#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k93 n VAL 295 N 0.00 0.00 -4.49 5.18 0.24 -1.26 -4.68 118.33 113.32 1k93 n VAL 295 Ca 0.00 -0.03 -0.23 0.00 -2.04 0.00 0.00 64.34 62.04 1k93 n VAL 295 Cb 0.00 -1.62 -0.11 0.00 -1.47 0.00 0.00 33.84 30.64 1k93 n VAL 295 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1k93 s LEU 296 N 0.00 2.38 0.25 1.34 1.43 -1.04 -4.93 118.68 118.12 1k93 s LEU 296 Ca 0.02 -1.37 -0.16 0.00 -1.03 0.00 0.00 54.13 51.59 1k93 s LEU 296 Cb -0.00 -0.53 0.01 0.00 0.03 0.00 0.00 46.19 45.69 1k93 s LEU 296 CO 0.01 -0.55 0.55 -0.54 0.23 0.00 0.00 176.35 176.05 1k93 s LYS 297 N -3.84 1.59 0.47 1.70 1.02 -1.26 -2.31 119.74 117.12 1k93 s LYS 297 Ca 0.36 -1.13 0.00 0.00 0.02 0.00 0.00 55.97 55.22 1k93 s LYS 297 Cb 0.09 0.51 0.00 0.00 -0.52 0.00 0.00 37.83 37.91 1k93 s LYS 297 CO 0.16 -0.68 0.00 0.41 -0.92 0.00 0.00 175.35 174.32 1k93 n GLY 298 N -0.40 -2.48 0.00 -3.33 0.00 -1.22 -3.39 105.19 94.36 1k93 n GLY 298 Ca -0.03 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1k93 n GLY 298 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1k93 n GLU 299 N -4.02 0.00 -0.23 1.61 -0.58 -1.26 0.15 120.64 116.32 1k93 n GLU 299 Ca -0.07 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 56.82 1k93 n GLU 299 Cb 0.56 0.00 0.27 0.00 -0.57 0.00 0.00 31.44 31.70 1k93 n GLU 299 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1k93 n LYS 300 N -1.28 -0.05 -0.00 3.49 3.00 -1.25 0.96 118.16 123.03 1k93 n LYS 300 Ca 0.00 1.00 -0.12 0.00 -0.00 0.00 0.00 58.31 59.19 1k93 n LYS 300 Cb 0.00 -1.66 -0.10 0.00 0.00 0.00 0.00 35.03 33.28 1k93 n LYS 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1k93 h ALA 301 N 1.37 -0.08 -0.80 3.14 0.00 0.14 -3.14 119.26 119.90 1k93 h ALA 301 Ca 0.47 -0.29 0.23 0.00 0.00 0.00 0.00 54.91 55.32 1k93 h ALA 301 Cb 1.09 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1k93 h ALA 301 CO -0.61 -0.21 0.58 1.25 0.00 0.00 0.00 179.25 180.26 1k93 h LEU 302 N -0.73 0.00 -0.21 0.00 5.85 0.52 0.92 115.31 121.65 1k93 h LEU 302 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1k93 h LEU 302 Cb 0.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1k93 h LEU 302 CO 0.01 0.00 0.00 0.29 -0.34 0.00 0.00 178.44 178.40 1k93 n LYS 303 N -4.27 0.87 0.00 1.25 5.02 0.15 -2.80 118.16 118.38 1k93 n LYS 303 Ca 0.16 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1k93 n LYS 303 Cb 0.88 -1.09 0.00 0.00 -0.02 0.00 0.00 35.03 34.80 1k93 n LYS 303 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1k93 n ALA 304 N -0.38 0.68 0.08 7.82 0.00 0.32 -4.72 120.51 124.31 1k93 n ALA 304 Ca 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 53.44 53.35 1k93 n ALA 304 Cb 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.45 1k93 n ALA 304 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1k93 h SER 305 N 0.00 0.09 0.00 0.00 4.64 -1.31 -3.45 113.55 113.52 1k93 h SER 305 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1k93 h SER 305 Cb 0.04 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1k93 h SER 305 CO 0.00 0.96 0.00 0.61 -0.87 0.00 0.00 176.83 177.53 1k93 n GLY 306 N 1.05 1.30 3.75 -0.77 0.00 -1.25 -1.77 105.19 107.50 1k93 n GLY 306 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 3.10 -0.29 0.99 1.02 -1.26 -4.32 118.68 117.92 1k93 s LEU 307 Ca 0.00 1.97 -0.19 0.00 0.02 0.00 0.00 54.13 55.92 1k93 s LEU 307 Cb 0.00 -4.54 -0.02 0.00 0.02 0.00 0.00 46.19 41.65 1k93 s LEU 307 CO 0.00 -2.15 0.59 -0.69 0.02 0.00 0.00 176.35 174.12 1k93 s VAL 308 N -2.66 4.99 0.30 -1.59 1.01 -1.26 -4.95 120.40 116.24 1k93 s VAL 308 Ca 0.64 0.89 -0.00 0.00 0.00 0.00 0.00 61.98 63.51 1k93 s VAL 308 Cb -0.20 -3.94 0.43 0.00 0.00 0.00 0.00 36.38 32.67 1k93 s VAL 308 CO 0.52 -0.05 1.56 -0.81 0.00 0.00 0.00 175.10 176.33 1k93 n PRO 309 N 5.74 -0.08 0.28 2.72 -0.04 -1.26 0.56 135.00 142.92 1k93 n PRO 309 Ca -0.02 1.51 0.13 0.00 -0.04 0.00 0.00 63.50 65.07 1k93 n PRO 309 Cb 0.49 -2.36 0.81 0.00 -0.04 0.00 0.00 33.50 32.40 1k93 n PRO 309 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1k93 h GLU 310 N 0.00 0.00 0.07 0.54 3.07 -1.99 0.27 114.58 116.54 1k93 h GLU 310 Ca 0.58 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 59.13 1k93 h GLU 310 Cb 1.14 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.02 1k93 h GLU 310 CO -0.96 0.03 -1.64 0.45 -1.40 0.00 0.00 179.01 175.48 1k93 h HIS 311 N 0.00 0.26 -0.04 4.33 3.86 -0.29 -2.89 115.15 120.38 1k93 h HIS 311 Ca -0.00 -0.19 -0.00 0.00 -1.16 0.00 0.00 60.37 59.02 1k93 h HIS 311 Cb 0.06 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.52 1k93 h HIS 311 CO 0.00 1.29 0.01 0.00 0.86 0.00 0.00 177.93 180.09 1k93 h ALA 312 N 0.63 0.05 -0.45 2.45 0.00 -0.05 -1.45 119.26 120.44 1k93 h ALA 312 Ca -0.27 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1k93 h ALA 312 Cb 2.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1k93 h ALA 312 CO 0.11 -0.33 0.00 -0.25 0.00 0.00 0.00 179.25 178.79 1k93 n ASP 313 N -4.94 0.00 -0.39 0.00 10.43 0.86 -0.21 116.55 122.30 1k93 n ASP 313 Ca -0.07 0.92 0.37 0.00 2.57 0.00 0.00 54.79 58.58 1k93 n ASP 313 Cb 0.14 -0.42 0.56 0.00 1.84 0.00 0.00 41.12 43.23 1k93 n ASP 313 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1k93 n ALA 314 N -2.18 1.30 0.00 2.24 0.00 -1.09 0.14 120.51 120.92 1k93 n ALA 314 Ca 0.00 0.45 -0.05 0.00 0.00 0.00 0.00 53.44 53.84 1k93 n ALA 314 Cb 0.00 -0.78 0.17 0.00 0.00 0.00 0.00 19.45 18.84 1k93 n ALA 314 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1k93 h PHE 315 N 0.00 0.59 -0.20 0.00 0.05 0.54 -3.15 116.94 114.77 1k93 h PHE 315 Ca 0.64 -0.14 0.04 0.00 3.82 0.00 0.00 57.97 62.34 1k93 h PHE 315 Cb 3.21 -0.14 -0.07 0.00 2.00 0.00 0.00 35.95 40.95 1k93 h PHE 315 CO 0.00 0.75 -0.51 0.87 -0.18 0.00 0.00 178.31 179.25 1k93 h LYS 316 N 0.45 -0.49 -0.90 1.51 1.57 0.15 -0.08 116.57 118.77 1k93 h LYS 316 Ca 0.06 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.96 1k93 h LYS 316 Cb 0.73 0.11 -0.12 0.00 0.08 0.00 0.00 32.23 33.04 1k93 h LYS 316 CO 0.06 -0.33 -0.56 0.87 -0.57 0.00 0.00 179.45 178.92 1k93 h LYS 317 N -0.51 -0.06 -0.06 3.15 1.57 -1.64 0.85 116.57 119.87 1k93 h LYS 317 Ca 0.06 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1k93 h LYS 317 Cb 0.65 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1k93 