ILE 331 Cb 0.26 1.96 -0.03 0.00 -0.74 0.00 0.00 36.82 38.27 3dg8 h ILE 331 CO 0.02 0.62 0.33 0.40 0.00 0.00 0.00 178.15 179.52 3dg8 h ILE 332 N 0.52 1.18 -0.62 -0.67 1.08 -0.65 -1.15 117.51 117.19 3dg8 h ILE 332 Ca -0.04 -0.42 -0.05 0.00 -0.39 0.00 0.00 64.86 63.96 3dg8 h ILE 332 Cb 1.36 0.43 -0.03 0.00 -3.07 0.00 0.00 36.82 35.52 3dg8 h ILE 332 CO 0.15 0.19 0.19 0.22 -0.69 0.00 0.00 178.15 178.21 3dg8 h TYR 333 N 0.76 1.00 -0.37 1.37 3.20 -1.09 -1.47 116.97 120.38 3dg8 h TYR 333 Ca 0.20 -0.10 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 3dg8 h TYR 333 Cb 0.01 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 37.97 3dg8 h TYR 333 CO -0.02 0.82 0.09 0.22 -1.64 0.00 0.00 178.16 177.64 3dg8 h ASP 334 N 0.89 0.56 -0.32 -2.11 3.58 -0.67 -1.15 116.42 117.20 3dg8 h ASP 334 Ca 0.20 -0.23 -0.04 0.00 0.42 0.00 0.00 57.03 57.38 3dg8 h ASP 334 Cb 0.29 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 3dg8 h ASP 334 CO -0.01 0.64 0.05 0.40 -2.88 0.00 0.00 179.24 177.45 3dg8 h ILE 335 N 0.45 1.24 -0.59 2.25 2.04 -1.14 0.38 117.51 122.14 3dg8 h ILE 335 Ca 0.12 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 3dg8 h ILE 335 Cb 0.30 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 3dg8 h ILE 335 CO 0.00 0.28 0.35 0.24 0.00 0.00 0.00 178.15 179.02 3dg8 h MET 336 N 0.37 0.79 0.02 2.37 2.86 -1.19 0.99 114.93 121.14 3dg8 h MET 336 Ca 0.10 -0.07 -0.21 0.00 -2.06 0.00 0.00 59.70 57.46 3dg8 h MET 336 Cb 0.36 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 3dg8 h MET 336 CO 0.01 0.57 -0.93 0.52 1.06 0.00 0.00 176.91 178.13 3dg8 h MET 337 N 0.79 0.16 0.00 1.72 2.86 -1.07 -3.39 114.93 116.01 3dg8 h MET 337 Ca 0.21 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3dg8 h MET 337 Cb -0.02 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.70 3dg8 h MET 337 CO -0.04 0.98 0.00 0.09 1.06 0.00 0.00 176.91 179.00 3dg8 n ASN 338 N -3.60 0.76 -4.66 1.22 3.02 0.13 -1.78 115.26 110.35 3dg8 n ASN 338 Ca -0.04 -1.06 -0.36 0.00 -0.03 0.00 0.00 54.58 53.10 3dg8 n ASN 338 Cb 0.85 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 40.11 3dg8 n ASN 338 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dg8 n GLY 339 N -0.03 -0.06 3.70 7.41 0.00 0.34 -4.92 105.19 111.64 3dg8 n GLY 339 Ca 0.00 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.34 3dg8 n GLY 339 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dg8 s ASN 340 N -1.64 6.57 0.06 1.61 0.01 -0.70 -4.75 114.94 116.09 3dg8 s ASN 340 Ca 0.76 0.67 -0.31 0.00 -0.71 0.00 0.00 52.86 53.28 3dg8 s ASN 340 Cb -0.35 -2.25 -0.07 0.00 0.41 0.00 0.00 41.25 38.99 3dg8 s ASN 340 CO 0.47 -0.02 1.44 -0.54 -1.51 0.00 0.00 177.10 176.95 3dg8 s LYS 341 N 0.86 4.28 0.02 -0.60 1.02 -1.26 -1.91 119.74 122.16 3dg8 s LYS 341 Ca 0.22 2.08 -0.08 0.00 0.02 0.00 0.00 55.97 58.21 3dg8 s LYS 341 Cb -0.15 -3.44 0.00 0.00 -0.52 0.00 0.00 37.83 33.73 3dg8 s LYS 341 CO 0.08 -0.55 0.17 -0.65 -0.92 0.00 0.00 175.35 173.48 3dg8 s GLN 342 N 1.91 0.59 -0.36 1.68 -0.21 -0.63 -5.00 119.66 117.64 3dg8 s GLN 342 Ca 0.66 -0.52 0.01 0.00 0.02 0.00 0.00 55.36 55.54 3dg8 s GLN 342 Cb -0.35 0.24 0.11 0.00 1.00 0.00 0.00 33.01 34.01 3dg8 s GLN 342 CO 0.29 -0.16 0.13 -1.12 -2.12 0.00 0.00 175.29 172.31 3dg8 s SER 343 N -1.74 4.11 0.57 5.90 0.01 -1.26 -1.23 113.70 120.07 3dg8 s SER 343 Ca -0.10 -2.06 -0.17 0.00 1.31 0.00 0.00 55.95 54.93 3dg8 s SER 343 Cb -0.04 -1.11 -0.05 0.00 0.21 0.00 0.00 66.02 65.03 3dg8 s SER 343 CO -0.01 -0.36 1.06 1.51 0.41 0.00 0.00 173.24 175.85 3dg8 s ASP 344 N 1.06 5.83 0.00 2.44 1.47 -1.18 -4.77 116.67 121.51 3dg8 s ASP 344 Ca 0.12 1.89 0.00 0.00 1.18 0.00 0.00 52.55 55.74 3dg8 s ASP 344 Cb -0.20 -2.54 0.00 0.00 -0.34 0.00 0.00 42.92 39.84 3dg8 s ASP 344 CO -0.14 -1.13 0.00 -1.14 0.68 0.00 0.00 175.17 173.44 3dg8 n ARG 345 N -1.78 0.00 0.27 2.11 0.63 -1.26 0.17 116.66 116.81 3dg8 n ARG 345 Ca 0.09 0.00 0.18 0.00 -0.92 0.00 0.00 57.85 57.21 3dg8 n ARG 345 Cb 0.52 0.00 0.93 0.00 0.45 0.00 0.00 32.46 34.37 3dg8 n ARG 345 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 3dg8 h THR 346 N 0.00 0.00 0.00 5.15 1.35 -2.05 -3.45 112.91 113.92 3dg8 h THR 346 Ca 0.00 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 3dg8 h THR 346 Cb 0.00 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 3dg8 h THR 346 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3dg8 n GLY 347 N -0.84 0.72 3.76 5.82 0.00 0.13 -5.05 105.19 109.72 3dg8 n GLY 347 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 3dg8 n GLY 347 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dg8 s VAL 348 N -2.20 2.57 -0.01 1.61 1.01 -1.25 -4.86 120.40 117.28 3dg8 s VAL 348 Ca 0.00 0.43 -0.02 0.00 0.00 0.00 0.00 61.98 62.39 3dg8 s VAL 348 Cb 0.00 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 3dg8 s VAL 348 CO 0.00 0.00 0.16 -0.83 0.00 0.00 0.00 175.10 174.43 3dg8 s GLY 349 N -1.10 2.14 0.13 4.51 0.00 -1.26 -3.13 107.32 108.62 3dg8 s GLY 349 Ca 0.66 -0.79 -0.08 0.00 0.00 0.00 0.00 44.72 44.52 3dg8 s GLY 349 CO 0.42 -0.67 0.22 -1.34 0.00 0.00 0.00 173.10 171.73 3dg8 s VAL 350 N -1.29 0.10 -0.11 1.40 -7.23 -0.36 -1.14 120.40 111.76 3dg8 s VAL 350 Ca 0.26 -1.38 0.03 0.00 -1.81 0.00 0.00 61.98 59.08 3dg8 s VAL 350 Cb -0.12 -1.68 -0.00 0.00 0.56 0.00 0.00 36.38 35.14 3dg8 s VAL 350 CO 0.18 -0.46 -0.21 -0.76 -0.31 0.00 0.00 175.10 173.53 3dg8 s LEU 351 N -2.94 2.22 0.03 1.32 1.43 0.12 -1.61 118.68 119.25 3dg8 s LEU 351 Ca 0.13 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 3dg8 s LEU 351 Cb 0.04 -1.46 -0.02 0.00 0.03 0.00 0.00 46.19 44.79 3dg8 s LEU 351 CO -0.04 0.14 -0.06 -0.94 0.23 0.00 0.00 176.35 175.68 3dg8 s SER 352 N 0.44 0.64 0.31 2.29 1.04 -0.80 -0.52 113.70 117.10 3dg8 s SER 352 Ca -0.15 -0.46 0.03 0.00 0.48 0.00 0.00 55.95 55.85 3dg8 s SER 352 Cb -0.17 0.04 -0.06 0.00 0.10 0.00 0.00 66.02 65.93 3dg8 s SER 352 CO 0.06 -0.19 0.06 -0.54 0.98 0.00 0.00 173.24 173.61 3dg8 s LYS 353 N -1.31 1.59 -0.19 4.02 -0.14 -0.14 -1.73 119.74 121.85 3dg8 s LYS 353 Ca -0.10 -1.87 -0.00 0.00 -1.36 0.00 0.00 55.97 52.64 3dg8 s LYS 353 Cb -0.09 -0.76 0.05 0.00 -1.68 0.00 0.00 37.83 35.35 3dg8 s LYS 353 CO -0.00 -0.19 -0.05 0.12 -0.76 0.00 0.00 175.35 174.46 3dg8 s PHE 354 N -3.38 1.91 0.00 3.18 5.36 -1.26 -1.91 117.98 121.88 3dg8 s PHE 354 Ca 0.36 -1.29 0.00 0.00 -0.96 0.00 0.00 56.93 55.05 3dg8 s PHE 354 Cb 0.08 -1.40 0.00 0.00 -0.34 0.00 0.00 43.02 41.36 3dg8 s PHE 354 CO 0.15 -0.67 0.00 0.41 -1.46 0.00 0.00 175.22 173.65 3dg8 n GLY 355 N 4.82 -0.99 3.25 13.12 0.00 -0.67 -5.04 105.19 119.67 3dg8 n GLY 355 Ca -0.12 -0.61 -0.14 0.00 0.00 0.00 0.00 46.02 45.15 3dg8 n GLY 355 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dg8 s TYR 356 N 0.00 1.25 -0.05 1.61 2.02 -0.77 -4.98 117.35 116.43 3dg8 s TYR 356 Ca 0.00 -0.76 -0.02 0.00 -0.37 0.00 0.00 57.07 55.91 3dg8 s TYR 356 Cb 0.00 -0.64 0.03 0.00 -0.40 0.00 0.00 41.96 40.95 3dg8 s TYR 356 CO 0.00 0.07 0.11 -1.50 -1.57 0.00 0.00 175.55 172.66 3dg8 s ILE 357 N -3.34 -0.04 0.09 2.71 2.07 -1.26 -0.91 121.20 120.53 3dg8 s ILE 357 Ca 0.16 0.15 0.09 0.00 -1.41 0.00 0.00 60.65 59.64 3dg8 s ILE 357 Cb 0.03 -0.18 -0.03 0.00 0.13 0.00 0.00 42.46 42.40 3dg8 s ILE 357 CO 0.00 0.06 -0.23 -0.04 -1.91 0.00 0.00 174.94 172.82 3dg8 s MET 358 N 0.88 1.32 -0.04 3.50 -1.94 0.79 -4.97 119.30 118.84 3dg8 s MET 358 Ca -0.07 -1.18 0.01 0.00 -1.71 0.00 0.00 55.69 52.75 3dg8 s MET 358 Cb -0.09 -1.62 0.02 0.00 2.01 0.00 0.00 34.83 35.14 3dg8 s MET 358 CO -0.04 0.39 -0.05 0.15 -0.01 0.00 0.00 175.02 175.46 3dg8 s LYS 359 N -1.76 0.83 -0.04 2.03 1.02 -1.26 -0.22 119.74 120.33 3dg8 s LYS 359 Ca 0.09 -0.15 0.04 0.00 0.02 0.00 0.00 55.97 55.98 3dg8 s LYS 359 Cb -0.10 -0.81 -0.00 0.00 -0.52 0.00 0.00 37.83 36.40 3dg8 s LYS 359 CO 0.04 -0.03 -0.18 -0.06 -0.92 0.00 0.00 175.35 174.20 3dg8 s PHE 360 N 0.70 1.75 -0.69 3.18 0.08 -0.37 -4.98 117.98 117.65 3dg8 s PHE 360 Ca -0.10 -0.50 -0.21 0.00 0.12 0.00 0.00 56.93 56.24 3dg8 s PHE 360 Cb -0.13 -1.18 0.09 0.00 -0.57 0.00 0.00 43.02 41.23 3dg8 s PHE 360 CO 0.00 -0.17 0.94 0.34 -0.10 0.00 0.00 175.22 176.24 3dg8 s ASP 361 N 0.02 6.25 0.16 1.36 -1.08 -1.26 -1.46 116.67 120.65 3dg8 s ASP 361 Ca -0.04 -1.25 0.19 0.00 -0.52 0.00 0.00 52.55 50.93 3dg8 s ASP 361 Cb -0.12 -2.39 0.81 0.00 -1.46 0.00 0.00 42.92 39.76 3dg8 s ASP 361 CO 0.02 -1.32 1.57 0.18 0.52 0.00 0.00 175.17 176.14 3dg8 n LEU 362 N 7.26 0.38 0.08 -1.34 4.77 0.17 -2.12 117.00 126.20 3dg8 n LEU 362 Ca -0.00 0.61 0.13 0.00 -0.03 0.00 0.00 56.01 56.71 3dg8 n LEU 362 Cb 0.45 -0.57 0.32 0.00 -2.33 0.00 0.00 43.42 41.29 3dg8 n LEU 362 CO 0.61 -0.49 0.66 -1.54 -1.33 0.00 0.00 177.39 175.29 3dg8 n SER 363 N -1.94 0.71 -0.00 -1.43 3.41 -1.21 -3.83 113.62 109.33 3dg8 n SER 363 Ca 0.02 0.35 0.05 0.00 -0.26 0.00 0.00 58.87 59.03 3dg8 n SER 363 Cb 0.17 -0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 63.71 3dg8 n SER 363 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dg8 n GLN 364 N -2.13 2.70 0.00 4.33 1.13 -0.90 -5.08 117.38 117.43 3dg8 n GLN 364 Ca 0.05 -0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 3dg8 n GLN 364 Cb 0.43 -1.04 0.00 0.00 0.11 0.00 0.00 30.24 29.74 3dg8 n GLN 364 CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 3dg8 n TYR 365 N -1.43 0.00 -3.67 1.08 0.18 -1.05 -5.04 117.16 107.23 3dg8 n TYR 365 Ca 0.01 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.41 3dg8 n TYR 365 Cb 0.18 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.02 3dg8 n TYR 365 CO 0.00 0.00 0.00 0.12 -2.08 0.00 0.00 176.86 174.90 