h LYS 317 CO -0.47 -0.04 -0.23 0.82 -0.57 0.00 0.00 179.45 178.96 1k93 h ILE 318 N -0.07 1.19 -0.29 1.86 5.03 -1.49 -1.79 117.51 121.96 1k93 h ILE 318 Ca 0.17 -0.90 -0.06 0.00 -0.12 0.00 0.00 64.86 63.94 1k93 h ILE 318 Cb 0.46 1.41 -0.02 0.00 -3.03 0.00 0.00 36.82 35.65 1k93 h ILE 318 CO -0.89 0.27 -0.10 0.00 -0.68 0.00 0.00 178.15 176.75 1k93 h ALA 319 N 1.69 1.29 0.00 1.87 0.00 0.10 -2.56 119.26 121.66 1k93 h ALA 319 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1k93 h ALA 319 Cb 0.46 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1k93 h ALA 319 CO 0.03 0.47 -0.14 0.07 0.00 0.00 0.00 179.25 179.68 1k93 h ARG 320 N 0.45 0.00 -1.31 0.00 0.11 -0.85 -0.27 114.38 112.51 1k93 h ARG 320 Ca 0.09 0.00 0.42 0.00 0.10 0.00 0.00 59.98 60.58 1k93 h ARG 320 Cb 0.45 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 31.44 1k93 h ARG 320 CO 0.02 0.00 0.89 0.39 0.10 0.00 0.00 179.97 181.37 1k93 n GLU 321 N -3.42 -0.02 -0.20 0.08 1.02 -0.71 0.30 120.64 117.69 1k93 n GLU 321 Ca -0.02 0.96 0.08 0.00 -0.02 0.00 0.00 57.16 58.16 1k93 n GLU 321 Cb 0.07 -2.01 0.19 0.00 -0.02 0.00 0.00 31.44 29.67 1k93 n GLU 321 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1k93 n LEU 322 N -4.02 3.12 -3.62 -4.62 4.77 -0.96 -5.01 117.00 106.66 1k93 n LEU 322 Ca 0.34 -1.83 -0.27 0.00 -0.03 0.00 0.00 56.01 54.23 1k93 n LEU 322 Cb 1.41 -0.27 0.01 0.00 -2.33 0.00 0.00 43.42 42.25 1k93 n LEU 322 CO 0.23 0.75 -0.25 -3.20 -1.33 0.00 0.00 177.39 173.60 1k93 n ASN 323 N 0.91 -4.61 -3.76 -1.43 2.85 0.87 -4.52 115.26 105.57 1k93 n ASN 323 Ca 0.15 -0.72 -0.13 0.00 -0.11 0.00 0.00 54.58 53.77 1k93 n ASN 323 Cb 0.48 -1.48 -0.11 0.00 1.24 0.00 0.00 39.78 39.91 1k93 n ASN 323 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 1k93 s THR 324 N -2.51 -0.00 0.14 -0.44 -4.23 -0.16 -0.37 115.64 108.07 1k93 s THR 324 Ca 0.10 0.02 -0.30 0.00 -1.18 0.00 0.00 61.69 60.32 1k93 s THR 324 Cb -0.01 -0.44 -0.06 0.00 1.34 0.00 0.00 72.50 73.33 1k93 s THR 324 CO 0.83 0.01 0.96 -0.31 -0.54 0.00 0.00 174.62 175.57 1k93 s TYR 325 N 0.32 3.84 -0.22 3.99 1.51 0.12 -3.73 117.35 123.18 1k93 s TYR 325 Ca -0.01 1.82 0.02 0.00 -1.01 0.00 0.00 57.07 57.89 1k93 s TYR 325 Cb -0.03 -3.04 0.04 0.00 -0.11 0.00 0.00 41.96 38.82 1k93 s TYR 325 CO -0.01 0.25 -0.14 0.42 -1.11 0.00 0.00 175.55 174.96 1k93 s ILE 326 N -0.22 2.02 -0.14 2.71 1.01 -0.50 -1.36 121.20 124.72 1k93 s ILE 326 Ca 0.46 -1.26 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 1k93 s ILE 326 Cb -0.24 -2.01 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 1k93 s ILE 326 CO 0.30 0.22 -0.03 -0.76 0.00 0.00 0.00 174.94 174.67 1k93 s LEU 327 N 1.23 3.35 0.04 2.97 1.02 -0.62 -1.25 118.68 125.42 1k93 s LEU 327 Ca -0.02 -0.05 0.08 0.00 0.02 0.00 0.00 54.13 54.15 1k93 s LEU 327 Cb -0.17 -1.79 -0.03 0.00 0.02 0.00 0.00 46.19 44.22 1k93 s LEU 327 CO -0.09 0.22 -0.21 -0.36 0.02 0.00 0.00 176.35 175.94 1k93 s PHE 328 N 0.03 2.48 0.95 0.29 0.40 0.46 -0.02 117.98 122.58 1k93 s PHE 328 Ca 0.01 -0.31 -0.15 0.00 -0.60 0.00 0.00 56.93 55.89 1k93 s PHE 328 Cb -0.13 -1.44 0.17 0.00 0.51 0.00 0.00 43.02 42.13 1k93 s PHE 328 CO 0.02 0.21 1.22 1.03 0.70 0.00 0.00 175.22 178.41 1k93 s ARG 329 N -1.35 0.78 1.03 0.44 0.52 0.73 -1.88 118.95 119.22 1k93 s ARG 329 Ca 0.14 -0.10 -0.12 0.00 -0.52 0.00 0.00 55.73 55.13 1k93 s ARG 329 Cb -0.10 -1.83 0.21 0.00 0.52 0.00 0.00 34.95 33.74 1k93 s ARG 329 CO 0.04 -2.37 1.07 -2.14 0.02 0.00 0.00 175.30 171.92 1k93 s PRO 330 N -5.62 0.11 -0.06 3.54 0.02 -1.26 -4.74 135.00 126.99 1k93 s PRO 330 Ca 0.69 0.91 -0.01 0.00 0.02 0.00 0.00 61.00 62.60 1k93 s PRO 330 Cb -0.09 -1.67 0.03 0.00 0.02 0.00 0.00 34.50 32.79 1k93 s PRO 330 CO 0.53 -3.05 0.01 0.08 -0.33 0.00 0.00 177.00 174.24 1k93 s VAL 331 N -2.68 0.30 -0.39 3.83 1.01 -0.73 -4.75 120.40 116.99 1k93 s VAL 331 Ca 0.66 0.16 -0.41 0.00 0.00 0.00 0.00 61.98 62.39 1k93 s VAL 331 Cb -0.22 -0.47 -0.16 0.00 0.00 0.00 0.00 36.38 35.53 1k93 s VAL 331 CO 0.61 0.24 1.94 -3.20 0.00 0.00 0.00 175.10 174.69 1k93 n ASN 332 N 5.08 1.71 0.25 3.32 4.05 -1.26 -4.20 115.26 124.21 1k93 n ASN 332 Ca -0.08 0.82 0.09 0.00 0.45 0.00 0.00 54.58 55.86 1k93 n ASN 332 Cb 0.50 -1.07 0.65 0.00 1.23 0.00 0.00 39.78 41.10 1k93 n ASN 332 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 1k93 h LYS 333 N 8.66 0.00 0.00 1.20 1.57 -1.91 0.11 116.57 126.19 1k93 h LYS 333 Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1k93 h LYS 333 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1k93 h LYS 333 CO 1.01 0.10 0.00 1.28 -0.57 0.00 0.00 179.45 181.27 1k93 n LEU 334 N -4.16 0.00 -0.03 2.94 7.99 -1.26 -3.05 117.00 119.44 1k93 n LEU 334 Ca -0.03 0.00 0.01 0.00 -0.01 0.00 0.00 56.01 55.99 1k93 n LEU 334 Cb 0.18 0.00 -0.09 0.00 -0.11 0.00 0.00 43.42 43.39 1k93 n LEU 334 CO 0.33 0.00 -0.74 0.00 -1.51 0.00 0.00 177.39 175.47 1k93 n ALA 335 N -0.80 2.16 -0.13 -1.18 0.00 -0.01 -3.99 120.51 116.56 1k93 n ALA 335 Ca 0.15 -0.49 -0.04 0.00 0.00 0.00 0.00 53.44 53.06 1k93 n ALA 335 Cb 0.07 -0.25 0.04 0.00 0.00 0.00 0.00 19.45 19.30 1k93 n ALA 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k93 h THR 336 N 0.00 0.75 -0.68 0.00 1.03 -1.38 0.20 112.91 112.83 1k93 h THR 336 Ca -0.13 -0.06 0.04 0.00 -0.01 0.00 0.00 66.41 66.25 1k93 h THR 336 Cb 1.03 0.55 -0.05 0.00 -1.07 0.00 0.00 68.15 68.62 1k93 h THR 336 CO 0.01 0.03 0.41 0.78 -0.01 0.00 0.00 175.52 176.74 1k93 h ASN 337 N 0.18 0.66 -0.63 0.00 2.35 -1.81 0.13 115.58 116.45 1k93 h ASN 337 Ca 0.21 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1k93 h ASN 337 Cb 0.27 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.48 1k93 h ASN 337 CO -0.29 0.44 0.41 -0.07 -1.65 0.00 0.00 177.43 176.27 1k93 h LEU 338 N 0.79 0.74 -0.30 1.61 3.38 -1.45 -1.20 115.31 118.89 1k93 h LEU 338 Ca 0.29 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.23 1k93 h LEU 338 Cb 0.08 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1k93 h LEU 338 CO -0.13 0.56 0.18 0.40 0.09 0.00 0.00 178.44 179.54 1k93 h ILE 339 N 0.86 1.05 -0.96 1.22 2.04 0.59 -1.73 117.51 120.58 1k93 h ILE 339 Ca 0.23 -0.13 0.13 0.00 1.00 0.00 0.00 64.86 66.09 1k93 h ILE 339 Cb -0.07 0.64 -0.09 0.00 -0.74 0.00 0.00 36.82 36.57 1k93 h ILE 339 CO -0.05 0.07 0.58 0.50 0.00 0.00 0.00 178.15 179.25 1k93 h LYS 340 N 0.37 0.87 0.00 2.37 3.64 -0.39 -0.83 116.57 122.61 1k93 h LYS 340 Ca 0.11 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1k93 h LYS 340 Cb -0.02 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.60 1k93 h LYS 340 CO -0.04 0.58 0.00 -1.13 -2.27 0.00 0.00 179.45 176.58 1k93 n SER 341 N -4.68 0.00 0.00 4.20 3.41 -0.49 -4.87 113.62 111.19 1k93 n SER 341 Ca 0.18 -1.41 0.00 0.00 -0.26 0.00 0.00 58.87 57.38 1k93 n SER 341 Cb 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 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 0.23 2.34 3.57 5.00 0.00 -0.32 -4.97 105.19 111.05 1k93 n GLY 342 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1k93 n GLY 342 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1k93 n VAL 343 N -2.00 2.10 -1.91 1.61 0.31 -1.09 -2.30 118.33 115.05 1k93 n VAL 343 Ca 0.00 -0.50 -0.35 0.00 -0.01 0.00 0.00 64.34 63.48 1k93 n VAL 343 Cb 0.00 -0.95 0.04 0.00 -0.91 0.00 0.00 33.84 32.02 1k93 n VAL 343 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k93 s ALA 344 N -1.19 2.48 -0.09 3.52 0.00 -1.23 -4.71 121.76 120.54 1k93 s ALA 344 Ca 0.61 0.93 0.02 0.00 0.00 0.00 0.00 51.96 53.52 1k93 s ALA 344 Cb -0.65 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.02 1k93 s ALA 344 CO 0.59 -1.26 -0.14 0.95 0.00 0.00 0.00 175.76 175.90 1k93 s THR 345 N -1.74 3.05 0.24 0.00 -4.23 -1.26 -0.06 115.64 111.64 1k93 s THR 345 Ca 0.76 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 60.27 1k93 s THR 345 Cb -0.29 -2.24 -0.10 0.00 1.34 0.00 0.00 72.50 71.21 1k93 s THR 345 CO 0.35 0.55 1.47 -1.59 -0.54 0.00 0.00 174.62 174.86 1k93 s LYS 346 N -0.13 4.25 0.00 3.99 -2.85 -0.49 -4.83 119.74 119.68 1k93 s LYS 346 Ca -0.01 2.32 0.00 0.00 -1.00 0.00 0.00 55.97 57.28 1k93 s LYS 346 Cb -0.14 -3.11 0.00 0.00 -2.06 0.00 0.00 37.83 32.52 1k93 s LYS 346 CO 0.03 -0.46 0.00 0.41 0.10 0.00 0.00 175.35 175.43 1k93 n GLY 347 N 2.45 1.87 0.00 0.59 0.00 -1.26 -4.48 105.19 104.35 1k93 n GLY 347 Ca 0.08 -2.06 0.08 0.00 0.00 0.00 0.00 46.02 44.12 1k93 n GLY 347 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k93 n LEU 348 N 0.00 0.00 0.17 0.99 4.77 -1.26 -2.14 117.00 119.52 1k93 n LEU 348 Ca 0.00 0.27 0.13 0.00 -0.03 0.00 0.00 56.01 56.38 1k93 n LEU 348 Cb 0.00 -0.27 0.40 0.00 -2.33 0.00 0.00 43.42 41.23 1k93 n LEU 348 CO 0.00 -0.12 0.88 -0.55 -1.33 0.00 0.00 177.39 176.27 1k93 h ASN 349 N 0.00 0.00 -3.53 -1.43 7.08 -1.93 -3.41 115.58 112.36 1k93 h ASN 349 Ca 0.00 0.00 -0.59 0.00 -3.08 0.00 0.00 56.30 52.63 1k93 h ASN 349 Cb 0.15 0.00 -0.39 0.00 -2.08 0.00 0.00 38.32 36.00 1k93 h ASN 349 CO 0.00 0.00 -0.78 -0.69 -2.08 0.00 0.00 177.43 173.88 1k93 s VAL 350 N -3.26 1.31 -1.60 6.14 1.01 -0.91 -4.65 120.40 118.44 1k93 s VAL 350 Ca 0.07 -1.14 0.20 0.00 0.00 0.00 0.00 61.98 61.10 1k93 s VAL 350 Cb 0.09 -1.67 0.62 0.00 0.00 0.00 0.00 36.38 35.42 1k93 s VAL 350 CO 0.57 -0.18 1.52 1.41 0.00 0.00 0.00 175.10 178.42 1k93 n HIS 351 N 4.74 1.04 -1.55 5.22 8.25 -1.26 -4.67 115.22 127.00 1k93 n HIS 351 Ca -0.10 -0.53 -0.32 0.00 -0.26 0.00 0.00 57.72 56.51 1k93 n HIS 351 Cb 0.44 -0.07 0.06 0.00 1.12 0.00 0.00 29.99 31.55 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 -1.00 1.85 -0.05 -1.41 0.00 -1.26 -4.95 107.32 100.51 1k93 s GLY 352 Ca 0.46 0.32 -0.13 0.00 0.00 0.00 0.00 44.72 45.38 1k93 s GLY 352 CO 0.29 0.66 0.33 0.54 0.00 0.00 0.00 173.10 174.91 1k93 s LYS 353 N -4.62 3.84 0.63 2.90 3.01 -1.26 -5.03 119.74 119.21 1k93 s LYS 353 Ca 0.62 0.23 -0.17 0.00 -1.01 0.00 0.00 55.97 55.64 1k93 s LYS 353 Cb -0.17 -3.24 -0.11 0.00 -1.01 0.00 0.00 37.83 33.30 1k93 s LYS 353 CO 0.50 0.65 0.09 0.43 0.51 0.00 0.00 175.35 177.53 1k93 n SER 354 N 2.10 -2.79 -4.43 2.83 7.64 -1.26 -4.33 113.62 113.37 1k93 n SER 354 Ca -0.15 0.60 -0.30 0.00 1.01 0.00 0.00 58.87 60.03 1k93 n SER 354 Cb 0.53 -1.00 -0.13 0.00 -1.01 0.00 0.00 64.21 62.61 1k93 n SER 354 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1k93 s SER 355 N -1.15 3.61 -0.08 6.43 0.15 -1.01 -2.57 113.70 119.09 1k93 s SER 355 Ca 0.60 -0.56 0.20 0.00 0.70 0.00 0.00 55.95 56.89 1k93 s SER 355 Cb -0.41 -0.46 0.43 0.00 -1.71 0.00 0.00 66.02 63.87 1k93 s SER 355 CO 0.64 0.22 1.19 -0.90 1.20 0.00 0.00 173.24 175.58 1k93 n ASP 356 N 1.27 1.31 -3.76 5.45 3.85 -1.26 -0.26 116.55 123.14 1k93 n ASP 356 Ca -0.16 -2.70 -0.08 0.00 -0.71 0.00 0.00 54.79 51.14 1k93 n ASP 356 Cb 0.52 -0.39 -0.02 0.00 -1.35 0.00 0.00 41.12 39.89 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 -1.27 -0.26 0.20 2.11 1.48 -1.26 -4.98 118.94 114.96 1k93 s TRP 357 Ca 0.35 -0.14 0.00 0.00 -1.06 0.00 0.00 56.10 55.26 1k93 s TRP 357 Cb 0.38 0.68 0.00 0.00 -1.16 0.00 0.00 33.47 33.37 1k93 s TRP 357 CO -0.13 -1.14 0.00 0.41 -4.06 0.00 0.00 176.95 172.03 1k93 n GLY 358 N -0.44 -1.48 0.21 3.67 0.00 -1.26 -2.97 105.19 102.91 1k93 n GLY 358 Ca -0.07 -1.06 -0.01 0.00 0.00 0.00 0.00 46.02 44.87 1k93 n GLY 358 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1k93 h PRO 359 N 0.00 0.25 0.00 1.61 0.11 -1.93 -2.09 132.00 129.94 1k93 h PRO 359 Ca 0.02 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1k93 h PRO 359 Cb 0.80 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1k93 h PRO 359 CO 0.01 0.16 0.00 1.55 -0.21 0.00 0.00 178.00 179.51 1k93 n VAL 360 N -5.11 0.28 -1.41 3.15 3.14 -1.26 -4.87 118.33 112.24 1k93 n VAL 360 Ca 0.07 0.07 -0.61 0.00 -2.96 0.00 0.00 64.34 60.91 1k93 n VAL 360 Cb 0.27 -0.86 -0.11 0.00 -1.06 0.00 0.00 33.84 32.08 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 -1.12 -0.49 0.00 1.55 0.00 -0.79 -0.75 120.51 118.91 1k93 n ALA 361 Ca 0.08 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1k93 n ALA 361 Cb 0.07 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 17.61 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 5.59 2.12 4.00 0.00 0.00 0.64 -4.81 105.19 112.73 1k93 n GLY 362 Ca 0.42 -0.17 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.90 2.37 -0.57 1.61 1.51 0.07 -4.07 117.35 116.37 1k93 s TYR 363 Ca 0.00 -0.27 -0.18 0.00 -1.01 0.00 0.00 57.07 55.61 1k93 s TYR 363 Cb 0.00 -2.63 0.10 0.00 -0.11 0.00 0.00 41.96 39.32 1k93 s TYR 363 CO 0.00 -0.98 0.65 0.42 -1.11 0.00 0.00 175.55 174.54 1k93 s ILE 364 N -2.72 4.89 0.49 2.71 -1.09 -1.22 -2.40 