3dg8 s PHE 366 N -2.00 3.16 -1.05 -3.48 5.36 -0.58 -4.17 117.98 115.22 3dg8 s PHE 366 Ca 0.00 -0.42 -0.08 0.00 -0.96 0.00 0.00 56.93 55.47 3dg8 s PHE 366 Cb 0.00 -2.33 -0.06 0.00 -0.34 0.00 0.00 43.02 40.28 3dg8 s PHE 366 CO 0.00 -0.39 2.26 -0.35 -1.46 0.00 0.00 175.22 175.28 3dg8 n PRO 367 N 4.98 2.36 -3.27 10.12 -0.04 -1.26 -3.89 135.00 144.00 3dg8 n PRO 367 Ca -0.14 -1.65 -0.43 0.00 -0.04 0.00 0.00 63.50 61.24 3dg8 n PRO 367 Cb 0.50 -2.57 -0.08 0.00 -0.04 0.00 0.00 33.50 31.31 3dg8 n PRO 367 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3dg8 s LEU 368 N 0.23 4.73 0.15 1.53 2.96 -1.26 -4.53 118.68 122.49 3dg8 s LEU 368 Ca 0.46 -0.53 -0.31 0.00 -0.22 0.00 0.00 54.13 53.53 3dg8 s LEU 368 Cb 0.12 -2.48 -0.18 0.00 0.50 0.00 0.00 46.19 44.15 3dg8 s LEU 368 CO -0.03 -0.61 0.65 0.18 -1.32 0.00 0.00 176.35 175.23 3dg8 n LEU 369 N 5.76 -0.93 -0.00 -0.68 4.77 -1.26 -4.79 117.00 119.87 3dg8 n LEU 369 Ca -0.06 1.14 0.04 0.00 -0.03 0.00 0.00 56.01 57.10 3dg8 n LEU 369 Cb 0.48 -0.95 -0.05 0.00 -2.33 0.00 0.00 43.42 40.57 3dg8 n LEU 369 CO 0.47 -2.72 -0.13 0.35 -1.33 0.00 0.00 177.39 174.04 3dg8 n THR 370 N 0.36 0.00 1.59 -5.08 -2.24 -1.26 -4.52 114.28 103.13 3dg8 n THR 370 Ca 0.18 -0.28 0.02 0.00 -2.27 0.00 0.00 64.05 61.71 3dg8 n THR 370 Cb 0.21 0.87 0.11 0.00 -2.10 0.00 0.00 70.33 69.42 3dg8 n THR 370 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3dg8 n THR 371 N -1.32 0.00 -3.65 4.28 -2.24 -1.26 -0.86 114.28 109.23 3dg8 n THR 371 Ca 0.01 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.76 3dg8 n THR 371 Cb 0.16 -0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 68.20 3dg8 n THR 371 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3dg8 s LYS 372 N -2.00 0.77 -0.05 -0.78 -2.85 -1.26 -4.70 119.74 108.87 3dg8 s LYS 372 Ca 0.05 -0.39 -0.21 0.00 -1.00 0.00 0.00 55.97 54.42 3dg8 s LYS 372 Cb 0.02 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 36.04 3dg8 s LYS 372 CO 0.04 -0.35 0.61 0.21 0.10 0.00 0.00 175.35 175.96 3dg8 s LYS 373 N -2.88 4.37 0.00 1.78 2.20 -1.22 -4.54 119.74 119.44 3dg8 s LYS 373 Ca 0.11 0.72 0.06 0.00 -0.36 0.00 0.00 55.97 56.50 3dg8 s LYS 373 Cb 0.01 -3.40 -0.02 0.00 -1.51 0.00 0.00 37.83 32.91 3dg8 s LYS 373 CO -0.03 0.21 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.49 3dg8 s LEU 374 N 0.36 2.07 -0.08 5.43 1.43 -1.26 -4.78 118.68 121.84 3dg8 s LEU 374 Ca 0.32 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 3dg8 s LEU 374 Cb -0.17 -0.86 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 3dg8 s LEU 374 CO 0.16 0.18 -0.07 -0.36 0.23 0.00 0.00 176.35 176.49 3dg8 s PHE 375 N -0.51 2.95 -0.76 0.29 0.08 -1.26 -5.05 117.98 113.72 3dg8 s PHE 375 Ca 0.06 -0.06 0.08 0.00 0.12 0.00 0.00 56.93 57.13 3dg8 s PHE 375 Cb -0.07 -1.76 0.01 0.00 -0.57 0.00 0.00 43.02 40.64 3dg8 s PHE 375 CO -0.00 0.25 0.59 1.28 -0.10 0.00 0.00 175.22 177.24 3dg8 n LEU 376 N 2.49 1.19 0.10 -0.37 4.77 -1.26 -4.71 117.00 119.21 3dg8 n LEU 376 Ca -0.18 -0.82 -0.12 0.00 -0.03 0.00 0.00 56.01 54.86 3dg8 n LEU 376 Cb 0.53 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.56 3dg8 n LEU 376 CO 0.28 0.24 0.73 -0.09 -1.33 0.00 0.00 177.39 177.22 3dg8 h ARG 377 N 1.01 -0.37 -0.42 3.23 2.43 -2.00 -1.53 114.38 116.73 3dg8 h ARG 377 Ca 0.00 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.28 3dg8 h ARG 377 Cb 0.27 0.08 -0.08 0.00 -0.42 0.00 0.00 29.97 29.83 3dg8 h ARG 377 CO 0.00 -0.25 -0.12 0.78 -1.51 0.00 0.00 179.97 178.88 3dg8 h GLY 378 N -0.39 0.28 2.00 2.80 0.00 -1.95 -1.27 103.07 104.55 3dg8 h GLY 378 Ca 0.03 0.15 -0.04 0.00 0.00 0.00 0.00 47.33 47.47 3dg8 h GLY 378 CO -0.12 -0.17 -0.21 0.16 0.00 0.00 0.00 176.54 176.20 3dg8 h ILE 379 N -0.01 0.61 -0.05 2.60 3.07 -1.79 -1.75 117.51 120.18 3dg8 h ILE 379 Ca 0.20 -0.95 -0.07 0.00 1.55 0.00 0.00 64.86 65.59 3dg8 h ILE 379 Cb 0.32 1.63 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 3dg8 h ILE 379 CO -0.44 0.20 -0.26 0.40 -1.05 0.00 0.00 178.15 177.00 3dg8 h ILE 380 N 0.00 1.46 -1.00 0.16 2.04 -0.52 -2.27 117.51 117.37 3dg8 h ILE 380 Ca -0.00 -1.72 0.08 0.00 1.00 0.00 0.00 64.86 64.22 3dg8 h ILE 380 Cb 0.61 2.42 -0.07 0.00 -0.74 0.00 0.00 36.82 39.04 3dg8 h ILE 380 CO 0.03 0.48 0.64 -0.33 0.00 0.00 0.00 178.15 178.97 3dg8 h GLU 381 N -0.28 1.09 -0.57 2.37 4.39 -1.04 0.17 114.58 120.72 3dg8 h GLU 381 Ca -0.02 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 3dg8 h GLU 381 Cb 0.92 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 29.30 3dg8 h GLU 381 CO 0.05 0.72 0.30 1.49 -1.16 0.00 0.00 179.01 180.42 3dg8 h GLU 382 N 1.12 0.79 -0.35 2.33 4.81 -1.29 0.32 114.58 122.31 3dg8 h GLU 382 Ca 0.45 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 3dg8 h GLU 382 Cb 0.26 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 3dg8 h GLU 382 CO -0.20 0.62 0.18 1.25 -0.73 0.00 0.00 179.01 180.13 3dg8 h LEU 383 N 0.76 0.45 -1.15 1.64 5.85 -0.51 0.25 115.31 122.60 3dg8 h LEU 383 Ca 0.20 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 3dg8 h LEU 383 Cb 0.06 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3dg8 h LEU 383 CO -0.03 0.44 0.14 -0.07 -0.34 0.00 0.00 178.44 178.58 3dg8 h LEU 384 N 0.43 0.68 -0.31 2.25 3.38 -0.27 -1.46 115.31 120.02 3dg8 h LEU 384 Ca 0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3dg8 h LEU 384 Cb 0.10 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3dg8 h LEU 384 CO -0.02 0.66 0.14 -0.25 0.09 0.00 0.00 178.44 179.06 3dg8 h TRP 385 N 0.72 0.46 -0.57 1.13 7.01 0.43 -2.29 115.95 122.84 3dg8 h TRP 385 Ca 0.16 -0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.15 3dg8 h TRP 385 Cb 0.23 -0.14 -0.03 0.00 -2.10 0.00 0.00 29.16 27.12 3dg8 h TRP 385 CO 0.01 0.42 0.36 0.74 -2.79 0.00 0.00 178.44 177.19 3dg8 h PHE 386 N 0.36 0.69 -0.45 2.65 0.04 0.08 -2.72 116.94 117.59 3dg8 h PHE 386 Ca 0.10 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.89 3dg8 h PHE 386 Cb 0.15 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.05 3dg8 h PHE 386 CO -0.01 0.41 0.27 0.82 -0.60 0.00 0.00 178.31 179.20 3dg8 h ILE 387 N 0.73 1.13 0.00 -0.55 2.04 -1.02 0.69 117.51 120.53 3dg8 h ILE 387 Ca 0.22 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.81 3dg8 h ILE 387 Cb -0.04 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 3dg8 h ILE 387 CO -0.07 0.13 0.00 0.54 0.00 0.00 0.00 178.15 178.75 3dg8 n ARG 388 N -4.45 0.25 -1.08 2.37 1.74 -0.88 -4.89 116.66 109.72 3dg8 n ARG 388 Ca 0.04 0.04 -0.03 0.00 -0.77 0.00 0.00 57.85 57.13 3dg8 n ARG 388 Cb 0.07 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.00 3dg8 n ARG 388 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dg8 n GLY 389 N 1.03 0.60 3.78 -0.13 0.00 0.23 -5.02 105.19 105.68 3dg8 n GLY 389 Ca 0.10 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 3dg8 n GLY 389 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dg8 s GLU 390 N -1.67 2.72 0.00 1.61 2.02 -1.09 -3.65 118.70 118.64 3dg8 s GLU 390 Ca 0.00 1.30 0.00 0.00 0.02 0.00 0.00 54.97 56.29 3dg8 s GLU 390 Cb 0.00 -1.95 0.00 0.00 0.10 0.00 0.00 34.13 32.28 3dg8 s GLU 390 CO 0.00 -1.30 0.39 0.25 0.02 0.00 0.00 175.26 174.62 3dg8 n THR 391 N -2.69 0.00 -2.93 3.63 -2.24 -1.26 -4.17 114.28 104.62 3dg8 n THR 391 Ca 0.10 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.45 3dg8 n THR 391 Cb 0.52 1.13 -0.05 0.00 -2.10 0.00 0.00 70.33 69.83 3dg8 n THR 391 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3dg8 s ASN 392 N 0.00 6.35 0.55 3.42 3.84 -1.26 -2.17 114.94 125.67 3dg8 s ASN 392 Ca 0.00 -0.34 0.27 0.00 0.21 0.00 0.00 52.86 53.00 3dg8 s ASN 392 Cb 0.00 -2.40 1.61 0.00 -0.55 0.00 0.00 41.25 39.91 3dg8 s ASN 392 CO 0.00 -1.07 2.18 1.23 -2.79 0.00 0.00 177.10 176.65 3dg8 h GLY 393 N 10.49 0.00 1.40 1.21 0.00 -0.93 -2.84 103.07 112.40 3dg8 h GLY 393 Ca -0.26 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 3dg8 h GLY 393 CO 1.02 0.00 0.30 3.43 0.00 0.00 0.00 176.54 181.30 3dg8 h ASN 394 N 0.00 0.70 -0.95 0.19 -0.26 -1.92 -2.05 115.58 111.29 3dg8 h ASN 394 Ca -0.00 -0.05 0.08 0.00 -0.56 0.00 0.00 56.30 55.76 3dg8 h ASN 394 Cb 0.12 -0.18 -0.07 0.00 -1.06 0.00 0.00 38.32 37.13 3dg8 h ASN 394 CO 0.01 0.57 0.60 0.74 -1.06 0.00 0.00 177.43 178.29 3dg8 h THR 395 N 0.79 1.04 -0.11 2.81 2.02 -1.90 0.23 112.91 117.78 3dg8 h THR 395 Ca 0.20 -0.37 -0.15 0.00 0.77 0.00 0.00 66.41 66.87 3dg8 h THR 395 Cb 0.03 -0.12 0.01 0.00 -1.74 0.00 0.00 68.15 66.33 3dg8 h THR 395 CO -0.03 0.19 -0.52 -0.07 0.37 0.00 0.00 175.52 175.46 3dg8 h LEU 396 N 1.06 0.66 -0.98 2.58 3.38 -1.56 -3.23 115.31 117.22 3dg8 h LEU 396 Ca 0.43 -0.63 0.01 0.00 0.09 0.00 0.00 57.88 57.77 3dg8 h LEU 396 Cb 0.23 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 3dg8 h LEU 396 CO -0.19 1.18 0.63 -0.07 0.09 0.00 0.00 178.44 180.08 3dg8 h LEU 397 N 0.17 1.14 0.00 1.67 3.38 -0.83 0.42 115.31 121.27 3dg8 h LEU 397 Ca -0.03 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3dg8 h LEU 397 Cb 1.16 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.62 3dg8 h LEU 397 CO 0.11 0.84 0.00 0.59 0.09 0.00 0.00 178.44 180.07 3dg8 n ASN 398 N -4.38 0.00 -0.67 -0.43 3.02 0.02 -0.23 115.26 112.59 3dg8 n ASN 398 Ca 0.11 0.41 0.06 0.00 -0.03 0.00 0.00 54.58 55.13 3dg8 n ASN 398 Cb 0.03 -0.45 0.15 0.00 -0.61 0.00 0.00 39.78 38.89 3dg8 n ASN 398 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3dg8 n LYS 399 N -1.45 2.53 -3.31 3.52 5.02 -0.47 -4.97 118.16 119.03 3dg8 n LYS 399 Ca 0.04 -1.97 -0.24 0.00 -2.02 0.00 0.00 58.31 54.12 3dg8 n LYS 399 Cb 0.14 -1.29 0.05 0.00 -0.02 0.00 0.00 35.03 33.91 3dg8 n LYS 399 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3dg8 n ASN 400 N 0.63 -6.02 -4.34 4.39 3.02 0.68 -4.97 115.26 108.65 3dg8 n ASN 400 Ca 0.12 -0.42 -0.39 0.00 -0.03 0.00 0.00 54.58 53.86 3dg8 n ASN 400 Cb 0.42 -4.81 -0.12 0.00 -0.61 0.00 0.00 39.78 34.66 3dg8 n ASN 400 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dg8 s VAL 401 N -3.23 4.16 -0.27 2.41 1.01 0.01 -4.98 120.40 119.52 3dg8 s VAL 401 Ca 0.44 -0.87 0.11 0.00 0.00 0.00 0.00 61.98 61.66 3dg8 s VAL 401 Cb -0.20 -3.27 0.54 0.00 0.00 0.00 0.00 36.38 33.45 3dg8 s VAL 401 CO 0.54 -0.11 1.50 0.54 0.00 0.00 0.00 175.10 177.58 3dg8 n ARG 402 N 4.90 2.33 -0.25 2.72 1.74 -1.26 -3.42 116.66 123.43 3dg8 n ARG 402 Ca -0.13 -3.05 0.08 0.00 -0.77 0.00 0.00 57.85 53.98 3dg8 n ARG 402 Cb 0.46 -1.88 0.33 0.00 -1.02 0.00 0.00 32.46 30.36 3dg8 n ARG 402 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3dg8 h ILE 403 N 1.35 0.97 -0.37 0.55 2.04 -1.96 -2.78 117.51 117.32 3dg8 h ILE 403 Ca 0.18 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.76 3dg8 h ILE 403 Cb 1.72 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 3dg8 h ILE 403 CO 0.41 0.15 0.00 0.79 0.00 0.00 0.00 178.15 179.50 3dg8 n TRP 404 N -4.51 0.48 0.02 1.37 7.02 -1.26 -4.73 117.44 115.83 3dg8 n TRP 404 Ca 0.14 -0.41 -0.11 0.00 -1.02 0.00 0.00 57.50 56.10 3dg8 n TRP 404 Cb 0.30 -0.02 -0.05 0.00 -2.42 0.00 0.00 31.31 29.12 3dg8 n TRP 404 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 3dg8 h GLU 405 N 2.64 -0.06 0.00 -0.99 4.81 -1.81 -2.55 114.58 116.62 3dg8 h GLU 405 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3dg8 h GLU 405 Cb 0.76 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.15 3dg8 h GLU 405 CO 0.00 -0.04 -0.13 0.00 -0.73 0.00 0.00 179.01 178.11 3dg8 h ALA 406 N 0.99 1.52 0.00 2.92 0.00 -1.85 -1.71 119.26 121.13 3dg8 h ALA 406 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3dg8 h ALA 406 Cb 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3dg8 h ALA 406 CO -0.10 0.16 0.00 0.09 0.00 0.00 0.00 179.25 179.41 3dg8 n ASN 407 N -4.00 0.38 -0.79 0.00 3.02 -0.98 -3.69 115.26 109.20 3dg8 n ASN 407 Ca -0.02 0.54 0.07 0.00 -0.03 0.00 0.00 54.58 55.14 3dg8 n ASN 407 Cb 0.22 -0.64 0.17 0.00 -0.61 0.00 0.00 39.78 38.92 3dg8 n ASN 407 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dg8 n GLY 408 N 1.30 2.17 3.80 7.41 0.00 -0.64 -4.56 105.19 114.67 3dg8 n GLY 408 Ca 0.06 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 3dg8 n GLY 408 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dg8 s THR 409 N -1.04 3.83 0.18 2.61 -4.23 -1.21 -0.35 115.64 115.42 3dg8 s THR 409 Ca 0.28 0.88 -0.17 0.00 -1.18 0.00 0.00 61.69 61.49 3dg8 s THR 409 Cb 0.15 -3.40 0.12 0.00 1.34 0.00 0.00 72.50 70.72 3dg8 s THR 409 CO 0.20 -0.50 1.64 -0.09 -0.54 0.00 0.00 174.62 175.33 3dg8 h ARG 410 N 0.49 -0.06 -0.52 3.99 9.65 -1.95 -0.51 114.38 125.47 3dg8 h ARG 410 Ca -0.47 0.00 0.06 0.00 -1.10 0.00 0.00 59.98 58.47 3dg8 h ARG 410 Cb 1.22 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.76 3dg8 h ARG 410 CO 0.58 -0.04 0.24 0.93 2.80 0.00 0.00 179.97 184.48 3dg8 h GLU 411 N -0.06 0.45 -0.30 0.20 3.07 -1.96 0.91 114.58 116.89 3dg8 h GLU 411 Ca 0.21 -0.03 -0.12 0.00 -0.50 0.00 0.00 59.36 58.93 3dg8 h GLU 411 Cb 0.39 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.19 3dg8 h GLU 411 CO -0.49 0.30 -0.29 0.35 -1.40 0.00 0.00 179.01 177.48 3dg8 h PHE 412 N 0.46 0.86 -0.73 4.33 3.04 -1.66 -2.08 116.94 121.16 3dg8 h PHE 412 Ca 0.24 -0.26 -0.04 0.00 3.98 0.00 0.00 57.97 61.89 3dg8 h PHE 412 Cb 0.19 -0.18 -0.03 0.00 2.56 0.00 0.00 35.95 38.49 3dg8 h PHE 412 CO -0.12 1.01 0.31 -0.07 -2.02 0.00 0.00 178.31 177.42 3dg8 h LEU 413 N 0.47 1.00 -0.83 0.59 3.38 -0.91 -1.96 115.31 117.05 3dg8 h LEU 413 Ca 0.05 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3dg8 h LEU 413 Cb 0.86 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 3dg8 h LEU 413 CO 0.07 0.88 0.52 0.44 0.09 0.00 0.00 178.44 180.45 3dg8 h ASP 414 N 1.04 0.97 1.08 -0.43 3.32 -0.72 0.28 116.42 121.96 3dg8 h ASP 414 Ca 0.25 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.25 3dg8 h ASP 414 Cb 0.19 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3dg8 h ASP 414 CO -0.02 0.73 0.00 0.78 -1.72 0.00 0.00 179.24 179.01 3dg8 h ASN 415 N 1.13 0.00 0.17 6.45 4.21 -0.96 0.53 115.58 127.11 3dg8 h ASN 415 Ca 0.30 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.81 3dg8 h ASN 415 Cb -0.08 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.12 3dg8 h ASN 415 CO -0.06 0.00 -0.08 0.54 -1.29 0.00 0.00 177.43 176.54 3dg8 n ARG 416 N -2.76 1.05 -2.15 0.81 5.12 -0.55 -4.89 116.66 113.28 3dg8 n ARG 416 Ca 0.02 -0.45 -0.09 0.00 -1.93 0.00 0.00 57.85 55.39 3dg8 n ARG 416 Cb 0.32 -1.49 -0.01 0.00 -1.16 0.00 0.00 32.46 30.12 3dg8 n ARG 416 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3dg8 n LYS 417 N -0.58 -0.73 -2.69 5.56 5.02 0.18 -4.94 118.16 119.97 3dg8 n LYS 417 Ca 0.17 0.46 -0.39 0.00 -2.02 0.00 0.00 58.31 56.52 3dg8 n LYS 417 Cb 0.29 -4.46 0.01 0.00 -0.02 0.00 0.00 35.03 30.84 3dg8 n LYS 417 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3dg8 n LEU 418 N -1.31 6.94 0.28 -0.35 4.77 0.87 -4.77 117.00 123.42 3dg8 n LEU 418 Ca -0.11 -5.43 0.13 0.00 -0.03 0.00 0.00 56.01 50.58 3dg8 n LEU 418 Cb 0.58 -1.09 0.80 0.00 -2.33 0.00 0.00 43.42 41.38 3dg8 n LEU 418 CO 0.13 2.09 1.04 -0.26 -1.33 0.00 0.00 177.39 179.05 3dg8 h PHE 419 N 4.06 0.00 -0.51 -1.77 0.04 -1.85 -2.59 116.94 114.32 3dg8 h PHE 419 Ca 0.48 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.22 3dg8 h PHE 419 Cb 0.35 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.49 3dg8 h PHE 419 CO 1.26 0.07 0.02 0.72 -0.60 0.00 0.00 178.31 179.79 3dg8 n HIS 420 N -3.75 1.84 -4.25 -0.55 8.25 -1.26 -4.91 115.22 110.59 3dg8 n HIS 420 Ca -0.02 -0.82 -0.34 0.00 -0.26 0.00 0.00 57.72 56.28 3dg8 n HIS 420 Cb 0.17 -0.48 -0.12 0.00 1.12 0.00 0.00 29.99 30.68 3dg8 n HIS 420 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 3dg8 s ARG 421 N -2.82 3.70 0.60 -0.41 6.06 -0.98 -5.09 118.95 120.02 3dg8 s ARG 421 Ca 0.52 -0.49 -0.19 0.00 -2.50 0.00 0.00 55.73 53.06 3dg8 s ARG 421 Cb 0.40 -3.01 -0.03 0.00 0.06 0.00 0.00 34.95 32.37 3dg8 s ARG 421 CO 0.14 0.18 1.24 -2.00 -2.50 0.00 0.00 175.30 172.36 3dg8 s GLU 422 N 0.55 2.90 0.10 5.12 2.12 -1.26 -4.90 118.70 123.32 3dg8 s GLU 422 Ca -0.01 1.93 -0.33 0.00 0.36 0.00 0.00 54.97 56.92 3dg8 s GLU 422 Cb -0.14 -1.95 -0.12 0.00 0.26 0.00 0.00 34.13 32.18 3dg8 s GLU 422 CO 0.02 -1.29 1.75 0.28 -0.54 0.00 0.00 175.26 175.48 3dg8 n VAL 423 N -1.58 0.25 -0.97 3.70 0.31 -1.26 -1.27 118.33 117.51 3dg8 n VAL 423 Ca 0.14 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 3dg8 n VAL 423 Cb 0.49 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 3dg8 n VAL 423 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3dg8 n ASN 424 N 4.93 -1.64 -4.40 4.52 5.03 0.52 -4.94 115.26 119.28 3dg8 n ASN 424 Ca 0.18 0.00 -0.45 0.00 0.87 0.00 0.00 54.58 55.19 3dg8 n ASN 424 Cb 0.32 -0.27 -0.03 0.00 -1.02 0.00 0.00 39.78 38.78 3dg8 n ASN 424 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3dg8 s ASP 425 N -2.43 6.45 0.00 6.41 -1.08 -0.40 -0.17 116.67 125.45 3dg8 s ASP 425 Ca 0.00 -1.85 0.15 0.00 -0.52 0.00 0.00 52.55 50.33 3dg8 s ASP 425 Cb 0.00 -2.33 0.80 0.00 -1.46 0.00 0.00 42.92 39.93 3dg8 s ASP 425 CO 0.00 -1.03 1.37 0.18 0.52 0.00 0.00 175.17 176.21 3dg8 n LEU 426 N 6.10 0.00 0.00 -1.34 4.77 -0.92 -4.75 117.00 120.86 3dg8 n LEU 426 Ca 0.08 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 3dg8 n LEU 426 Cb 0.46 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 3dg8 n LEU 426 CO 0.51 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3dg8 n GLY 427 N -0.06 -1.68 2.69 -0.72 0.00 -1.26 -1.39 105.19 102.78 3dg8 n GLY 427 Ca 0.09 -1.34 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 3dg8 n GLY 427 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dg8 n PRO 428 N -0.02 2.42 -0.45 1.61 -0.04 -1.26 -4.80 135.00 132.45 3dg8 n PRO 428 Ca 0.00 -1.90 0.00 0.00 -0.04 0.00 0.00 63.50 61.56 3dg8 n PRO 428 Cb 0.00 -2.78 0.00 0.00 -0.04 0.00 0.00 33.50 30.68 3dg8 n PRO 428 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3dg8 n ILE 429 N 4.67 0.00 -0.04 0.52 -5.35 -1.26 -4.59 119.36 113.30 3dg8 n ILE 429 Ca 0.54 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 63.01 3dg8 n ILE 429 Cb 0.26 -1.27 -0.01 0.00 -1.74 0.00 0.00 39.64 36.89 3dg8 n ILE 429 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3dg8 n TYR 430 N -0.78 -0.04 -0.22 4.28 4.01 -1.26 -0.69 117.16 122.46 3dg8 n TYR 430 Ca 0.00 0.12 -0.04 0.00 -0.16 0.00 0.00 57.90 57.82 3dg8 n TYR 430 Cb 0.00 -0.34 0.06 0.00 -0.31 0.00 0.00 39.34 38.75 3dg8 n TYR 430 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3dg8 h GLY 431 N 0.00 0.89 0.85 2.72 0.00 -1.75 -0.29 103.07 105.49 3dg8 h GLY 431 Ca 0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 3dg8 h GLY 431 CO -0.09 0.24 0.05 -2.75 0.00 0.00 0.00 176.54 173.98 3dg8 h PHE 432 N 0.75 0.29 -0.51 5.60 3.57 -0.97 -2.82 116.94 122.84 3dg8 h PHE 432 Ca 0.25 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.67 3dg8 h PHE 432 Cb 0.03 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 3dg8 h PHE 432 CO -0.05 0.40 0.12 1.96 -2.23 0.00 0.00 178.31 178.50 3dg8 h GLN 433 N 0.10 0.78 0.00 1.11 1.08 -1.18 0.94 115.11 117.94 3dg8 h GLN 433 Ca 0.06 -0.16 -0.05 0.00 -1.45 0.00 0.00 58.65 57.05 3dg8 h GLN 433 Cb 0.25 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.55 