121.20 121.86 1k93 s ILE 364 Ca 0.59 -0.98 -0.24 0.00 -2.23 0.00 0.00 60.65 57.80 1k93 s ILE 364 Cb -0.09 -4.43 -0.07 0.00 -1.58 0.00 0.00 42.46 36.30 1k93 s ILE 364 CO 0.38 -1.02 1.38 -2.84 -1.23 0.00 0.00 174.94 171.61 1k93 s PRO 365 N 2.50 3.47 0.00 2.79 0.02 -1.26 -0.82 135.00 141.70 1k93 s PRO 365 Ca 0.11 2.30 -0.25 0.00 0.02 0.00 0.00 61.00 63.18 1k93 s PRO 365 Cb -0.24 -2.48 -0.18 0.00 0.02 0.00 0.00 34.50 31.62 1k93 s PRO 365 CO 0.07 -0.95 1.31 0.35 -0.33 0.00 0.00 177.00 177.45 1k93 h PHE 366 N 1.96 -0.13 -3.09 6.54 3.57 -1.08 -3.38 116.94 121.34 1k93 h PHE 366 Ca -0.51 -0.00 -0.55 0.00 3.53 0.00 0.00 57.97 60.44 1k93 h PHE 366 Cb 1.28 0.04 -0.07 0.00 2.79 0.00 0.00 35.95 39.99 1k93 h PHE 366 CO 0.49 0.24 0.99 0.34 -2.23 0.00 0.00 178.31 178.14 1k93 s ASP 367 N -5.42 6.41 0.00 0.41 2.15 -1.26 -4.68 116.67 114.28 1k93 s ASP 367 Ca -0.15 0.05 0.08 0.00 0.43 0.00 0.00 52.55 52.97 1k93 s ASP 367 Cb 0.02 -2.55 0.50 0.00 -0.30 0.00 0.00 42.92 40.59 1k93 s ASP 367 CO 0.62 -1.53 0.94 0.00 -0.17 0.00 0.00 175.17 175.04 1k93 n GLN 368 N 8.55 0.28 0.00 4.34 1.13 -1.26 -1.93 117.38 128.50 1k93 n GLN 368 Ca 0.08 0.00 0.15 0.00 -1.94 0.00 0.00 57.00 55.29 1k93 n GLN 368 Cb 0.49 -1.47 0.73 0.00 0.11 0.00 0.00 30.24 30.11 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 -0.97 0.04 -0.93 1.08 2.03 -1.26 -1.90 116.55 114.64 1k93 n ASP 369 Ca 0.06 -0.13 0.11 0.00 0.52 0.00 0.00 54.79 55.35 1k93 n ASP 369 Cb 0.03 -0.28 0.13 0.00 -0.72 0.00 0.00 41.12 40.28 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 -1.28 2.98 0.00 -2.67 4.77 -0.81 -4.25 117.00 115.75 1k93 n LEU 370 Ca 0.14 -1.18 -0.11 0.00 -0.03 0.00 0.00 56.01 54.83 1k93 n LEU 370 Cb 0.25 -0.08 0.06 0.00 -2.33 0.00 0.00 43.42 41.32 1k93 n LEU 370 CO 0.24 0.56 0.27 -1.54 -1.33 0.00 0.00 177.39 175.59 1k93 n SER 371 N 1.26 0.52 0.20 -1.43 3.41 -0.80 -4.72 113.62 112.06 1k93 n SER 371 Ca 0.14 -1.46 0.12 0.00 -0.26 0.00 0.00 58.87 57.41 1k93 n SER 371 Cb 0.55 -0.31 0.63 0.00 -0.26 0.00 0.00 64.21 64.82 1k93 n SER 371 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1k93 h LYS 372 N 0.00 0.00 -0.79 4.33 2.10 -1.75 -1.46 116.57 119.00 1k93 h LYS 372 Ca -0.15 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.40 1k93 h LYS 372 Cb 0.54 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.81 1k93 h LYS 372 CO 0.15 0.00 0.13 1.63 -2.00 0.00 0.00 179.45 179.36 1k93 n LYS 373 N -2.35 3.21 -1.29 0.07 4.76 -1.26 -4.95 118.16 116.34 1k93 n LYS 373 Ca -0.02 -2.16 -0.39 0.00 -2.87 0.00 0.00 58.31 52.87 1k93 n LYS 373 Cb 0.12 -1.98 0.02 0.00 -1.84 0.00 0.00 35.03 31.35 1k93 n LYS 373 CO 0.00 0.00 0.00 1.58 -1.37 0.00 0.00 177.40 177.61 1k93 n HIS 374 N 0.14 -2.49 -3.40 2.13 -0.00 -0.55 -4.21 115.22 106.84 1k93 n HIS 374 Ca 0.26 0.45 0.08 0.00 -0.00 0.00 0.00 57.72 58.50 1k93 n HIS 374 Cb 1.03 -1.74 -0.02 0.00 -0.00 0.00 0.00 29.99 29.26 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 2.37 -1.41 1.98 1.57 0.00 -1.26 -4.94 105.19 103.50 1k93 n GLY 375 Ca 0.09 -1.09 -0.05 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.76 -1.40 -0.34 1.61 6.02 -1.26 -4.70 117.38 114.54 1k93 n GLN 376 Ca 0.00 0.29 0.28 0.00 -0.01 0.00 0.00 57.00 57.56 1k93 n GLN 376 Cb 0.26 -3.26 0.45 0.00 1.02 0.00 0.00 30.24 28.71 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 -2.08 -0.02 -0.01 -1.09 7.27 -1.26 -0.73 117.38 119.47 1k93 n GLN 377 Ca -0.06 0.75 -0.08 0.00 0.07 0.00 0.00 57.00 57.68 1k93 n GLN 377 Cb 0.55 -1.55 -0.14 0.00 2.41 0.00 0.00 30.24 31.51 1k93 n GLN 377 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1k93 h LEU 378 N 0.00 0.00 -0.54 1.69 -0.00 -1.97 -3.30 115.31 111.21 1k93 h LEU 378 Ca 0.56 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.88 58.30 1k93 h LEU 378 Cb 1.95 -0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 42.59 1k93 h LEU 378 CO -0.20 1.01 -0.65 0.00 -0.00 0.00 0.00 178.44 178.59 1k93 h ALA 379 N 0.99 0.80 0.24 1.53 0.00 -1.26 -2.56 119.26 119.00 1k93 h ALA 379 Ca -0.25 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.06 1k93 h ALA 379 Cb 1.98 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.66 1k93 h ALA 379 CO 0.09 0.81 -0.15 0.28 0.00 0.00 0.00 179.25 180.28 1k93 h VAL 380 N 0.00 0.69 -0.32 0.00 2.07 -1.65 -0.64 116.25 116.41 1k93 h VAL 380 Ca -0.01 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1k93 h VAL 380 Cb 1.25 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 1k93 h VAL 380 CO 0.08 0.00 0.15 -0.33 0.02 0.00 0.00 177.57 177.50 1k93 h GLU 381 N -0.37 0.31 -0.46 1.57 5.08 -1.61 0.61 114.58 119.72 1k93 h GLU 381 Ca -0.02 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1k93 h GLU 381 Cb 0.31 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1k93 h GLU 381 CO 0.02 0.21 0.30 -0.22 -1.00 0.00 0.00 179.01 178.32 1k93 h LYS 382 N 0.32 0.59 -0.10 2.33 1.63 -1.35 -1.24 116.57 118.76 1k93 h LYS 382 Ca 0.13 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.86 1k93 h LYS 382 Cb 0.05 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 31.55 1k93 h LYS 382 CO -0.10 0.39 -0.08 0.78 -3.45 0.00 0.00 179.45 176.99 1k93 h GLY 383 N 0.61 0.25 0.61 5.01 0.00 0.03 -0.38 103.07 109.20 1k93 h GLY 383 Ca 0.17 -0.25 0.05 0.00 0.00 0.00 0.00 47.33 47.30 1k93 h GLY 383 CO -0.04 0.22 0.09 3.43 0.00 0.00 0.00 176.54 180.25 1k93 h ASN 384 N -0.18 0.06 0.37 0.19 2.35 0.53 -1.05 115.58 117.86 1k93 h ASN 384 Ca 0.02 0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.73 1k93 h ASN 384 Cb 0.59 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 1k93 h ASN 384 CO 0.02 0.07 -0.41 0.25 -1.65 0.00 0.00 177.43 175.71 1k93 h LEU 385 N 0.23 0.06 -1.10 1.61 5.85 -1.21 0.27 115.31 121.01 1k93 h LEU 385 Ca 0.17 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 1k93 h LEU 385 Cb 0.18 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1k93 h LEU 385 CO -0.20 0.46 -0.23 -0.33 -0.34 0.00 0.00 178.44 177.80 1k93 h GLU 386 N 0.05 0.00 0.00 1.25 4.39 -0.42 -2.25 114.58 117.60 1k93 h GLU 386 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 1k93 h GLU 386 Cb 0.75 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.40 1k93 h GLU 386 CO 0.06 0.23 -0.14 -0.91 -1.16 0.00 0.00 179.01 177.08 1k93 h ASN 387 N 0.00 0.00 -0.26 1.42 2.35 -0.06 -2.88 