3dg8 h GLN 433 CO -0.00 0.72 -0.25 -1.49 -0.95 0.00 0.00 178.83 176.86 3dg8 h TRP 434 N 0.76 0.00 0.00 2.96 4.06 -0.92 -3.00 115.95 119.81 3dg8 h TRP 434 Ca 0.17 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.12 3dg8 h TRP 434 Cb 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.45 3dg8 h TRP 434 CO 0.02 0.25 -0.98 0.54 -3.56 0.00 0.00 178.44 174.70 3dg8 n ARG 435 N -3.97 0.83 -2.23 0.49 5.12 -1.07 -1.68 116.66 114.16 3dg8 n ARG 435 Ca -0.02 -0.02 0.01 0.00 -1.93 0.00 0.00 57.85 55.90 3dg8 n ARG 435 Cb 0.32 -1.00 0.04 0.00 -1.16 0.00 0.00 32.46 30.66 3dg8 n ARG 435 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3dg8 n HIS 436 N -1.51 0.75 -1.65 -1.55 8.25 0.32 -3.23 115.22 116.60 3dg8 n HIS 436 Ca -0.00 -1.45 -0.47 0.00 -0.26 0.00 0.00 57.72 55.53 3dg8 n HIS 436 Cb 0.06 -0.20 -0.04 0.00 1.12 0.00 0.00 29.99 30.92 3dg8 n HIS 436 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3dg8 n PHE 437 N -0.16 2.06 0.00 4.41 -0.00 -0.92 -1.64 117.46 121.22 3dg8 n PHE 437 Ca 0.08 0.38 0.00 0.00 -0.00 0.00 0.00 57.45 57.91 3dg8 n PHE 437 Cb 0.95 -2.48 0.00 0.00 -0.00 0.00 0.00 39.48 37.95 3dg8 n PHE 437 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3dg8 n GLY 438 N 3.02 3.42 3.82 7.13 0.00 -1.26 -0.17 105.19 121.14 3dg8 n GLY 438 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3dg8 n GLY 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dg8 s ALA 439 N -2.84 2.84 -0.32 4.61 0.00 -0.65 -4.87 121.76 120.52 3dg8 s ALA 439 Ca 0.00 0.29 -0.29 0.00 0.00 0.00 0.00 51.96 51.96 3dg8 s ALA 439 Cb 0.00 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 19.95 3dg8 s ALA 439 CO 0.00 -0.69 1.06 -1.21 0.00 0.00 0.00 175.76 174.92 3dg8 s GLU 440 N -4.21 4.04 0.19 0.00 8.01 -1.26 -5.00 118.70 120.47 3dg8 s GLU 440 Ca 0.61 1.02 -0.30 0.00 0.01 0.00 0.00 54.97 56.31 3dg8 s GLU 440 Cb -0.14 -3.74 -0.09 0.00 -4.31 0.00 0.00 34.13 25.85 3dg8 s GLU 440 CO 0.38 -0.90 1.31 -0.47 0.01 0.00 0.00 175.26 175.58 3dg8 s TYR 441 N 3.63 3.26 0.00 1.61 5.04 -1.26 -4.96 117.35 124.67 3dg8 s TYR 441 Ca 0.44 1.22 0.00 0.00 -2.44 0.00 0.00 57.07 56.30 3dg8 s TYR 441 Cb -0.12 -3.60 0.00 0.00 0.35 0.00 0.00 41.96 38.59 3dg8 s TYR 441 CO 0.16 -1.86 0.00 0.25 -1.34 0.00 0.00 175.55 172.76 3dg8 n THR 442 N 2.68 0.00 -4.22 4.34 -2.24 -1.26 -5.09 114.28 108.49 3dg8 n THR 442 Ca 0.06 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.67 3dg8 n THR 442 Cb 0.43 -0.75 -0.07 0.00 -2.10 0.00 0.00 70.33 67.84 3dg8 n THR 442 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3dg8 s ASN 443 N -0.32 1.37 0.00 3.42 2.20 -1.26 -5.04 114.94 115.32 3dg8 s ASN 443 Ca 0.00 -1.66 0.20 0.00 -0.94 0.00 0.00 52.86 50.46 3dg8 s ASN 443 Cb 0.00 0.58 0.87 0.00 -2.00 0.00 0.00 41.25 40.70 3dg8 s ASN 443 CO 0.00 -1.12 1.65 1.15 -2.94 0.00 0.00 177.10 175.84 3dg8 n MET 444 N -0.59 0.00 0.02 3.55 0.00 -1.26 -3.23 117.12 115.61 3dg8 n MET 444 Ca 0.05 0.15 0.11 0.00 0.00 0.00 0.00 57.70 58.02 3dg8 n MET 444 Cb 0.62 -1.50 -0.12 0.00 0.00 0.00 0.00 33.22 32.22 3dg8 n MET 444 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 3dg8 n TYR 445 N -1.51 0.21 -1.33 3.17 4.01 -1.26 -4.68 117.16 115.77 3dg8 n TYR 445 Ca 0.05 0.06 -0.35 0.00 -0.16 0.00 0.00 57.90 57.50 3dg8 n TYR 445 Cb 0.24 -0.55 0.10 0.00 -0.31 0.00 0.00 39.34 38.82 3dg8 n TYR 445 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3dg8 n ASP 446 N -2.27 1.26 -4.60 7.72 2.03 -1.20 -4.97 116.55 114.53 3dg8 n ASP 446 Ca -0.02 0.67 -0.41 0.00 0.52 0.00 0.00 54.79 55.55 3dg8 n ASP 446 Cb 0.54 -1.51 -0.07 0.00 -0.72 0.00 0.00 41.12 39.36 3dg8 n ASP 446 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3dg8 s ASN 447 N -1.83 6.43 -0.01 1.67 3.84 -1.26 -4.93 114.94 118.85 3dg8 s ASN 447 Ca 0.76 0.36 0.16 0.00 0.21 0.00 0.00 52.86 54.35 3dg8 s ASN 447 Cb -0.33 -2.30 0.48 0.00 -0.55 0.00 0.00 41.25 38.56 3dg8 s ASN 447 CO 0.48 -0.40 1.40 -1.22 -2.79 0.00 0.00 177.10 174.56 3dg8 n TYR 448 N 5.71 0.74 -1.69 0.43 4.01 -1.26 -5.02 117.16 120.10 3dg8 n TYR 448 Ca -0.03 -0.51 -0.56 0.00 -0.16 0.00 0.00 57.90 56.64 3dg8 n TYR 448 Cb 0.49 -0.03 -0.07 0.00 -0.31 0.00 0.00 39.34 39.42 3dg8 n TYR 448 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 3dg8 n GLU 449 N 1.01 1.21 -0.99 -0.72 2.13 -1.26 -0.27 120.64 121.76 3dg8 n GLU 449 Ca 0.18 0.44 0.00 0.00 0.66 0.00 0.00 57.16 58.44 3dg8 n GLU 449 Cb 0.54 -2.12 0.00 0.00 0.27 0.00 0.00 31.44 30.13 3dg8 n GLU 449 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3dg8 n ASN 450 N 4.86 -1.96 -4.78 4.31 3.02 -1.26 -5.03 115.26 114.43 3dg8 n ASN 450 Ca 0.25 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.44 3dg8 n ASN 450 Cb 0.15 -0.51 -0.08 0.00 -0.61 0.00 0.00 39.78 38.73 3dg8 n ASN 450 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3dg8 s LYS 451 N -0.12 3.22 0.09 3.52 1.02 0.63 -4.98 119.74 123.11 3dg8 s LYS 451 Ca 0.00 -0.27 0.00 0.00 0.02 0.00 0.00 55.97 55.72 3dg8 s LYS 451 Cb 0.00 -2.99 0.00 0.00 -0.52 0.00 0.00 37.83 34.32 3dg8 s LYS 451 CO 0.00 0.74 0.00 0.41 -0.92 0.00 0.00 175.35 175.58 3dg8 n GLY 452 N 2.07 -2.18 3.70 -3.33 0.00 -1.26 -4.37 105.19 99.82 3dg8 n GLY 452 Ca -0.19 -1.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.00 3dg8 n GLY 452 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dg8 s VAL 453 N -1.26 5.22 -1.18 1.61 1.01 0.76 -4.75 120.40 121.81 3dg8 s VAL 453 Ca 0.00 0.75 -0.15 0.00 0.00 0.00 0.00 61.98 62.58 3dg8 s VAL 453 Cb 0.00 -3.74 0.15 0.00 0.00 0.00 0.00 36.38 32.80 3dg8 s VAL 453 CO 0.00 0.31 1.42 -0.62 0.00 0.00 0.00 175.10 176.21 3dg8 s ASP 454 N 0.77 6.98 0.20 3.32 -1.08 -1.20 -2.16 116.67 123.50 3dg8 s ASP 454 Ca 0.21 -2.79 -0.11 0.00 -0.52 0.00 0.00 52.55 49.33 3dg8 s ASP 454 Cb -0.14 -2.42 0.24 0.00 -1.46 0.00 0.00 42.92 39.13 3dg8 s ASP 454 CO 0.08 -0.84 1.74 1.56 0.52 0.00 0.00 175.17 178.23 3dg8 h GLN 455 N 7.46 0.36 -0.10 4.34 4.20 -1.69 -1.41 115.11 128.27 3dg8 h GLN 455 Ca 0.31 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.04 3dg8 h GLN 455 Cb 0.90 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.54 3dg8 h GLN 455 CO 1.25 0.24 -0.28 1.25 -0.67 0.00 0.00 178.83 180.61 3dg8 h LEU 456 N 0.37 -0.87 -0.79 1.46 5.85 -1.64 0.31 115.31 119.99 3dg8 h LEU 456 Ca 0.28 0.13 0.03 0.00 0.84 0.00 0.00 57.88 59.16 3dg8 h LEU 456 Cb 0.33 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.69 3dg8 h LEU 456 CO -0.29 -0.33 0.51 0.50 -0.34 0.00 0.00 178.44 178.48 3dg8 h LYS 457 N -0.37 0.97 -0.15 1.25 3.64 -1.78 -2.17 116.57 117.96 3dg8 h LYS 457 Ca 0.09 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3dg8 h LYS 457 Cb 0.51 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 3dg8 h LYS 457 CO -0.31 0.64 0.07 -0.91 -2.27 0.00 0.00 179.45 176.66 3dg8 h ASN 458 N 1.00 0.20 -0.10 4.20 2.35 -0.10 -1.41 115.58 121.72 3dg8 h ASN 458 Ca 0.31 -0.14 -0.08 0.00 -0.55 0.00 0.00 56.30 55.85 3dg8 h ASN 458 Cb -0.00 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 3dg8 h ASN 458 CO -0.11 0.29 -0.16 0.16 -1.65 0.00 0.00 177.43 175.97 3dg8 h ILE 459 N 0.10 1.24 -0.55 2.81 -0.00 -0.30 0.40 117.51 121.21 3dg8 h ILE 459 Ca 0.05 -1.06 -0.09 0.00 -0.00 0.00 0.00 64.86 63.76 3dg8 h ILE 459 Cb 0.15 1.20 -0.02 0.00 -0.00 0.00 0.00 36.82 38.15 3dg8 h ILE 459 CO -0.01 0.34 -0.01 0.40 -0.00 0.00 0.00 178.15 178.88 3dg8 h ILE 460 N 0.43 1.26 -0.10 0.16 2.04 -1.21 -0.52 117.51 119.57 3dg8 h ILE 460 Ca 0.08 -1.11 -0.16 0.00 1.00 0.00 0.00 64.86 64.67 3dg8 h ILE 460 Cb 0.53 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 3dg8 h ILE 460 CO 0.03 0.40 -0.62 0.78 0.00 0.00 0.00 178.15 178.74 3dg8 h ASN 461 N 0.87 0.41 -0.49 1.72 2.35 -0.72 -2.37 115.58 117.35 3dg8 h ASN 461 Ca 0.16 -0.24 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 3dg8 h ASN 461 Cb 0.52 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 3dg8 h ASN 461 CO 0.03 0.92 0.13 -0.07 -1.65 0.00 0.00 177.43 176.79 3dg8 h LEU 462 N 0.26 0.73 -0.88 1.61 3.38 -0.56 -0.36 115.31 119.49 3dg8 h LEU 462 Ca -0.01 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.75 3dg8 h LEU 462 Cb 1.14 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.66 3dg8 h LEU 462 CO 0.10 0.77 0.58 0.40 0.09 0.00 0.00 178.44 180.38 3dg8 h ILE 463 N 0.66 1.22 -0.02 1.22 2.04 -0.97 0.38 117.51 122.05 3dg8 h ILE 463 Ca 0.15 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 3dg8 h ILE 463 Cb 0.31 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 3dg8 h ILE 463 CO -0.00 0.22 -0.10 0.11 0.00 0.00 0.00 178.15 178.38 3dg8 h LYS 464 N 1.19 0.09 0.00 2.37 1.57 -1.19 -3.27 116.57 117.34 3dg8 h LYS 464 Ca 0.32 -0.08 -0.28 0.00 -1.87 0.00 0.00 60.65 58.75 3dg8 h LYS 464 Cb -0.14 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.14 3dg8 h LYS 464 CO -0.07 0.76 -1.75 0.09 -0.57 0.00 0.00 179.45 177.91 3dg8 n ASN 465 N -4.66 0.75 -3.21 0.86 3.02 -0.17 -4.64 115.26 107.21 3dg8 n ASN 465 Ca -0.09 0.35 -0.24 0.00 -0.03 0.00 0.00 54.58 54.57 3dg8 n ASN 465 Cb 0.39 0.13 -0.07 0.00 -0.61 0.00 0.00 39.78 39.62 3dg8 n ASN 465 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3dg8 n ASP 466 N -2.97 0.60 0.32 6.41 2.03 0.13 -4.98 116.55 118.09 3dg8 n ASP 466 Ca -0.17 -2.79 0.21 0.00 0.52 0.00 0.00 54.79 52.55 3dg8 n ASP 466 Cb 1.02 -0.64 1.03 0.00 -0.72 0.00 0.00 41.12 41.81 3dg8 n ASP 466 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3dg8 h PRO 467 N 3.96 0.00 -0.00 -0.67 0.13 -1.56 -2.05 132.00 131.81 3dg8 h PRO 467 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3dg8 h PRO 467 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 3dg8 h PRO 467 CO 0.50 0.00 -0.13 0.25 -0.23 0.00 0.00 178.00 178.40 3dg8 n THR 468 N -3.12 0.00 -1.68 1.56 -2.24 -1.26 -3.94 114.28 103.60 3dg8 n THR 468 Ca -0.02 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.27 3dg8 n THR 468 Cb 0.15 -0.06 -0.01 0.00 -2.10 0.00 0.00 70.33 68.31 3dg8 n THR 468 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3dg8 n SER 469 N -0.96 2.62 -1.30 3.42 2.88 -0.77 -4.90 113.62 114.60 3dg8 n SER 469 Ca 0.14 1.20 -0.05 0.00 -1.33 0.00 0.00 58.87 58.82 3dg8 n SER 469 Cb 0.29 -1.46 0.21 0.00 -0.75 0.00 0.00 64.21 62.50 3dg8 n SER 469 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3dg8 n ARG 470 N 0.75 2.15 -0.03 -1.46 1.74 -1.26 -4.27 116.66 114.28 3dg8 n ARG 470 Ca 0.06 -3.10 0.02 0.00 -0.77 0.00 0.00 57.85 54.05 3dg8 n ARG 470 Cb 0.35 -1.89 0.02 0.00 -1.02 0.00 0.00 32.46 29.93 3dg8 n ARG 470 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3dg8 n ARG 471 N -0.99 2.14 -2.27 5.56 1.74 -1.26 -4.93 116.66 116.65 3dg8 n ARG 471 Ca 0.35 -1.52 -0.40 0.00 -0.77 0.00 0.00 57.85 55.52 3dg8 n ARG 471 Cb 1.12 -0.99 -0.02 0.00 -1.02 0.00 0.00 32.46 31.55 3dg8 n ARG 471 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3dg8 n ILE 472 N -0.57 3.33 -5.05 0.55 5.41 -1.26 -4.92 119.36 116.85 3dg8 n ILE 472 Ca 0.03 -3.36 -0.28 0.00 1.00 0.00 0.00 62.75 60.14 3dg8 n ILE 472 Cb 0.37 -2.35 -0.16 0.00 -0.71 0.00 0.00 39.64 36.80 3dg8 n ILE 472 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3dg8 s LEU 473 N 5.20 2.03 -0.34 1.39 1.02 -1.26 -1.75 118.68 124.98 3dg8 s LEU 473 Ca 0.56 -0.39 -0.05 0.00 0.02 0.00 0.00 54.13 54.27 3dg8 s LEU 473 Cb 0.05 -1.11 0.05 0.00 0.02 0.00 0.00 46.19 45.20 3dg8 s LEU 473 CO 0.07 0.25 0.08 -0.22 0.02 0.00 0.00 176.35 176.56 3dg8 s LEU 474 N -0.45 4.29 -0.14 1.79 2.96 0.02 -4.90 118.68 122.25 3dg8 s LEU 474 Ca 0.07 -1.27 -0.04 0.00 -0.22 0.00 0.00 54.13 52.67 3dg8 s LEU 474 Cb -0.09 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 3dg8 s LEU 474 CO -0.00 -0.33 -0.02 0.00 -1.32 0.00 0.00 176.35 174.67 3dg8 n ALA 476 N 3.24 3.55 -2.79 0.00 0.00 -0.18 -4.74 120.51 119.60 3dg8 n ALA 476 Ca -0.17 -0.42 -0.44 0.00 0.00 0.00 0.00 53.44 52.41 3dg8 n ALA 476 Cb 0.53 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.49 3dg8 n ALA 476 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 3dg8 n TRP 477 N -0.98 4.51 -2.72 0.00 -0.00 -1.23 -4.79 117.44 112.23 3dg8 n TRP 477 Ca 0.04 -3.21 -0.42 0.00 -0.00 0.00 0.00 57.50 53.90 3dg8 n TRP 477 Cb 0.23 -2.16 -0.03 0.00 -0.00 0.00 0.00 31.31 29.35 3dg8 n TRP 477 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 3dg8 s ASN 478 N 2.47 6.23 0.42 5.87 3.84 -1.26 -4.90 114.94 127.62 3dg8 s ASN 478 Ca 0.43 -0.55 0.17 0.00 0.21 0.00 0.00 52.86 53.11 3dg8 s ASN 478 Cb 0.00 -2.49 1.06 0.00 -0.55 0.00 0.00 41.25 39.28 3dg8 s ASN 478 CO 0.01 -1.54 1.88 0.58 -2.79 0.00 0.00 177.10 175.24 3dg8 h VAL 479 N 6.02 0.73 -0.08 -5.21 2.07 -2.01 -1.31 116.25 116.46 3dg8 h VAL 479 Ca -0.28 -0.14 -0.11 0.00 0.82 0.00 0.00 66.70 66.99 3dg8 h VAL 479 Cb 1.06 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3dg8 h VAL 479 CO 1.20 0.08 -0.47 0.50 0.02 0.00 0.00 177.57 178.90 3dg8 h LYS 480 N 0.42 0.19 -0.02 1.57 3.64 -2.02 -3.24 116.57 117.11 3dg8 h LYS 480 Ca 0.43 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 3dg8 h LYS 480 Cb 1.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 3dg8 h LYS 480 CO -0.15 0.62 -0.34 -0.25 -2.27 0.00 0.00 179.45 177.05 3dg8 n ASP 481 N -3.98 1.98 -0.29 4.20 8.00 -0.53 -4.65 116.55 121.28 3dg8 n ASP 481 Ca -0.02 -1.48 -0.01 0.00 0.71 0.00 0.00 54.79 53.99 3dg8 n ASP 481 Cb 0.51 0.32 0.05 0.00 -0.02 0.00 0.00 41.12 41.99 3dg8 n ASP 481 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3dg8 h LEU 482 N 2.58 -1.11 -1.40 0.64 3.38 -1.48 0.07 115.31 117.99 3dg8 h LEU 482 Ca 0.00 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3dg8 h LEU 482 Cb 0.74 0.61 0.00 0.00 0.09 0.00 0.00 40.66 42.10 3dg8 h LEU 482 CO 0.00 -0.29 0.00 0.44 0.09 0.00 0.00 178.44 178.68 3dg8 h ASP 483 N -0.05 0.00 0.93 -0.43 3.32 -1.85 -2.16 116.42 116.17 3dg8 h ASP 483 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 3dg8 h ASP 483 Cb 0.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.14 3dg8 h ASP 483 CO -0.85 0.00 -0.55 0.00 -1.72 0.00 0.00 179.24 176.12 3dg8 n GLN 484 N -2.57 0.28 -2.82 3.56 6.02 -0.00 -4.89 117.38 116.96 3dg8 n GLN 484 Ca 0.00 0.10 -0.34 0.00 -0.01 0.00 0.00 57.00 56.75 3dg8 n GLN 484 Cb 0.18 -1.70 -0.07 0.00 1.02 0.00 0.00 30.24 29.67 3dg8 n GLN 484 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3dg8 s MET 485 N -3.16 4.30 0.32 -1.09 -1.94 -0.81 -4.32 119.30 112.60 3dg8 s MET 485 Ca 0.07 1.15 0.03 0.00 -1.71 0.00 0.00 55.69 55.23 3dg8 s MET 485 Cb 0.13 -2.33 0.62 0.00 2.01 0.00 0.00 34.83 35.26 3dg8 s MET 485 CO 0.71 0.05 1.91 0.00 -0.01 0.00 0.00 175.02 177.67 3dg8 h ALA 486 N 2.22 1.61 -1.93 3.03 0.00 -1.54 -3.43 119.26 119.22 3dg8 h ALA 486 Ca -0.48 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 3dg8 h ALA 486 Cb 1.18 -0.22 -0.21 0.00 0.00 0.00 0.00 17.79 18.54 3dg8 h ALA 486 CO 0.62 0.23 0.22 -0.48 0.00 0.00 0.00 179.25 179.85 3dg8 s LEU 487 N -9.93 -0.65 0.47 0.00 2.34 -1.26 -4.97 118.68 104.68 3dg8 s LEU 487 Ca -0.11 0.98 -0.25 0.00 0.06 0.00 0.00 54.13 54.81 3dg8 s LEU 487 Cb 0.20 2.40 -0.08 0.00 -0.56 0.00 0.00 46.19 48.16 3dg8 s LEU 487 CO 0.79 -0.41 1.42 -2.65 -1.06 0.00 0.00 176.35 174.44 3dg8 n PRO 488 N 1.66 2.14 -1.95 1.48 -0.02 -1.26 -4.93 135.00 132.13 3dg8 n PRO 488 Ca -0.16 0.77 -0.41 0.00 -2.02 0.00 0.00 63.50 61.68 3dg8 n PRO 488 Cb 0.56 -2.63 -0.01 0.00 -0.02 0.00 0.00 33.50 31.40 3dg8 n PRO 488 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3dg8 s PRO 489 N -2.55 4.23 0.06 0.52 0.04 -1.26 -4.92 135.00 131.12 3dg8 s PRO 489 Ca 0.63 2.40 -0.06 0.00 0.04 0.00 0.00 61.00 64.01 3dg8 s PRO 489 Cb -0.44 -3.03 -0.30 0.00 0.04 0.00 0.00 34.50 30.77 3dg8 s PRO 489 CO 0.56 -0.39 1.10 0.00 0.04 0.00 0.00 177.00 178.31 3dg8 s HIS 491 N -2.64 3.10 0.09 0.00 3.76 -1.26 -0.90 115.29 117.44 3dg8 s HIS 491 Ca -0.05 -1.27 -0.30 0.00 -0.15 0.00 0.00 55.06 53.29 3dg8 s HIS 491 Cb 0.07 -4.19 -0.14 0.00 1.11 0.00 0.00 32.58 29.42 3dg8 s HIS 491 CO 0.89 -1.43 1.63 0.82 -0.85 0.00 0.00 174.74 175.80 3dg8 h ILE 492 N 5.75 0.37 -3.19 0.60 1.08 -1.44 -3.42 117.51 117.26 3dg8 h ILE 492 Ca 0.02 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.51 3dg8 h ILE 492 Cb 1.04 0.37 -0.07 0.00 -3.07 0.00 0.00 36.82 35.09 3dg8 h ILE 492 CO 1.08 0.00 0.12 -1.48 -0.69 0.00 0.00 178.15 177.18 3dg8 s LEU 493 N -10.18 -0.11 -0.06 1.44 0.05 -1.24 -1.01 118.68 107.58 3dg8 s LEU 493 Ca -0.17 -0.61 0.03 0.00 0.05 0.00 0.00 54.13 53.44 3dg8 s LEU 493 Cb 0.06 2.42 0.01 0.00 -2.05 0.00 0.00 46.19 46.62 3dg8 s LEU 493 CO 0.63 -1.23 -0.14 0.00 -0.55 0.00 0.00 176.35 175.07 3dg8 s GLN 495 N 0.39 2.01 0.13 0.00 0.74 0.13 -0.80 119.66 122.25 3dg8 s GLN 495 Ca -0.10 -0.92 0.07 0.00 0.05 0.00 0.00 55.36 54.45 3dg8 s GLN 495 Cb -0.14 -1.97 -0.04 0.00 1.10 0.00 0.00 33.01 31.96 3dg8 s GLN 495 CO 0.03 0.54 -0.04 -0.06 -0.55 0.00 0.00 175.29 175.21 3dg8 s PHE 496 N -0.62 2.84 -0.02 1.67 0.08 -0.72 -0.30 117.98 120.92 3dg8 s PHE 496 Ca 0.10 -0.12 0.01 0.00 0.12 0.00 0.00 56.93 57.04 3dg8 s PHE 496 Cb -0.10 -1.44 0.02 0.00 -0.57 0.00 0.00 43.02 40.93 3dg8 s PHE 496 CO -0.01 0.48 -0.01 -0.47 -0.10 0.00 0.00 175.22 175.11 3dg8 s TYR 497 N -1.44 0.29 -0.14 0.36 5.04 -0.48 -4.72 117.35 116.26 3dg8 s TYR 497 Ca 0.25 -0.01 0.01 0.00 -2.44 0.00 0.00 57.07 54.87 3dg8 s TYR 497 Cb -0.11 -0.33 0.02 0.00 0.35 0.00 0.00 41.96 41.89 3dg8 s TYR 497 CO 0.17 -0.09 -0.16 0.08 -1.34 0.00 0.00 175.55 174.21 3dg8 s VAL 498 N 0.68 1.62 -0.04 3.14 1.01 -1.25 -0.59 120.40 124.97 3dg8 s VAL 498 Ca -0.07 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.21 3dg8 s VAL 498 Cb -0.10 -1.49 0.03 0.00 0.00 0.00 0.00 36.38 34.82 3dg8 s VAL 498 CO -0.01 0.47 0.09 0.12 0.00 0.00 0.00 175.10 175.76 3dg8 s PHE 499 N 1.25 -0.07 -1.33 5.22 5.36 -0.67 -4.70 117.98 123.04 3dg8 s PHE 499 Ca 0.00 0.29 -0.18 0.00 -0.96 0.00 0.00 56.93 56.08 3dg8 s PHE 499 Cb -0.14 -0.12 0.02 0.00 -0.34 0.00 0.00 43.02 42.45 3dg8 s PHE 499 CO -0.07 -0.11 0.34 -3.47 -1.46 0.00 0.00 175.22 170.45 3dg8 n ASP 500 N 3.97 -1.60 -0.47 6.13 2.03 -1.26 -0.96 116.55 124.40 3dg8 n ASP 500 Ca -0.24 -1.26 -0.06 0.00 0.52 0.00 0.00 54.79 53.75 3dg8 n ASP 500 Cb 0.53 -1.53 -0.03 0.00 -0.72 0.00 0.00 41.12 39.37 3dg8 n ASP 500 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3dg8 n GLY 501 N -2.30 0.82 3.23 0.27 0.00 -1.26 -5.02 105.19 100.93 3dg8 n GLY 501 Ca -0.21 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.12 3dg8 n GLY 501 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dg8 s LYS 502 N -2.16 1.31 -0.15 1.61 1.02 -0.13 -1.50 119.74 119.75 3dg8 s LYS 502 Ca 0.00 -0.91 -0.01 0.00 0.02 0.00 0.00 55.97 55.07 3dg8 s LYS 502 Cb 0.00 -1.41 -0.01 0.00 -0.52 0.00 0.00 37.83 35.89 3dg8 s LYS 502 CO 0.00 0.36 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.49 3dg8 s LEU 503 N -1.17 2.68 0.21 3.17 2.96 0.25 -1.68 118.68 125.09 3dg8 s LEU 503 Ca 0.06 -0.37 0.10 0.00 -0.22 0.00 0.00 54.13 53.71 3dg8 s LEU 503 Cb -0.09 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 3dg8 s LEU 503 CO 0.02 0.12 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.58 3dg8 s SER 504 N 0.61 3.91 -0.04 3.68 0.01 0.24 0.28 113.70 122.39 3dg8 s SER 504 Ca -0.07 -0.75 -0.02 0.00 1.31 0.00 0.00 55.95 