115.58 116.15 1k93 h ASN 387 Ca -0.00 -0.89 0.06 0.00 -0.55 0.00 0.00 56.30 54.92 1k93 h ASN 387 Cb 0.75 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 39.05 1k93 h ASN 387 CO 0.03 1.03 -0.31 0.11 -1.65 0.00 0.00 177.43 176.64 1k93 h LYS 388 N -1.00 -0.30 -0.65 0.81 1.57 -0.98 -0.05 116.57 115.97 1k93 h LYS 388 Ca -0.04 0.02 0.14 0.00 -1.87 0.00 0.00 60.65 58.90 1k93 h LYS 388 Cb 0.98 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 33.24 1k93 h LYS 388 CO -0.02 -0.20 -0.11 0.87 -0.57 0.00 0.00 179.45 179.42 1k93 h LYS 389 N -0.31 0.03 -0.75 3.15 1.57 -1.53 0.10 116.57 118.83 1k93 h LYS 389 Ca 0.13 -0.00 0.11 0.00 -1.87 0.00 0.00 60.65 59.03 1k93 h LYS 389 Cb 0.53 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.75 1k93 h LYS 389 CO -0.44 0.02 0.36 0.77 -0.57 0.00 0.00 179.45 179.60 1k93 h SER 390 N 0.03 0.44 -0.14 0.86 0.02 -0.82 0.63 113.55 114.58 1k93 h SER 390 Ca 0.33 0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 61.31 1k93 h SER 390 Cb 0.52 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.06 1k93 h SER 390 CO -0.64 0.23 -0.07 0.40 -1.14 0.00 0.00 176.83 175.60 1k93 h ILE 391 N 0.58 1.32 0.02 3.27 2.04 0.23 -2.91 117.51 122.05 1k93 h ILE 391 Ca 0.39 -1.12 -0.05 0.00 1.00 0.00 0.00 64.86 65.07 1k93 h ILE 391 Cb 0.48 1.77 0.01 0.00 -0.74 0.00 0.00 36.82 38.33 1k93 h ILE 391 CO -0.31 0.33 -0.22 0.71 0.00 0.00 0.00 178.15 178.65 1k93 h THR 392 N -0.05 1.62 0.00 -0.27 1.35 -0.55 -2.38 112.91 112.63 1k93 h THR 392 Ca 0.03 -2.11 0.00 0.00 -0.55 0.00 0.00 66.41 63.78 1k93 h THR 392 Cb 0.55 3.00 0.00 0.00 -1.73 0.00 0.00 68.15 69.97 1k93 h THR 392 CO 0.02 0.57 0.00 -0.62 -0.25 0.00 0.00 175.52 175.24 1k93 n GLU 393 N -4.51 0.01 -2.47 4.72 1.02 0.22 -3.14 120.64 116.49 1k93 n GLU 393 Ca -0.10 0.18 -0.05 0.00 -0.02 0.00 0.00 57.16 57.16 1k93 n GLU 393 Cb 0.52 -1.52 0.05 0.00 -0.02 0.00 0.00 31.44 30.46 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 -1.55 1.47 -1.53 -0.32 8.25 -1.10 -5.05 115.22 115.39 1k93 n HIS 394 Ca 0.05 -2.00 -0.48 0.00 -0.26 0.00 0.00 57.72 55.02 1k93 n HIS 394 Cb 0.23 -0.25 -0.03 0.00 1.12 0.00 0.00 29.99 31.06 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 -0.55 0.87 0.00 -0.41 4.07 -0.90 -0.16 120.64 123.56 1k93 n GLU 395 Ca 0.16 0.31 0.00 0.00 -0.06 0.00 0.00 57.16 57.57 1k93 n GLU 395 Cb 0.87 -1.65 0.00 0.00 -0.06 0.00 0.00 31.44 30.60 1k93 n GLU 395 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1k93 n GLY 396 N 1.73 2.73 0.13 8.31 0.00 -1.26 -4.65 105.19 112.18 1k93 n GLY 396 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 1k93 n GLY 396 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1k93 n GLU 397 N -0.62 0.65 -4.39 1.61 -0.58 0.78 -4.52 120.64 113.57 1k93 n GLU 397 Ca 0.00 0.26 -0.29 0.00 -0.42 0.00 0.00 57.16 56.72 1k93 n GLU 397 Cb 0.00 -1.60 -0.13 0.00 -0.57 0.00 0.00 31.44 29.15 1k93 n GLU 397 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1k93 s ILE 398 N -2.51 2.31 0.07 -3.67 -1.09 0.21 -1.31 121.20 115.21 1k93 s ILE 398 Ca -0.32 -1.81 -0.04 0.00 -2.23 0.00 0.00 60.65 56.25 1k93 s ILE 398 Cb 0.09 -2.04 0.02 0.00 -1.58 0.00 0.00 42.46 38.95 1k93 s ILE 398 CO 0.62 0.05 0.21 0.61 -1.23 0.00 0.00 174.94 175.20 1k93 n GLY 399 N 0.76 1.44 3.01 6.18 0.00 0.84 -4.62 105.19 112.80 1k93 n GLY 399 Ca -0.17 -1.02 -0.21 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.02 1.04 0.31 1.61 -2.85 -1.26 0.12 119.74 116.70 1k93 s LYS 400 Ca 0.05 -0.33 0.05 0.00 -1.00 0.00 0.00 55.97 54.73 1k93 s LYS 400 Cb -0.01 -0.96 -0.06 0.00 -2.06 0.00 0.00 37.83 34.74 1k93 s LYS 400 CO 0.02 0.12 0.02 0.96 0.10 0.00 0.00 175.35 176.57 1k93 s ILE 401 N 0.20 1.33 0.60 3.79 -4.36 -0.32 -4.86 121.20 117.58 1k93 s ILE 401 Ca -0.03 -2.03 -0.15 0.00 -0.26 0.00 0.00 60.65 58.18 1k93 s ILE 401 Cb -0.09 -2.68 -0.04 0.00 1.25 0.00 0.00 42.46 40.90 1k93 s ILE 401 CO 0.01 -0.10 1.04 -2.84 0.24 0.00 0.00 174.94 173.28 1k93 s PRO 402 N -3.84 3.38 -0.07 0.37 0.02 -1.26 -1.53 135.00 132.07 1k93 s PRO 402 Ca 0.34 1.09 -0.28 0.00 0.02 0.00 0.00 61.00 62.17 1k93 s PRO 402 Cb 0.07 -2.05 -0.02 0.00 0.02 0.00 0.00 34.50 32.52 1k93 s PRO 402 CO 0.14 -0.75 0.92 -1.17 -0.33 0.00 0.00 177.00 175.81 1k93 s LEU 403 N -4.65 4.30 -0.16 -5.54 2.96 -0.43 -4.81 118.68 110.36 1k93 s LEU 403 Ca 0.61 1.48 0.02 0.00 -0.22 0.00 0.00 54.13 56.02 1k93 s LEU 403 Cb -0.14 -3.44 0.01 0.00 0.50 0.00 0.00 46.19 43.12 1k93 s LEU 403 CO 0.40 -0.31 -0.20 -0.54 -1.32 0.00 0.00 176.35 174.38 1k93 s LYS 404 N 1.44 3.04 -0.40 1.98 1.02 -1.26 -1.39 119.74 124.16 1k93 s LYS 404 Ca 0.47 -0.83 -0.13 0.00 0.02 0.00 0.00 55.97 55.49 1k93 s LYS 404 Cb -0.19 -2.52 0.03 0.00 -0.52 0.00 0.00 37.83 34.63 1k93 s LYS 404 CO 0.21 -0.09 0.27 -0.51 -0.92 0.00 0.00 175.35 174.31 1k93 s LEU 405 N 1.01 5.00 0.00 3.17 1.43 -0.59 -4.99 118.68 123.71 1k93 s LEU 405 Ca -0.02 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 1k93 s LEU 405 Cb -0.15 -2.11 0.00 0.00 0.03 0.00 0.00 46.19 43.97 1k93 s LEU 405 CO -0.06 -0.44 0.00 -0.90 0.23 0.00 0.00 176.35 175.18 1k93 n ASP 406 N 5.09 -0.70 -0.03 2.29 5.75 -1.26 -4.83 116.55 122.86 1k93 n ASP 406 Ca -0.11 -0.27 -0.15 0.00 -0.01 0.00 0.00 54.79 54.25 1k93 n ASP 406 Cb 0.46 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.45 1k93 n ASP 406 CO 0.00 0.00 0.00 0.45 -0.11 0.00 0.00 177.20 177.54 1k93 h HIS 407 N -1.19 0.30 -0.53 2.11 3.86 -2.00 -3.28 115.15 114.42 1k93 h HIS 407 Ca 0.00 -0.14 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 1k93 h HIS 407 Cb 0.00 -0.04 -0.03 0.00 1.06 0.00 0.00 27.41 28.40 1k93 h HIS 407 CO 0.00 0.89 0.34 -0.07 0.86 0.00 0.00 177.93 179.95 1k93 h LEU 408 N -0.38 0.62 -1.77 2.43 3.38 -2.00 -2.65 115.31 114.93 1k93 h LEU 408 Ca -0.02 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1k93 h LEU 408 Cb 0.94 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 1k93 h LEU 408 CO 0.05 0.48 -0.16 -0.09 0.09 0.00 0.00 178.44 178.81 1k93 h ARG 409 N 0.72 0.00 -0.03 1.13 9.65 -1.95 -0.98 114.38 122.92 1k93 h ARG 409 Ca 0.19 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.92 1k93 h ARG 409 Cb -0.05 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.52 1k93 h ARG 409 CO -0.04 0.16 -0.67 0.82 2.80 0.00 0.00 179.97 183.04 1k93 h ILE 410 N 0.00 1.44 -0.09 1.20 1.08 -1.53 -0.12 117.51 119.49 1k93 h ILE 410 Ca -0.00 -2.20 -0.02 0.00 -0.39 0.00 0.00 64.86 62.24 1k93 h ILE 410 Cb 0.36 2.17 -0.00 0.00 -3.07 0.00 0.00 36.82 36.28 1k93 h ILE 410 CO 0.02 0.64 -0.04 -0.08 -0.69 0.00 0.00 178.15 178.00 1k93 h GLU 411 N 0.10 0.18 -0.60 2.37 4.57 -1.17 -1.14 114.58 118.89 1k93 h GLU 411 Ca -0.01 -0.08 0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1k93 h GLU 411 Cb 1.20 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.75 1k93 h GLU 411 CO 0.10 0.53 0.37 0.93 -1.18 0.00 0.00 179.01 179.76 1k93 h GLU 412 N -0.18 0.72 -0.03 1.92 5.08 -1.11 -1.82 114.58 119.17 1k93 h GLU 412 Ca 0.02 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1k93 h GLU 412 Cb 0.47 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1k93 h GLU 412 CO 0.01 0.48 -0.25 -0.07 -1.00 0.00 0.00 179.01 178.17 1k93 h LEU 413 N 0.74 0.05 -0.69 1.33 3.38 -0.91 -1.51 115.31 117.70 1k93 h LEU 413 Ca 0.24 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 1k93 h LEU 413 Cb 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1k93 h LEU 413 CO -0.09 0.31 -0.47 0.50 0.09 0.00 0.00 178.44 178.78 1k93 h LYS 414 N 0.05 0.00 0.12 1.13 3.64 -0.56 0.49 116.57 121.45 1k93 h LYS 414 Ca 0.01 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.10 1k93 h LYS 414 Cb 0.48 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1k93 h LYS 414 CO 0.03 0.47 -1.23 1.49 -2.27 0.00 0.00 179.45 177.94 1k93 h GLU 415 N 0.00 0.44 0.00 1.90 4.57 -0.48 -2.09 114.58 118.92 1k93 h GLU 415 Ca -0.00 -0.64 0.00 0.00 -1.18 0.00 0.00 59.36 57.53 1k93 h GLU 415 Cb 1.06 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.88 1k93 h GLU 415 CO 0.06 1.28 0.00 0.09 -1.18 0.00 0.00 179.01 179.26 1k93 n ASN 416 N -3.68 0.00 -2.96 1.04 5.03 -0.90 -4.86 115.26 108.93 1k93 n ASN 416 Ca -0.11 -1.50 -0.22 0.00 0.87 0.00 0.00 54.58 53.63 1k93 n ASN 416 Cb 0.99 0.00 0.02 0.00 -1.02 0.00 0.00 39.78 39.77 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 0.63 -0.51 0.13 7.41 0.00 -0.78 -4.91 105.19 107.15 1k93 n GLY 417 Ca 0.09 0.10 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 1k93 n GLY 417 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1k93 h ILE 418 N -1.00 1.09 -3.37 -0.61 1.08 -0.25 -3.48 117.51 110.96 1k93 h ILE 418 Ca -0.49 -2.67 -0.06 0.00 -0.39 0.00 0.00 64.86 61.25 1k93 h ILE 418 Cb 1.34 2.81 -0.14 0.00 -3.07 0.00 0.00 36.82 37.76 1k93 h ILE 418 CO 0.55 0.84 -0.12 0.27 -0.69 0.00 0.00 178.15 178.99 1k93 s ILE 419 N -2.60 0.08 -0.10 -0.67 -5.25 -1.19 -4.38 121.20 107.08 1k93 s ILE 419 Ca -0.12 -0.63 -0.01 0.00 -0.99 0.00 0.00 60.65 58.91 1k93 s ILE 419 Cb 0.06 -1.14 0.03 0.00 2.95 0.00 0.00 42.46 44.36 1k93 s ILE 419 CO 0.87 -0.35 -0.05 -0.76 -1.79 0.00 0.00 174.94 172.86 1k93 s LEU 420 N -2.63 1.01 0.01 0.37 1.43 -1.17 -3.92 118.68 113.79 1k93 s LEU 420 Ca 0.01 -0.25 -0.30 0.00 -1.03 0.00 0.00 54.13 52.56 1k93 s LEU 420 Cb 0.02 -0.72 -0.07 0.00 0.03 0.00 0.00 46.19 45.45 1k93 s LEU 420 CO -0.10 -0.15 1.66 -0.75 0.23 0.00 0.00 176.35 177.25 1k93 s LYS 421 N 1.79 4.19 0.00 1.70 2.20 -1.26 -0.79 119.74 127.57 1k93 s LYS 421 Ca 0.05 2.26 0.00 0.00 -0.36 0.00 0.00 55.97 57.92 1k93 s LYS 421 Cb -0.13 -3.81 0.00 0.00 -1.51 0.00 0.00 37.83 32.38 1k93 s LYS 421 CO -0.07 -0.79 0.00 0.41 -0.36 0.00 0.00 175.35 174.54 1k93 n GLY 422 N 4.07 3.24 3.55 5.54 0.00 0.94 -4.96 105.19 117.57 1k93 n GLY 422 Ca 0.17 -0.58 -0.45 0.00 0.00 0.00 0.00 46.02 45.15 1k93 n GLY 422 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1k93 n LYS 423 N 0.00 1.06 -1.70 1.61 4.81 -1.26 -4.39 118.16 118.29 1k93 n LYS 423 Ca 0.00 0.37 -0.29 0.00 -0.87 0.00 0.00 58.31 57.52 1k93 n LYS 423 Cb 0.00 -1.66 0.10 0.00 0.02 0.00 0.00 35.03 33.49 1k93 n LYS 423 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1k93 s LYS 424 N -1.42 1.87 -0.29 1.64 1.02 -1.26 -1.67 119.74 119.64 1k93 s LYS 424 Ca 0.60 0.35 -0.23 0.00 0.02 0.00 0.00 55.97 56.71 1k93 s LYS 424 Cb -0.75 -1.92 0.14 0.00 -0.52 0.00 0.00 37.83 34.78 1k93 s LYS 424 CO 0.59 -1.71 1.09 -2.00 -0.92 0.00 0.00 175.35 172.40 1k93 s GLU 425 N -5.34 0.40 -0.02 1.68 2.12 -0.56 -4.85 118.70 112.14 1k93 s GLU 425 Ca 0.62 0.52 0.08 0.00 0.36 0.00 0.00 54.97 56.55 1k93 s GLU 425 Cb -0.13 0.17 -0.02 0.00 0.26 0.00 0.00 34.13 34.41 1k93 s GLU 425 CO 0.52 -0.06 -0.25 0.42 -0.54 0.00 0.00 175.26 175.35 1k93 s ILE 426 N 0.44 2.00 0.00 -3.70 1.01 -1.25 -0.02 121.20 119.67 1k93 s ILE 426 Ca 0.01 -1.09 0.00 0.00 0.00 0.00 0.00 60.65 59.57 1k93 s ILE 426 Cb -0.05 -1.66 0.00 0.00 0.01 0.00 0.00 42.46 40.77 1k93 s ILE 426 CO -0.09 0.55 0.00 -0.67 0.00 0.00 0.00 174.94 174.73 1k93 n ASP 427 N 2.43 0.00 -2.33 3.58 -0.08 -0.11 -4.81 116.55 115.24 1k93 n ASP 427 Ca -0.16 0.00 -0.25 0.00 -1.51 0.00 0.00 54.79 52.87 1k93 n ASP 427 Cb 0.51 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.96 1k93 n ASP 427 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1k93 n ASN 428 N -0.72 6.61 -1.54 1.67 4.13 -1.26 -4.55 115.26 119.59 1k93 n ASN 428 Ca 0.00 -3.24 -0.10 0.00 1.68 0.00 0.00 54.58 52.92 1k93 n ASN 428 Cb 0.00 -1.16 0.02 0.00 -1.54 0.00 0.00 39.78 37.10 1k93 n ASN 428 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1k93 n GLY 429 N 0.53 0.12 3.14 7.41 0.00 -1.26 -5.03 105.19 110.10 1k93 n GLY 429 Ca 0.45 -0.36 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 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 -5.08 0.97 -0.19 1.61 1.02 -1.26 -5.13 119.74 111.69 1k93 s LYS 430 Ca 0.14 -0.72 -0.17 0.00 0.02 0.00 0.00 55.97 55.24 1k93 s LYS 430 Cb -0.06 -0.98 -0.04 0.00 -0.52 0.00 0.00 37.83 36.23 1k93 s LYS 430 CO 0.18 0.25 0.46 0.15 -0.92 0.00 0.00 175.35 175.47 1k93 s LYS 431 N -1.00 4.21 0.28 1.68 1.02 -1.26 -0.93 119.74 123.74 1k93 s LYS 431 Ca 0.02 0.34 0.02 0.00 0.02 0.00 0.00 55.97 56.37 1k93 s LYS 431 Cb -0.07 -3.53 -0.05 0.00 -0.52 0.00 0.00 37.83 33.66 1k93 s LYS 431 CO 0.01 -0.05 0.11 0.71 -0.92 0.00 0.00 175.35 175.21 1k93 s TYR 432 N 1.33 1.61 0.01 3.18 1.51 0.97 -1.05 117.35 124.91 1k93 s TYR 432 Ca 0.22 -1.21 0.04 0.00 -1.01 0.00 0.00 57.07 55.11 1k93 s TYR 432 Cb -0.15 -0.94 -0.01 0.00 -0.11 0.00 0.00 41.96 40.74 1k93 s TYR 432 CO 0.09 -0.34 -0.12 0.71 -1.11 0.00 0.00 175.55 174.78 1k93 s TYR 433 N -3.65 1.04 -0.20 