56.42 3dg8 s SER 504 Cb -0.16 -0.52 0.02 0.00 0.21 0.00 0.00 66.02 65.58 3dg8 s SER 504 CO 0.03 0.09 0.08 0.00 0.41 0.00 0.00 173.24 173.85 3dg8 s ILE 506 N 0.67 3.45 -0.06 0.00 1.01 0.59 0.11 121.20 126.97 3dg8 s ILE 506 Ca -0.05 -0.53 0.05 0.00 0.00 0.00 0.00 60.65 60.11 3dg8 s ILE 506 Cb -0.07 -2.46 -0.00 0.00 0.01 0.00 0.00 42.46 39.94 3dg8 s ILE 506 CO -0.03 0.53 -0.20 -0.32 0.00 0.00 0.00 174.94 174.92 3dg8 s MET 507 N 0.04 2.24 -0.27 2.79 1.75 -0.15 0.18 119.30 125.89 3dg8 s MET 507 Ca -0.02 -0.73 -0.07 0.00 -1.25 0.00 0.00 55.69 53.61 3dg8 s MET 507 Cb -0.14 -1.87 -0.01 0.00 2.84 0.00 0.00 34.83 35.65 3dg8 s MET 507 CO 0.04 0.26 0.08 -0.47 -0.65 0.00 0.00 175.02 174.27 3dg8 s TYR 508 N 0.08 3.11 -0.19 4.11 6.14 -0.59 -1.65 117.35 128.37 3dg8 s TYR 508 Ca -0.07 -0.67 -0.08 0.00 0.64 0.00 0.00 57.07 56.89 3dg8 s TYR 508 Cb -0.14 -2.25 -0.04 0.00 0.42 0.00 0.00 41.96 39.95 3dg8 s TYR 508 CO 0.04 -0.46 0.07 -1.14 0.64 0.00 0.00 175.55 174.70 3dg8 s GLN 509 N 1.57 3.99 0.07 4.97 0.74 0.26 -1.37 119.66 129.88 3dg8 s GLN 509 Ca 0.05 -0.34 -0.03 0.00 0.05 0.00 0.00 55.36 55.09 3dg8 s GLN 509 Cb -0.16 -3.23 -0.28 0.00 1.10 0.00 0.00 33.01 30.44 3dg8 s GLN 509 CO 0.03 0.27 1.11 0.07 -0.55 0.00 0.00 175.29 176.22 3dg8 h ARG 510 N 6.72 0.24 -3.92 1.67 0.11 -1.32 0.15 114.38 118.04 3dg8 h ARG 510 Ca -0.37 -0.41 -0.40 0.00 0.10 0.00 0.00 59.98 58.89 3dg8 h ARG 510 Cb 1.17 0.15 -0.35 0.00 1.11 0.00 0.00 29.97 32.05 3dg8 h ARG 510 CO 0.71 1.18 -0.77 0.45 0.10 0.00 0.00 179.97 181.64 3dg8 s SER 511 N -7.07 0.98 -0.15 0.08 0.15 -1.26 -0.97 113.70 105.45 3dg8 s SER 511 Ca -0.04 -0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.50 3dg8 s SER 511 Cb 0.07 -0.41 0.04 0.00 -1.71 0.00 0.00 66.02 64.01 3dg8 s SER 511 CO 0.87 -0.09 -0.04 0.00 1.20 0.00 0.00 173.24 175.19 3dg8 s ASP 513 N 1.71 6.19 0.33 0.00 2.15 -1.26 -1.30 116.67 124.49 3dg8 s ASP 513 Ca 0.01 -1.22 0.01 0.00 0.43 0.00 0.00 52.55 51.79 3dg8 s ASP 513 Cb -0.15 -2.37 0.57 0.00 -0.30 0.00 0.00 42.92 40.67 3dg8 s ASP 513 CO -0.07 -1.29 1.97 -0.07 -0.17 0.00 0.00 175.17 175.53 3dg8 h LEU 514 N 10.74 0.83 -0.22 -1.34 -0.00 -1.65 -0.49 115.31 123.18 3dg8 h LEU 514 Ca -0.27 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.88 57.50 3dg8 h LEU 514 Cb 1.08 -0.19 -0.00 0.00 -0.00 0.00 0.00 40.66 41.54 3dg8 h LEU 514 CO 1.15 0.57 -0.22 1.23 -0.00 0.00 0.00 178.44 181.17 3dg8 h GLY 515 N 0.96 0.58 0.00 0.83 0.00 -1.91 -3.39 103.07 100.14 3dg8 h GLY 515 Ca 0.31 -0.60 -0.20 0.00 0.00 0.00 0.00 47.33 46.84 3dg8 h GLY 515 CO -0.09 0.54 -1.68 1.04 0.00 0.00 0.00 176.54 176.35 3dg8 n LEU 516 N -4.40 1.74 0.11 3.11 4.77 -1.22 -4.86 117.00 116.25 3dg8 n LEU 516 Ca -0.05 0.06 -0.06 0.00 -0.03 0.00 0.00 56.01 55.93 3dg8 n LEU 516 Cb 0.42 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 3dg8 n LEU 516 CO 0.42 0.44 0.17 1.23 -1.33 0.00 0.00 177.39 178.32 3dg8 h GLY 517 N 0.10 -0.39 -0.96 -0.72 0.00 -1.50 -3.39 103.07 96.21 3dg8 h GLY 517 Ca -0.29 0.15 0.25 0.00 0.00 0.00 0.00 47.33 47.44 3dg8 h GLY 517 CO -0.13 -0.14 -0.03 -2.08 0.00 0.00 0.00 176.54 174.15 3dg8 h VAL 518 N -1.09 0.02 -0.73 4.60 2.07 -1.34 0.15 116.25 119.93 3dg8 h VAL 518 Ca -0.04 -0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.60 3dg8 h VAL 518 Cb 0.32 0.01 -0.09 0.00 -1.52 0.00 0.00 31.29 30.02 3dg8 h VAL 518 CO 0.06 0.00 0.31 -0.65 0.02 0.00 0.00 177.57 177.32 3dg8 h PRO 519 N 0.01 0.47 -0.35 1.57 0.11 -1.78 -0.42 132.00 131.61 3dg8 h PRO 519 Ca 0.57 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.50 3dg8 h PRO 519 Cb 1.12 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3dg8 h PRO 519 CO -0.94 0.31 -0.40 0.74 -0.21 0.00 0.00 178.00 177.50 3dg8 h PHE 520 N 0.49 1.02 -0.79 0.65 0.04 -0.93 -3.02 116.94 114.40 3dg8 h PHE 520 Ca 0.39 -0.31 0.05 0.00 2.80 0.00 0.00 57.97 60.90 3dg8 h PHE 520 Cb 0.54 -0.21 -0.05 0.00 2.20 0.00 0.00 35.95 38.42 3dg8 h PHE 520 CO -0.15 1.11 0.49 -0.91 -0.60 0.00 0.00 178.31 178.25 3dg8 h ASN 521 N 0.69 0.78 -0.03 2.17 -0.26 -0.12 0.18 115.58 119.00 3dg8 h ASN 521 Ca 0.06 0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.80 3dg8 h ASN 521 Cb 0.97 -0.15 -0.00 0.00 -1.06 0.00 0.00 38.32 38.08 3dg8 h ASN 521 CO 0.09 0.52 0.01 0.40 -1.06 0.00 0.00 177.43 177.39 3dg8 h ILE 522 N 0.92 1.13 -0.47 2.81 2.04 -1.11 -2.14 117.51 120.69 3dg8 h ILE 522 Ca 0.33 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 3dg8 h ILE 522 Cb 0.10 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3dg8 h ILE 522 CO -0.15 0.11 0.26 0.00 0.00 0.00 0.00 178.15 178.37 3dg8 h ALA 523 N 0.85 0.60 0.01 1.87 0.00 -1.34 -1.88 119.26 119.39 3dg8 h ALA 523 Ca 0.01 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.85 3dg8 h ALA 523 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3dg8 h ALA 523 CO -0.00 0.13 -0.12 1.03 0.00 0.00 0.00 179.25 180.28 3dg8 h SER 524 N 0.62 -0.35 1.75 0.00 0.87 -0.56 -1.83 113.55 114.05 3dg8 h SER 524 Ca 0.17 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 3dg8 h SER 524 Cb 0.05 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 3dg8 h SER 524 CO -0.03 -0.18 0.00 1.88 -0.53 0.00 0.00 176.83 177.98 3dg8 h TYR 525 N -0.22 0.00 -0.19 2.24 -1.99 -1.38 -2.53 116.97 112.91 3dg8 h TYR 525 Ca 0.04 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.57 3dg8 h TYR 525 Cb 0.26 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.00 3dg8 h TYR 525 CO -0.18 0.00 -0.67 0.77 -0.00 0.00 0.00 178.16 178.08 3dg8 h SER 526 N 0.00 0.85 -0.64 3.88 0.02 -1.15 -1.55 113.55 114.95 3dg8 h SER 526 Ca 0.00 -0.51 -0.05 0.00 -0.84 0.00 0.00 61.79 60.38 3dg8 h SER 526 Cb 0.88 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 3dg8 h SER 526 CO 0.00 1.29 0.19 0.40 -1.14 0.00 0.00 176.83 177.57 3dg8 h ILE 527 N 0.53 1.25 -0.47 3.27 2.04 -1.22 -2.40 117.51 120.52 3dg8 h ILE 527 Ca -0.02 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 3dg8 h ILE 527 Cb 1.27 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 3dg8 h ILE 527 CO 0.14 0.33 0.25 0.15 0.00 0.00 0.00 178.15 179.03 3dg8 h PHE 528 N 0.93 0.64 -0.85 1.37 3.57 -1.33 -0.33 116.94 120.94 3dg8 h PHE 528 Ca 0.21 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.74 3dg8 h PHE 528 Cb 0.31 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 3dg8 h PHE 528 CO 0.02 0.48 0.54 1.15 -2.23 0.00 0.00 178.31 178.27 3dg8 h THR 529 N 0.61 1.08 -0.15 4.41 2.02 -1.05 0.12 112.91 119.95 3dg8 h THR 529 Ca 0.16 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 3dg8 h THR 529 Cb 0.06 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.44 3dg8 h THR 529 CO -0.03 0.18 0.06 0.45 0.37 0.00 0.00 175.52 176.56 3dg8 h HIS 530 N 1.01 0.23 0.26 3.16 3.86 -1.03 -0.01 115.15 122.63 3dg8 h HIS 530 Ca 0.36 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.55 3dg8 h HIS 530 Cb 0.11 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 3dg8 h HIS 530 CO -0.03 0.31 -0.25 0.52 0.86 0.00 0.00 177.93 179.34 3dg8 h MET 531 N 0.09 -0.52 -0.93 2.45 2.07 -0.16 0.62 114.93 118.56 3dg8 h MET 531 Ca 0.05 0.04 0.03 0.00 -2.07 0.00 0.00 59.70 57.74 3dg8 h MET 531 Cb 0.17 0.12 -0.05 0.00 -1.87 0.00 0.00 31.60 29.97 3dg8 h MET 531 CO -0.00 -0.35 0.60 0.82 1.07 0.00 0.00 176.91 179.05 3dg8 h ILE 532 N -0.54 1.18 -0.74 -1.22 1.08 -0.77 -2.35 117.51 114.16 3dg8 h ILE 532 Ca -0.01 -0.41 -0.04 0.00 -0.39 0.00 0.00 64.86 64.01 3dg8 h ILE 532 Cb 0.49 -0.12 -0.03 0.00 -3.07 0.00 0.00 36.82 34.09 3dg8 h ILE 532 CO -0.05 0.22 0.32 0.00 -0.69 0.00 0.00 178.15 177.95 3dg8 h ALA 533 N 1.37 0.96 -0.40 1.87 0.00 -0.57 -2.93 119.26 119.55 3dg8 h ALA 533 Ca 0.36 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 3dg8 h ALA 533 Cb -0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3dg8 h ALA 533 CO -0.11 0.56 -0.26 0.37 0.00 0.00 0.00 179.25 179.81 3dg8 h GLN 534 N 1.05 0.84 0.00 0.00 4.15 -0.37 0.22 115.11 120.99 3dg8 h GLN 534 Ca 0.25 -0.36 0.00 0.00 0.77 0.00 0.00 58.65 59.30 3dg8 h GLN 534 Cb 0.18 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.84 3dg8 h GLN 534 CO -0.02 1.00 0.00 1.33 -1.93 0.00 0.00 178.83 179.21 3dg8 n VAL 535 N -4.09 0.17 -0.22 2.39 0.24 -0.97 -2.26 118.33 113.58 3dg8 n VAL 535 Ca -0.00 0.04 0.04 0.00 -2.04 0.00 0.00 64.34 62.38 3dg8 n VAL 535 Cb 0.46 -0.60 0.11 0.00 -1.47 0.00 0.00 33.84 32.35 3dg8 n VAL 535 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dg8 n ASN 537 N 0.02 -0.51 -4.38 0.00 3.02 -0.89 -4.94 115.26 107.58 3dg8 n ASN 537 Ca 0.09 -0.98 -0.20 0.00 -0.03 0.00 0.00 54.58 53.46 3dg8 n ASN 537 Cb 0.42 -3.17 -0.10 0.00 -0.61 0.00 0.00 39.78 36.31 3dg8 n ASN 537 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dg8 s LEU 538 N -6.94 2.55 -0.08 3.41 1.43 0.72 -5.03 118.68 114.75 3dg8 s LEU 538 Ca 0.03 -1.05 -0.09 0.00 -1.03 0.00 0.00 54.13 51.99 3dg8 s LEU 538 Cb -0.01 -0.75 -0.04 0.00 0.03 0.00 0.00 46.19 45.41 3dg8 s LEU 538 CO 0.88 -0.16 0.21 -1.10 0.23 0.00 0.00 176.35 176.42 3dg8 s GLN 539 N -3.63 3.56 0.34 1.70 -1.52 -0.56 -4.04 119.66 115.50 3dg8 s GLN 539 Ca 0.25 -0.01 -0.28 0.00 -1.95 0.00 0.00 55.36 53.37 3dg8 s GLN 539 Cb -0.01 -3.18 -0.10 0.00 -0.22 0.00 0.00 33.01 29.50 3dg8 s GLN 539 CO 0.09 0.74 1.22 -1.25 -0.25 0.00 0.00 175.29 175.84 3dg8 s PRO 540 N -1.15 4.34 0.00 2.91 0.04 -1.26 -0.59 135.00 139.29 3dg8 s PRO 540 Ca 0.19 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.24 3dg8 s PRO 540 Cb -0.13 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.42 3dg8 s PRO 540 CO 0.08 -0.13 0.00 0.00 0.04 0.00 0.00 177.00 176.99 3dg8 n ALA 