2.71 1.51 -0.22 -1.49 117.35 117.04 1k93 s TYR 433 Ca 0.36 -0.25 -0.23 0.00 -1.01 0.00 0.00 57.07 55.94 1k93 s TYR 433 Cb 0.07 -0.65 -0.02 0.00 -0.11 0.00 0.00 41.96 41.25 1k93 s TYR 433 CO 0.15 -0.01 0.76 -0.51 -1.11 0.00 0.00 175.55 174.83 1k93 s LEU 434 N -0.55 4.13 -0.28 -1.29 1.02 -0.67 -0.78 118.68 120.26 1k93 s LEU 434 Ca 0.03 1.00 -0.19 0.00 0.02 0.00 0.00 54.13 54.99 1k93 s LEU 434 Cb -0.05 -3.09 -0.02 0.00 0.02 0.00 0.00 46.19 43.04 1k93 s LEU 434 CO 0.00 -0.39 0.58 -0.76 0.02 0.00 0.00 176.35 175.79 1k93 s LEU 435 N 2.30 4.09 0.67 1.79 1.43 -1.16 -0.04 118.68 127.76 1k93 s LEU 435 Ca 0.34 0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 53.88 1k93 s LEU 435 Cb -0.16 -2.75 0.04 0.00 0.03 0.00 0.00 46.19 43.35 1k93 s LEU 435 CO 0.10 -0.37 0.99 -1.61 0.23 0.00 0.00 176.35 175.68 1k93 s GLU 436 N 2.45 2.46 -0.04 1.70 0.41 0.03 -3.95 118.70 121.76 1k93 s GLU 436 Ca 0.23 -0.13 -0.30 0.00 -0.41 0.00 0.00 54.97 54.36 1k93 s GLU 436 Cb -0.15 -2.19 0.11 0.00 -1.78 0.00 0.00 34.13 30.12 1k93 s GLU 436 CO 0.10 -1.06 1.06 0.45 -0.49 0.00 0.00 175.26 175.32 1k93 s SER 437 N -4.44 -0.21 -0.40 -0.19 0.15 -1.26 -3.02 113.70 104.32 1k93 s SER 437 Ca 0.58 -0.09 0.02 0.00 0.70 0.00 0.00 55.95 57.16 1k93 s SER 437 Cb -0.11 0.29 0.52 0.00 -1.71 0.00 0.00 66.02 65.01 1k93 s SER 437 CO 0.45 -0.50 1.80 -0.46 1.20 0.00 0.00 173.24 175.73 1k93 n ASN 438 N -0.28 4.23 -4.78 5.45 6.94 -1.26 -4.86 115.26 120.72 1k93 n ASN 438 Ca -0.05 -3.35 -0.36 0.00 -0.02 0.00 0.00 54.58 50.80 1k93 n ASN 438 Cb 0.61 -0.82 -0.07 0.00 -2.36 0.00 0.00 39.78 37.14 1k93 n ASN 438 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1k93 s ASN 439 N -0.91 6.32 -0.74 0.53 3.84 -1.26 -5.00 114.94 117.72 1k93 s ASN 439 Ca 0.48 0.38 0.03 0.00 0.21 0.00 0.00 52.86 53.95 1k93 s ASN 439 Cb 0.39 -2.11 0.33 0.00 -0.55 0.00 0.00 41.25 39.32 1k93 s ASN 439 CO 0.07 0.24 1.27 0.00 -2.79 0.00 0.00 177.10 175.89 1k93 n GLN 440 N 3.03 4.05 0.00 0.43 0.00 -1.26 -4.47 117.38 119.15 1k93 n GLN 440 Ca -0.16 -4.79 0.00 0.00 0.00 0.00 0.00 57.00 52.05 1k93 n GLN 440 Cb 0.53 -2.32 0.00 0.00 0.00 0.00 0.00 30.24 28.44 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 -0.18 0.00 -4.35 -0.39 0.31 -1.26 -4.96 118.33 107.49 1k93 n VAL 441 Ca 0.37 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.42 1k93 n VAL 441 Cb 0.34 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.16 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 -1.00 2.45 0.00 3.52 1.51 -1.26 -1.15 117.35 121.42 1k93 s TYR 442 Ca 0.00 -0.30 0.08 0.00 -1.01 0.00 0.00 57.07 55.83 1k93 s TYR 442 Cb 0.00 -1.25 -0.02 0.00 -0.11 0.00 0.00 41.96 40.58 1k93 s TYR 442 CO 0.00 0.44 -0.23 -2.00 -1.11 0.00 0.00 175.55 172.65 1k93 s GLU 443 N -2.46 1.79 0.34 -0.62 2.12 -0.48 -4.82 118.70 114.58 1k93 s GLU 443 Ca 0.20 -0.91 0.06 0.00 0.36 0.00 0.00 54.97 54.68 1k93 s GLU 443 Cb -0.09 -1.81 -0.07 0.00 0.26 0.00 0.00 34.13 32.42 1k93 s GLU 443 CO 0.10 0.48 0.02 -0.06 -0.54 0.00 0.00 175.26 175.27 1k93 s PHE 444 N -0.64 2.16 -0.22 5.30 0.40 -1.25 -2.21 117.98 121.52 1k93 s PHE 444 Ca 0.09 -0.80 -0.29 0.00 -0.60 0.00 0.00 56.93 55.33 1k93 s PHE 444 Cb -0.09 -1.42 0.16 0.00 0.51 0.00 0.00 43.02 42.18 1k93 s PHE 444 CO 0.00 0.22 1.16 -0.98 0.70 0.00 0.00 175.22 176.32 1k93 s ARG 445 N -3.79 0.36 -0.01 0.44 1.70 -1.12 -3.00 118.95 113.53 1k93 s ARG 445 Ca 0.35 0.12 0.08 0.00 -0.47 0.00 0.00 55.73 55.80 1k93 s ARG 445 Cb 0.08 0.17 -0.02 0.00 -0.57 0.00 0.00 34.95 34.61 1k93 s ARG 445 CO 0.16 -0.11 -0.25 -1.50 -1.08 0.00 0.00 175.30 172.52 1k93 s ILE 446 N -0.94 1.97 -0.17 4.99 2.07 0.04 0.27 121.20 129.41 1k93 s ILE 446 Ca 0.03 -1.11 -0.29 0.00 -1.41 0.00 0.00 60.65 57.87 1k93 s ILE 446 Cb -0.01 -1.64 -0.00 0.00 0.13 0.00 0.00 42.46 40.93 1k93 s ILE 446 CO -0.03 0.52 1.08 -0.55 -1.91 0.00 0.00 174.94 174.04 1k93 s SER 447 N -0.69 7.11 0.61 4.50 0.15 0.14 -1.06 113.70 124.47 1k93 s SER 447 Ca 0.10 1.50 0.33 0.00 0.70 0.00 0.00 55.95 58.58 1k93 s SER 447 Cb -0.10 -2.55 1.91 0.00 -1.71 0.00 0.00 66.02 63.58 1k93 s SER 447 CO -0.00 -0.62 2.23 -0.78 1.20 0.00 0.00 173.24 175.27 1k93 h ASP 448 N 7.46 0.00 0.00 5.45 3.58 -1.42 0.41 116.42 131.91 1k93 h ASP 448 Ca -0.25 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.20 1k93 h ASP 448 Cb 1.10 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.15 1k93 h ASP 448 CO 0.94 0.00 0.00 -0.62 -2.88 0.00 0.00 179.24 176.68 1k93 n GLU 449 N -3.64 0.00 0.00 0.28 -0.58 -1.26 -4.54 120.64 110.90 1k93 n GLU 449 Ca -0.02 0.41 0.11 0.00 -0.42 0.00 0.00 57.16 57.25 1k93 n GLU 449 Cb 0.15 -1.08 0.06 0.00 -0.57 0.00 0.00 31.44 30.00 1k93 n GLU 449 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1k93 n ASN 450 N -1.74 1.66 -0.03 1.62 0.23 -1.21 -4.97 115.26 110.81 1k93 n ASN 450 Ca 0.00 -1.29 -0.00 0.00 -0.53 0.00 0.00 54.58 52.75 1k93 n ASN 450 Cb 0.00 0.47 -0.00 0.00 -2.08 0.00 0.00 39.78 38.17 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 -0.37 -3.11 -4.77 0.53 5.03 0.14 -4.87 115.26 107.85 1k93 n ASN 451 Ca 0.09 0.01 -0.39 0.00 0.87 0.00 0.00 54.58 55.16 1k93 n ASN 451 Cb 0.42 -0.63 -0.03 0.00 -1.02 0.00 0.00 39.78 38.52 1k93 n ASN 451 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1k93 s GLU 452 N -0.91 4.33 -0.09 3.52 2.02 -1.26 -1.54 118.70 124.77 1k93 s GLU 452 Ca 0.00 1.84 -0.10 0.00 0.02 0.00 0.00 54.97 56.74 1k93 s GLU 452 Cb 0.00 -2.91 -0.05 0.00 0.10 0.00 0.00 34.13 31.28 1k93 s GLU 452 CO 0.00 -0.08 0.22 0.08 0.02 0.00 0.00 175.26 175.50 1k93 s VAL 453 N -1.31 5.36 0.48 2.63 1.01 -0.49 -0.68 120.40 127.40 1k93 s VAL 453 Ca 0.51 0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.92 1k93 s VAL 453 Cb -0.31 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 1k93 s VAL 453 CO 0.40 0.60 0.03 -1.10 0.00 0.00 0.00 175.10 175.03 1k93 s GLN 454 N -0.97 2.11 -0.07 2.72 -0.21 0.14 -1.97 119.66 121.41 1k93 s GLN 454 Ca 0.17 -2.32 -0.30 0.00 0.02 0.00 0.00 55.36 52.93 1k93 s GLN 454 Cb -0.13 -1.33 0.11 0.00 1.00 0.00 0.00 33.01 32.66 1k93 s GLN 454 CO 0.07 -0.35 0.97 1.52 -2.12 0.00 0.00 175.29 175.37 1k93 s TYR 455 N -2.94 -0.31 0.27 0.91 -0.85 0.13 -2.81 117.35 111.75 1k93 s TYR 455 Ca 0.13 0.28 -0.14 0.00 -0.52 0.00 0.00 57.07 56.83 1k93 s TYR 455 Cb 0.03 0.51 0.00 0.00 0.38 0.00 