541 N 0.69 0.77 -2.48 8.56 0.00 0.14 -3.83 120.51 124.37 3dg8 n ALA 541 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 3dg8 n ALA 541 Cb 0.44 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.77 3dg8 n ALA 541 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3dg8 s GLN 542 N 0.00 1.78 -0.21 0.00 -0.21 -1.25 0.45 119.66 120.22 3dg8 s GLN 542 Ca 0.00 -1.17 -0.01 0.00 0.02 0.00 0.00 55.36 54.19 3dg8 s GLN 542 Cb 0.00 -2.10 0.01 0.00 1.00 0.00 0.00 33.01 31.92 3dg8 s GLN 542 CO 0.00 0.48 -0.11 0.12 -2.12 0.00 0.00 175.29 173.66 3dg8 s PHE 543 N -1.11 2.91 -0.23 0.91 5.36 -0.54 -0.41 117.98 124.87 3dg8 s PHE 543 Ca 0.17 -1.36 -0.05 0.00 -0.96 0.00 0.00 56.93 54.73 3dg8 s PHE 543 Cb -0.10 -2.02 -0.01 0.00 -0.34 0.00 0.00 43.02 40.55 3dg8 s PHE 543 CO 0.09 -0.69 -0.01 0.42 -1.46 0.00 0.00 175.22 173.57 3dg8 s ILE 544 N 1.37 3.61 -0.25 3.12 1.01 0.30 -1.24 121.20 129.12 3dg8 s ILE 544 Ca 0.04 -0.46 -0.09 0.00 0.00 0.00 0.00 60.65 60.15 3dg8 s ILE 544 Cb -0.14 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 3dg8 s ILE 544 CO -0.08 0.37 0.12 -2.28 0.00 0.00 0.00 174.94 173.07 3dg8 s HIS 545 N 1.51 3.18 -0.22 3.97 2.46 0.69 -0.97 115.29 125.91 3dg8 s HIS 545 Ca 0.05 -0.08 -0.03 0.00 0.47 0.00 0.00 55.06 55.48 3dg8 s HIS 545 Cb -0.15 -2.26 0.01 0.00 -0.13 0.00 0.00 32.58 30.05 3dg8 s HIS 545 CO -0.01 -0.15 -0.07 0.08 -2.47 0.00 0.00 174.74 172.11 3dg8 s VAL 546 N 1.37 3.03 -0.17 0.89 1.01 -0.66 -0.15 120.40 125.72 3dg8 s VAL 546 Ca 0.06 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.23 3dg8 s VAL 546 Cb -0.15 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 3dg8 s VAL 546 CO 0.05 0.38 0.15 -0.76 0.00 0.00 0.00 175.10 174.93 3dg8 s LEU 547 N 1.41 4.26 0.00 3.92 1.43 -0.09 -0.58 118.68 129.04 3dg8 s LEU 547 Ca 0.04 0.33 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 3dg8 s LEU 547 Cb -0.15 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 43.95 3dg8 s LEU 547 CO -0.05 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.36 3dg8 n GLY 548 N 3.13 0.71 3.52 -3.19 0.00 0.52 -1.85 105.19 108.04 3dg8 n GLY 548 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 3dg8 n GLY 548 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dg8 s ASN 549 N -1.00 6.19 -0.23 1.61 3.84 -0.14 -1.67 114.94 123.54 3dg8 s ASN 549 Ca 0.00 -0.55 -0.13 0.00 0.21 0.00 0.00 52.86 52.39 3dg8 s ASN 549 Cb 0.00 -2.52 -0.05 0.00 -0.55 0.00 0.00 41.25 38.14 3dg8 s ASN 549 CO 0.00 -1.68 0.26 0.00 -2.79 0.00 0.00 177.10 172.88 3dg8 s ALA 550 N 5.16 3.59 0.04 1.71 0.00 -0.80 -0.82 121.76 130.64 3dg8 s ALA 550 Ca 0.32 -0.76 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 3dg8 s ALA 550 Cb -0.11 -2.46 -0.02 0.00 0.00 0.00 0.00 23.12 20.54 3dg8 s ALA 550 CO 0.15 -0.26 0.05 -3.38 0.00 0.00 0.00 175.76 172.31 3dg8 s HIS 551 N 1.21 0.27 -0.10 0.00 -3.43 -0.42 -0.97 115.29 111.85 3dg8 s HIS 551 Ca 0.12 -0.62 0.04 0.00 -0.80 0.00 0.00 55.06 53.80 3dg8 s HIS 551 Cb -0.14 -0.20 0.00 0.00 -1.43 0.00 0.00 32.58 30.81 3dg8 s HIS 551 CO 0.06 -0.33 -0.23 0.08 -2.00 0.00 0.00 174.74 172.32 3dg8 s VAL 552 N -2.63 1.99 0.44 -5.38 1.01 0.32 -1.45 120.40 114.71 3dg8 s VAL 552 Ca -0.05 -0.97 -0.22 0.00 0.00 0.00 0.00 61.98 60.73 3dg8 s VAL 552 Cb -0.01 -1.73 -0.08 0.00 0.00 0.00 0.00 36.38 34.55 3dg8 s VAL 552 CO -0.05 0.54 1.08 -0.31 0.00 0.00 0.00 175.10 176.36 3dg8 s TYR 553 N 0.43 3.08 0.20 5.22 2.02 -1.26 -0.70 117.35 126.34 3dg8 s TYR 553 Ca -0.17 1.60 -0.11 0.00 -0.37 0.00 0.00 57.07 58.02 3dg8 s TYR 553 Cb -0.17 -3.17 0.17 0.00 -0.40 0.00 0.00 41.96 38.38 3dg8 s TYR 553 CO 0.07 -0.92 1.85 -0.91 -1.57 0.00 0.00 175.55 174.06 3dg8 h ASN 554 N 2.07 0.70 0.00 2.29 4.21 -1.48 -2.42 115.58 120.94 3dg8 h ASN 554 Ca -0.49 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.02 3dg8 h ASN 554 Cb 1.23 -0.15 0.00 0.00 -1.12 0.00 0.00 38.32 38.27 3dg8 h ASN 554 CO 0.61 0.49 0.00 -0.46 -1.29 0.00 0.00 177.43 176.77 3dg8 n ASN 555 N -4.68 0.42 -0.01 5.81 0.23 -1.26 -2.45 115.26 113.33 3dg8 n ASN 555 Ca 0.07 -1.97 0.08 0.00 -0.53 0.00 0.00 54.58 52.23 3dg8 n ASN 555 Cb 0.07 -0.21 -0.12 0.00 -2.08 0.00 0.00 39.78 37.44 3dg8 n ASN 555 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 3dg8 n HIS 556 N -0.28 0.00 -0.28 -2.53 8.25 -0.91 -3.97 115.22 115.49 3dg8 n HIS 556 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.56 3dg8 n HIS 556 Cb 0.10 -0.35 0.25 0.00 1.12 0.00 0.00 29.99 31.11 3dg8 n HIS 556 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3dg8 h ILE 557 N 0.00 0.43 -0.57 1.59 2.04 -1.50 0.45 117.51 119.95 3dg8 h ILE 557 Ca 0.00 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.67 3dg8 h ILE 557 Cb 0.71 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 3dg8 h ILE 557 CO 0.00 0.05 -0.04 0.44 0.00 0.00 0.00 178.15 178.60 3dg8 h ASP 558 N 0.27 1.03 -0.27 1.72 3.32 -1.82 -0.60 116.42 120.07 3dg8 h ASP 558 Ca 0.50 -0.32 -0.15 0.00 0.02 0.00 0.00 57.03 57.07 3dg8 h ASP 558 Cb 0.93 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 3dg8 h ASP 558 CO -0.57 1.10 -0.38 0.28 -1.72 0.00 0.00 179.24 177.95 3dg8 h SER 559 N 0.93 0.86 -0.49 6.45 0.02 -1.26 -2.70 113.55 117.36 3dg8 h SER 559 Ca 0.16 -0.39 -0.08 0.00 -0.84 0.00 0.00 61.79 60.64 3dg8 h SER 559 Cb 0.60 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 3dg8 h SER 559 CO 0.04 1.14 0.01 -0.07 -1.14 0.00 0.00 176.83 176.81 3dg8 h LEU 560 N 0.67 0.89 -0.23 5.07 3.38 -0.03 -1.62 115.31 123.45 3dg8 h LEU 560 Ca 0.06 -0.23 0.03 0.00 0.09 0.00 0.00 57.88 57.83 3dg8 h LEU 560 Cb 0.94 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 3dg8 h LEU 560 CO 0.09 0.95 0.04 0.11 0.09 0.00 0.00 178.44 179.71 3dg8 h LYS 561 N 0.85 0.12 -0.85 1.13 1.57 -0.99 0.11 116.57 118.51 3dg8 h LYS 561 Ca 0.16 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.99 3dg8 h LYS 561 Cb 0.49 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.72 3dg8 h LYS 561 CO 0.02 0.08 0.53 0.82 -0.57 0.00 0.00 179.45 180.33 3dg8 h ILE 562 N 0.12 1.06 -0.34 1.86 2.04 -1.21 -2.65 117.51 118.39 3dg8 h ILE 562 Ca 0.10 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.60 3dg8 h ILE 562 Cb 0.11 -0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.17 3dg8 h ILE 562 CO -0.15 0.18 0.10 -0.61 0.00 0.00 0.00 178.15 177.67 3dg8 h GLN 563 N 0.98 0.53 -0.35 2.37 4.15 -0.22 -2.82 115.11 119.74 3dg8 h GLN 563 Ca 0.36 -0.12 0.10 0.00 0.77 0.00 0.00 58.65 59.77 3dg8 h GLN 563 Cb 0.14 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 3dg8 h GLN 563 CO -0.16 0.57 0.31 -0.07 -1.93 0.00 0.00 178.83 177.54 3dg8 h LEU 564 N 0.39 0.00 -1.35 -2.39 4.07 -0.49 -1.40 115.31 114.14 3dg8 h LEU 564 Ca 0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.07 3dg8 h LEU 564 Cb 0.27 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.01 3dg8 h LEU 564 CO -0.00 0.00 0.00 0.59 -1.08 0.00 0.00 178.44 177.95 3dg8 n ASN 565 N -4.08 1.97 -4.79 -0.43 3.02 -1.06 -4.30 115.26 105.60 3dg8 n ASN 565 Ca 0.06 -1.98 -0.33 0.00 -0.03 0.00 0.00 54.58 52.29 3dg8 n ASN 565 Cb 0.48 -0.24 -0.07 0.00 -0.61 0.00 0.00 39.78 39.34 3dg8 n ASN 565 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3dg8 s ARG 566 N -1.52 3.07 -0.16 3.52 0.52 -0.53 -4.76 118.95 119.09 3dg8 s ARG 566 Ca 0.25 -0.48 -0.16 0.00 -0.52 0.00 0.00 55.73 54.82 3dg8 s ARG 566 Cb 0.13 -2.86 -0.04 0.00 0.52 0.00 0.00 34.95 32.70 3dg8 s ARG 566 CO 0.17 0.65 0.39 0.42 0.02 0.00 0.00 175.30 176.95 3dg8 s ILE 567 N -1.20 5.23 0.54 1.52 1.01 -1.26 -4.99 121.20 122.05 3dg8 s ILE 567 Ca 0.23 0.73 -0.22 0.00 0.00 0.00 0.00 60.65 61.39 3dg8 s ILE 567 Cb -0.12 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.58 3dg8 s ILE 567 CO 0.14 0.32 1.35 -2.84 0.00 0.00 0.00 174.94 173.91 3dg8 s PRO 568 N 0.81 3.19 0.33 2.79 0.02 -1.26 -4.88 135.00 136.00 3dg8 s PRO 568 Ca 0.20 2.21 0.05 0.00 0.02 0.00 0.00 61.00 63.48 3dg8 s PRO 568 Cb -0.14 -2.27 -0.01 0.00 0.02 0.00 0.00 34.50 32.09 3dg8 s PRO 568 CO 0.07 -1.14 0.48 0.71 -0.33 0.00 0.00 177.00 176.79 3dg8 s TYR 569 N -1.32 3.22 0.39 6.54 2.02 -1.26 -5.05 117.35 121.90 3dg8 s TYR 569 Ca 0.71 -0.08 -0.27 0.00 -0.37 0.00 0.00 57.07 57.06 3dg8 s TYR 569 Cb -0.40 -1.95 -0.09 0.00 -0.40 0.00 0.00 41.96 39.12 3dg8 s TYR 569 CO 0.47 0.04 1.35 -1.25 -1.57 0.00 0.00 175.55 174.58 3dg8 s PRO 570 N -4.20 4.02 0.81 -1.71 0.04 -1.26 -4.88 135.00 127.82 3dg8 s PRO 570 Ca 0.43 2.26 -0.12 0.00 0.04 0.00 0.00 61.00 63.61 3dg8 s PRO 570 Cb -0.09 -2.83 0.09 0.00 0.04 0.00 0.00 34.50 31.70 3dg8 s PRO 570 CO 0.32 -0.49 1.18 -0.06 0.04 0.00 0.00 177.00 177.99 3dg8 s PHE 571 N -1.21 1.89 0.05 0.56 0.08 -1.26 -4.61 117.98 113.48 3dg8 s PHE 571 Ca 0.55 1.68 -0.00 0.00 0.12 0.00 0.00 56.93 59.28 3dg8 s PHE 571 Cb -0.40 -3.40 0.01 0.00 -0.57 0.00 0.00 43.02 38.66 3dg8 s PHE 571 CO 0.53 -2.67 0.07 -0.35 -0.10 0.00 0.00 175.22 172.70 3dg8 n PRO 572 N -3.45 0.32 -4.37 0.24 -0.04 -1.25 -4.82 135.00 121.63 3dg8 n PRO 572 Ca 0.13 -0.15 -0.19 0.00 -0.04 0.00 0.00 63.50 63.24 3dg8 n PRO 572 Cb 0.51 -0.06 -0.10 0.00 -0.04 0.00 0.00 33.50 33.81 3dg8 n PRO 572 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3dg8 s THR 573 N -0.44 1.43 -0.10 0.52 -4.23 -0.56 -1.53 115.64 110.73 3dg8 s THR 573 Ca 0.04 -2.11 0.04 0.00 -1.18 0.00 0.00 61.69 58.49 3dg8 s THR 573 Cb -0.00 -2.28 -0.00 0.00 1.34 0.00 0.00 72.50 71.55 3dg8 s THR 573 CO 0.03 -0.41 -0.24 -0.22 -0.54 0.00 0.00 174.62 173.24 3dg8 s LEU 574 N -3.35 2.09 -0.14 4.79 2.96 -1.26 -0.68 118.68 123.10 3dg8 s LEU 574 Ca 0.27 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 3dg8 s LEU 574 Cb 0.03 -1.41 0.01 0.00 0.50 0.00 0.00 46.19 45.32 3dg8 s LEU 574 CO 0.09 0.16 -0.22 -0.75 -1.32 0.00 0.00 176.35 174.32 3dg8 s LYS 575 N 0.32 3.04 0.17 1.98 2.20 0.14 -4.99 119.74 122.59 3dg8 s LYS 575 Ca -0.18 -0.85 0.04 0.00 -0.36 0.00 0.00 55.97 54.62 3dg8 s LYS 575 Cb -0.18 -2.44 -0.04 0.00 -1.51 0.00 0.00 37.83 33.67 3dg8 s LYS 575 CO 0.09 0.01 0.25 -0.51 -0.36 0.00 0.00 175.35 174.83 3dg8 s LEU 576 N 0.76 4.19 -0.16 5.43 1.43 -1.26 -1.74 118.68 127.34 3dg8 s LEU 576 Ca -0.08 0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 52.80 3dg8 s LEU 576 Cb -0.16 -2.77 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 3dg8 s LEU 576 CO -0.01 0.04 1.80 0.21 0.23 0.00 0.00 176.35 178.62 3dg8 s ASN 577 N -3.31 6.25 0.52 2.29 3.84 -0.53 -4.85 114.94 119.15 3dg8 s ASN 577 Ca 0.34 1.92 0.35 0.00 0.21 0.00 0.00 52.86 55.67 3dg8 s ASN 577 Cb -0.10 -2.53 1.80 0.00 -0.55 0.00 0.00 41.25 39.87 3dg8 s ASN 577 CO 0.27 -1.32 2.06 1.55 -2.79 0.00 0.00 177.10 176.87 3dg8 h PRO 578 N 11.40 0.00 0.00 0.43 0.13 -1.95 -2.96 132.00 139.05 3dg8 h PRO 578 Ca -0.38 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.68 3dg8 h PRO 578 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 3dg8 h PRO 578 CO 0.98 0.00 -0.33 -0.44 -0.23 0.00 0.00 178.00 177.98 3dg8 h ASP 579 N 0.00 0.00 -2.76 1.44 3.32 -2.01 -3.43 116.42 112.97 3dg8 h ASP 579 Ca 0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 3dg8 h ASP 579 Cb 0.11 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 3dg8 h ASP 579 CO 0.00 0.33 1.05 -0.63 -1.72 0.00 0.00 179.24 178.27 3dg8 s ILE 580 N -3.72 3.83 0.00 0.35 -1.09 -1.12 -4.86 121.20 114.59 3dg8 s ILE 580 Ca -0.00 0.98 0.00 0.00 -2.23 0.00 0.00 60.65 59.39 3dg8 s ILE 580 Cb 0.11 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.28 3dg8 s ILE 580 CO 0.67 -0.18 0.80 0.29 -1.23 0.00 0.00 174.94 175.30 3dg8 n LYS 581 N 7.18 1.48 -4.83 2.79 4.76 -1.26 -4.65 118.16 123.64 3dg8 n LYS 581 Ca 0.17 -1.11 -0.27 0.00 -2.87 0.00 0.00 58.31 54.23 3dg8 n LYS 581 Cb 0.44 -0.99 -0.17 0.00 -1.84 0.00 0.00 35.03 32.48 3dg8 n LYS 581 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 3dg8 s ASN 582 N -0.62 2.24 0.62 4.39 2.47 -1.26 -4.66 114.94 118.13 3dg8 s ASN 582 Ca 0.00 -0.39 0.30 0.00 0.42 0.00 0.00 52.86 53.19 3dg8 s ASN 582 Cb 0.00 -0.92 1.62 0.00 -1.45 0.00 0.00 41.25 40.50 3dg8 s ASN 582 CO 0.00 0.10 1.98 -0.29 -3.72 0.00 0.00 177.10 175.17 3dg8 h ILE 583 N 5.70 0.25 -0.01 -5.21 6.09 -1.93 -0.63 117.51 121.78 3dg8 h ILE 583 Ca -0.28 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 3dg8 h ILE 583 Cb 1.20 0.71 0.00 0.00 0.47 0.00 0.00 36.82 39.20 3dg8 h ILE 583 CO 0.47 0.00 -0.36 -0.62 -3.07 0.00 0.00 178.15 174.57 3dg8 n GLU 584 N -3.43 0.85 -0.01 2.19 1.02 -1.26 -4.27 120.64 115.73 3dg8 n GLU 584 Ca 0.03 -0.58 0.13 0.00 -0.02 0.00 0.00 57.16 56.72 3dg8 n GLU 584 Cb 0.45 -1.49 0.34 0.00 -0.02 0.00 0.00 31.44 30.72 3dg8 n GLU 584 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3dg8 n ASP 585 N -0.57 2.18 -4.77 1.62 8.00 -0.24 -4.96 116.55 117.81 3dg8 n ASP 585 Ca 0.11 -1.73 -0.37 0.00 0.71 0.00 0.00 54.79 53.51 3dg8 n ASP 585 Cb 0.38 -0.01 -0.01 0.00 -0.02 0.00 0.00 41.12 41.46 3dg8 n ASP 585 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dg8 s PHE 586 N -1.97 2.88 0.08 1.24 0.08 -1.26 -5.01 117.98 114.01 3dg8 s PHE 586 Ca 0.34 1.54 0.00 0.00 0.12 0.00 0.00 56.93 58.93 3dg8 s PHE 586 Cb 0.20 -3.37 -0.04 0.00 -0.57 0.00 0.00 43.02 39.24 3dg8 s PHE 586 CO 0.32 -1.49 -0.04 0.95 -0.10 0.00 0.00 175.22 174.85 3dg8 s THR 587 N -1.55 0.44 0.36 0.64 -4.23 -1.26 -5.05 115.64 104.99 3dg8 s THR 587 Ca 0.64 -1.87 0.15 0.00 -1.18 0.00 0.00 61.69 59.42 3dg8 s THR 587 Cb -0.28 -1.62 0.36 0.00 1.34 0.00 0.00 72.50 72.29 3dg8 s THR 587 CO 0.34 -0.92 1.72 -0.29 -0.54 0.00 0.00 174.62 174.94 3dg8 h ILE 588 N 3.05 0.45 0.00 2.99 6.09 -1.97 -0.10 117.51 128.02 3dg8 h ILE 588 Ca -0.35 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.00 3dg8 h ILE 588 Cb 1.15 -0.01 0.00 0.00 0.47 0.00 0.00 36.82 38.43 3dg8 h ILE 588 CO 0.65 0.08 0.00 -1.54 -3.07 0.00 0.00 178.15 174.27 3dg8 n SER 589 N -4.81 0.24 -0.14 2.19 3.41 -1.26 -2.95 113.62 110.31 3dg8 n SER 589 Ca 0.28 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.58 3dg8 n SER 589 Cb 0.89 -0.61 0.69 0.00 -0.26 0.00 0.00 64.21 64.93 3dg8 n SER 589 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3dg8 n ASP 590 N -1.76 0.41 -4.43 4.04 8.00 -0.05 -4.81 116.55 117.96 3dg8 n ASP 590 Ca 0.03 -1.29 -0.33 0.00 0.71 0.00 0.00 54.79 53.91 3dg8 n ASP 590 Cb 0.20 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 41.15 3dg8 n ASP 590 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dg8 s PHE 591 N -1.98 2.81 -0.07 1.24 0.40 -1.15 -1.45 117.98 117.79 3dg8 s PHE 591 Ca 0.38 -0.43 -0.03 0.00 -0.60 0.00 0.00 56.93 56.25 3dg8 s PHE 591 Cb 0.18 -1.79 0.04 0.00 0.51 0.00 0.00 43.02 41.97 3dg8 s PHE 591 CO 0.30 -0.05 0.13 0.99 0.70 0.00 0.00 175.22 177.29 3dg8 s THR 592 N -0.02 -0.16 -0.21 0.64 2.01 -0.71 -5.01 115.64 112.18 3dg8 s THR 592 Ca -0.03 0.31 -0.14 0.00 0.31 0.00 0.00 61.69 62.15 3dg8 s THR 592 Cb -0.14 -0.23 -0.04 0.00 0.01 0.00 0.00 72.50 72.09 3dg8 s THR 592 CO 0.04 0.13 0.31 -0.63 -0.69 0.00 0.00 174.62 173.78 3dg8 s ILE 593 N 1.88 5.26 -0.05 1.82 -1.09 -1.26 -0.68 121.20 127.09 3dg8 s ILE 593 Ca -0.01 0.51 0.04 0.00 -2.23 0.00 0.00 60.65 58.97 3dg8 s ILE 593 Cb -0.12 -3.64 -0.02 0.00 -1.58 0.00 0.00 42.46 37.09 3dg8 s ILE 593 CO -0.05 0.30 -0.16 -1.10 -1.23 0.00 0.00 174.94 172.70 3dg8 s GLN 594 N 1.15 2.46 -1.32 2.79 -0.21 0.15 -4.72 119.66 119.96 3dg8 s GLN 594 Ca 0.15 -0.73 -0.06 0.00 0.02 0.00 0.00 55.36 54.74 3dg8 s GLN 594 Cb -0.14 -2.34 0.01 0.00 1.00 0.00 0.00 33.01 31.55 3dg8 s GLN 594 CO 0.06 0.61 1.07 0.09 -2.12 0.00 0.00 175.29 175.00 3dg8 n ASN 595 N 2.35 -4.40 -4.57 5.90 3.02 -1.26 -1.50 115.26 114.79 3dg8 n ASN 595 Ca -0.17 -0.61 -0.42 0.00 -0.03 0.00 0.00 54.58 53.34 3dg8 n ASN 595 Cb 0.52 -4.86 -0.03 0.00 -0.61 0.00 0.00 39.78 34.80 3dg8 n ASN 595 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3dg8 s TYR 596 N -3.36 2.66 -0.21 3.10 5.04 -1.26 -4.24 117.35 119.08 3dg8 s TYR 596 Ca 0.36 0.36 -0.06 0.00 -2.44 0.00 0.00 57.07 55.29 3dg8 s TYR 596 Cb -0.16 -4.42 -0.03 0.00 0.35 0.00 0.00 41.96 37.70 3dg8 s TYR 596 CO 0.75 -1.51 0.03 0.08 -1.34 0.00 0.00 175.55 173.56 3dg8 s VAL 597 N 4.72 4.22 0.14 3.14 1.01 -1.26 -5.06 120.40 127.31 3dg8 s VAL 597 Ca 0.41 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 62.09 3dg8 s VAL 597 Cb -0.08 -2.92 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 3dg8 s VAL 597 CO 0.25 0.41 0.23 -1.38 0.00 0.00 0.00 175.10 174.61 3dg8 s HIS 598 N 1.01 0.40 0.87 5.22 -3.43 -1.26 -4.67 115.29 113.43 3dg8 s HIS 598 Ca 0.03 -0.79 -0.12 0.00 -0.80 0.00 0.00 55.06 53.38 3dg8 s HIS 598 Cb -0.14 -0.12 0.11 0.00 -1.43 0.00 0.00 32.58 31.01 3dg8 s HIS 598 CO 0.02 -0.65 1.16 -1.01 -2.00 0.00 0.00 174.74 172.27 3dg8 s HIS 599 N -3.95 2.68 0.83 0.38 3.76 -0.04 -4.97 115.29 113.97 3dg8 s HIS 599 Ca 0.15 0.78 -0.11 0.00 -0.15 0.00 0.00 55.06 55.74 3dg8 s HIS 599 Cb 0.04 -3.47 0.09 0.00 1.11 0.00 0.00 32.58 30.36 3dg8 s HIS 599 CO -0.02 -2.11 1.10 -1.83 -0.85 0.00 0.00 174.74 171.03 3dg8 s GLU 600 N -5.44 1.77 0.70 1.40 -1.05 -1.26 -3.43 118.70 111.39 3dg8 s GLU 600 Ca 0.63 1.16 -0.16 0.00 -0.15 0.00 0.00 54.97 56.45 3dg8 s GLU 600 Cb -0.13 -1.84 0.02 0.00 -0.44 0.00 0.00 34.13 31.74 3dg8 s GLU 600 CO 0.51 -1.98 1.22 -1.59 0.95 0.00 0.00 175.26 174.37 3dg8 s LYS 601 N -4.86 2.33 -0.04 -4.83 -2.85 -1.26 -3.68 119.74 104.55 3dg8 s LYS 601 Ca 0.63 1.82 0.04 0.00 -1.00 0.00 0.00 55.97 57.45 3dg8 s LYS 601 Cb -0.18 -1.85 -0.00 0.00 -2.06 0.00 0.00 37.83 33.73 3dg8 s LYS 601 CO 0.57 -1.70 -0.16 0.42 0.10 0.00 0.00 175.35 174.57 3dg8 s ILE 602 N -1.84 1.33 -0.54 3.79 1.01 -1.26 -4.85 121.20 118.84 3dg8 s ILE 602 Ca 0.76 -0.67 -0.22 0.00 0.00 0.00 0.00 60.65 60.52 3dg8 s ILE 602 Cb -0.31 -1.14 0.05 0.00 0.01 0.00 0.00 42.46 41.07 3dg8 s ILE 602 CO 0.43 0.38 0.82 -0.44 0.00 0.00 0.00 174.94 176.13 3dg8 s SER 603 N 0.01 6.29 0.36 3.58 0.01 -1.26 -4.88 113.70 117.80 3dg8 s SER 603 Ca -0.02 -0.59 0.05 0.00 1.31 0.00 0.00 55.95 56.69 3dg8 s SER 603 Cb -0.10 -2.38 0.71 0.00 0.21 0.00 0.00 66.02 64.46 3dg8 s SER 603 CO 0.02 -1.11 1.96 0.24 0.41 0.00 0.00 173.24 174.76 3dg8 h MET 604 N 9.20 0.76 -4.97 12.44 0.00 -1.93 -3.26 114.93 127.17 3dg8 h MET 604 Ca -0.27 -0.05 -0.70 0.00 0.00 0.00 0.00 59.70 58.69 3dg8 h MET 604 Cb 1.08 -0.17 -0.18 0.00 0.00 0.00 0.00 31.60 32.33 3dg8 h MET 604 CO 1.05 0.51 0.89 0.34 0.00 0.00 0.00 176.91 179.69 3dg8 s ASP 605 N -6.22 6.68 0.00 1.22 -1.08 -1.26 -4.09 116.67 111.92 3dg8 s ASP 605 Ca -0.10 -2.17 0.00 0.00 -0.52 0.00 0.00 52.55 49.76 3dg8 s ASP 605 Cb 0.19 -2.40 0.00 0.00 -1.46 0.00 0.00 42.92 39.26 3dg8 s ASP 605 CO 0.77 -1.02 0.46 1.15 0.52 0.00 0.00 175.17 177.06 3dg8 n MET 606 N 6.40 0.00 -2.57 4.34 -0.00 -1.23 -4.82 117.12 119.24 3dg8 n MET 606 Ca 0.25 0.10 -0.22 0.00 -0.00 0.00 0.00 57.70 57.84 3dg8 n MET 606 Cb 0.48 -1.66 0.04 0.00 -0.00 0.00 0.00 33.22 32.09 3dg8 n MET 606 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3dg8 s ALA 607 N -1.92 3.77 0.00 3.17 0.00 -1.26 -5.13 121.76 120.38 3dg8 s ALA 607 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.71 3dg8 s ALA 607 Cb 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 20.95 3dg8 s ALA 607 CO 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 175.76 174.92