0.00 41.96 42.88 1k93 s TYR 455 CO 0.07 -0.44 0.54 -1.59 -1.52 0.00 0.00 175.55 172.61 1k93 s LYS 456 N -2.53 1.66 0.26 -3.49 -2.85 -0.94 -1.58 119.74 110.27 1k93 s LYS 456 Ca 0.04 -1.26 -0.23 0.00 -1.00 0.00 0.00 55.97 53.52 1k93 s LYS 456 Cb -0.01 0.50 -0.09 0.00 -2.06 0.00 0.00 37.83 36.17 1k93 s LYS 456 CO -0.06 -0.71 0.83 0.95 0.10 0.00 0.00 175.35 176.47 1k93 s THR 457 N -3.83 4.38 0.19 3.79 -4.23 -0.60 -1.38 115.64 113.96 1k93 s THR 457 Ca 0.21 1.58 -0.03 0.00 -1.18 0.00 0.00 61.69 62.26 1k93 s THR 457 Cb -0.02 -3.96 0.05 0.00 1.34 0.00 0.00 72.50 69.91 1k93 s THR 457 CO 0.10 0.21 0.18 0.29 -0.54 0.00 0.00 174.62 174.86 1k93 n LYS 458 N 0.73 -1.18 -1.68 3.99 5.02 -0.30 -4.80 118.16 119.93 1k93 n LYS 458 Ca -0.01 -0.29 -0.45 0.00 -2.02 0.00 0.00 58.31 55.54 1k93 n LYS 458 Cb 0.50 -0.26 -0.04 0.00 -0.02 0.00 0.00 35.03 35.22 1k93 n LYS 458 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1k93 n GLU 459 N -1.96 2.37 -0.10 1.97 1.02 -1.26 -2.85 120.64 119.83 1k93 n GLU 459 Ca 0.03 0.86 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 1k93 n GLU 459 Cb 0.10 -2.67 0.00 0.00 -0.02 0.00 0.00 31.44 28.84 1k93 n GLU 459 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1k93 n GLY 460 N 3.77 0.00 3.83 0.62 0.00 -1.26 -4.87 105.19 107.28 1k93 n GLY 460 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1k93 n GLY 460 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1k93 s LYS 461 N -0.21 3.33 0.05 1.61 2.47 -1.13 -5.07 119.74 120.79 1k93 s LYS 461 Ca 0.00 0.98 0.03 0.00 -1.56 0.00 0.00 55.97 55.42 1k93 s LYS 461 Cb 0.00 -2.04 -0.02 0.00 -1.46 0.00 0.00 37.83 34.30 1k93 s LYS 461 CO 0.00 -0.79 -0.09 0.42 0.16 0.00 0.00 175.35 175.05 1k93 s ILE 462 N -2.85 0.66 0.98 5.43 1.01 -1.26 -4.63 121.20 120.54 1k93 s ILE 462 Ca 0.59 -1.11 -0.17 0.00 0.00 0.00 0.00 60.65 59.97 1k93 s ILE 462 Cb -0.13 -0.70 0.23 0.00 0.01 0.00 0.00 42.46 41.87 1k93 s ILE 462 CO 0.46 -0.34 1.25 0.35 0.00 0.00 0.00 174.94 176.66 1k93 n THR 463 N 1.46 0.00 -0.03 2.92 -2.24 -1.18 -4.91 114.28 110.29 1k93 n THR 463 Ca -0.22 -0.87 -0.15 0.00 -2.27 0.00 0.00 64.05 60.53 1k93 n THR 463 Cb 0.55 -1.49 -0.09 0.00 -2.10 0.00 0.00 70.33 67.20 1k93 n THR 463 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1k93 h VAL 464 N -1.88 1.39 0.00 2.28 -1.51 -1.96 -2.86 116.25 111.70 1k93 h VAL 464 Ca -0.41 -1.75 0.00 0.00 -1.23 0.00 0.00 66.70 63.31 1k93 h VAL 464 Cb 1.15 2.21 0.00 0.00 -2.13 0.00 0.00 31.29 32.52 1k93 h VAL 464 CO 0.29 0.52 0.00 0.18 -1.23 0.00 0.00 177.57 177.32 1k93 n LEU 465 N -4.33 0.08 -2.25 4.19 4.77 -1.26 -4.77 117.00 113.43 1k93 n LEU 465 Ca -0.08 -0.04 -0.11 0.00 -0.03 0.00 0.00 56.01 55.75 1k93 n LEU 465 Cb 0.54 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.64 1k93 n LEU 465 CO 0.44 0.02 0.10 0.61 -1.33 0.00 0.00 177.39 177.23 1k93 n GLY 466 N 0.00 0.08 1.92 -0.72 0.00 -1.08 -5.04 105.19 100.35 1k93 n GLY 466 Ca 0.00 -0.17 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 1k93 n GLY 466 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1k93 n GLU 467 N -2.84 1.11 -3.63 1.61 1.02 -1.26 -4.89 120.64 111.77 1k93 n GLU 467 Ca -0.07 -1.76 -0.12 0.00 -0.02 0.00 0.00 57.16 55.19 1k93 n GLU 467 Cb 0.56 0.22 -0.07 0.00 -0.02 0.00 0.00 31.44 32.13 1k93 n GLU 467 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1k93 s LYS 468 N -3.12 0.67 -0.01 3.49 2.20 -1.26 -3.09 119.74 118.62 1k93 s LYS 468 Ca 0.14 0.75 -0.30 0.00 -0.36 0.00 0.00 55.97 56.19 1k93 s LYS 468 Cb -0.01 0.33 0.11 0.00 -1.51 0.00 0.00 37.83 36.74 1k93 s LYS 468 CO 0.09 -0.09 1.17 -0.59 -0.36 0.00 0.00 175.35 175.57 1k93 s PHE 469 N 0.20 -0.10 0.00 4.03 -0.12 -1.26 -5.00 117.98 115.73 1k93 s PHE 469 Ca 0.01 -0.04 0.00 0.00 -0.05 0.00 0.00 56.93 56.85 1k93 s PHE 469 Cb -0.05 0.56 0.00 0.00 -0.63 0.00 0.00 43.02 42.90 1k93 s PHE 469 CO -0.02 -0.40 0.00 -1.71 -0.05 0.00 0.00 175.22 173.04 1k93 n ASN 470 N -0.39 0.00 -4.68 1.98 5.15 -1.26 -1.55 115.26 114.50 1k93 n ASN 470 Ca -0.06 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.49 1k93 n ASN 470 Cb 0.61 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.84 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 4.51 3.48 0.14 1.20 0.52 -1.26 -3.81 118.94 123.71 1k93 s TRP 471 Ca 0.00 1.56 0.04 0.00 0.02 0.00 0.00 56.10 57.72 1k93 s TRP 471 Cb 0.00 -3.20 -0.04 0.00 -1.15 0.00 0.00 33.47 29.07 1k93 s TRP 471 CO 0.00 -0.28 -0.09 1.03 0.02 0.00 0.00 176.95 177.64 1k93 s ARG 472 N 2.26 1.02 0.40 4.98 0.52 -0.61 -4.88 118.95 122.63 1k93 s ARG 472 Ca 0.47 -1.43 -0.22 0.00 -0.52 0.00 0.00 55.73 54.03 1k93 s ARG 472 Cb -0.18 -0.51 -0.11 0.00 0.52 0.00 0.00 34.95 34.68 1k93 s ARG 472 CO 0.15 0.04 0.95 -0.80 0.02 0.00 0.00 175.30 175.66 1k93 s ASN 473 N -3.14 7.04 -0.57 0.23 0.01 -1.26 0.21 114.94 117.45 1k93 s ASN 473 Ca 0.16 1.73 -0.20 0.00 -0.71 0.00 0.00 52.86 53.84 1k93 s ASN 473 Cb 0.03 -2.55 0.08 0.00 0.41 0.00 0.00 41.25 39.22 1k93 s ASN 473 CO -0.00 -0.29 0.73 -0.63 -1.51 0.00 0.00 177.10 175.40 1k93 s ILE 474 N -2.03 4.74 0.36 0.60 1.01 -0.83 -4.84 121.20 120.21 1k93 s ILE 474 Ca 0.59 -0.65 -0.25 0.00 0.00 0.00 0.00 60.65 60.34 1k93 s ILE 474 Cb -0.12 -4.46 -0.10 0.00 0.01 0.00 0.00 42.46 37.80 1k93 s ILE 474 CO 0.16 -1.06 0.97 -1.61 0.00 0.00 0.00 174.94 173.40 1k93 s GLU 475 N 2.95 4.42 0.03 2.79 2.02 -1.26 -1.31 118.70 128.34 1k93 s GLU 475 Ca 0.15 1.34 0.06 0.00 0.02 0.00 0.00 54.97 56.54 1k93 s GLU 475 Cb -0.21 -2.62 -0.02 0.00 0.10 0.00 0.00 34.13 31.38 1k93 s GLU 475 CO 0.10 0.12 -0.18 0.08 0.02 0.00 0.00 175.26 175.39 1k93 s VAL 476 N -1.73 1.44 0.41 2.63 1.01 -0.59 -0.45 120.40 123.12 1k93 s VAL 476 Ca 0.54 -1.06 -0.26 0.00 0.00 0.00 0.00 61.98 61.21 1k93 s VAL 476 Cb -0.18 -1.26 -0.09 0.00 0.00 0.00 0.00 36.38 34.86 1k93 s VAL 476 CO 0.23 0.17 1.30 -0.04 0.00 0.00 0.00 175.10 176.76 1k93 s MET 477 N -1.04 3.94 0.10 2.72 -1.94 -0.00 -1.18 119.30 121.89 1k93 s MET 477 Ca 0.05 2.15 -0.17 0.00 -1.71 0.00 0.00 55.69 56.02 1k93 s MET 477 Cb -0.08 -2.73 0.04 0.00 2.01 0.00 0.00 34.83 34.06 1k93 s MET 477 CO 0.01 -0.52 0.41 0.00 -0.01 0.00 0.00 175.02 174.92 1k93 s ALA 478 N -1.27 -0.98 0.02 3.03 0.00 0.33 -2.24 121.76 120.65 1k93 s ALA 478 Ca 0.57 0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.66 1k93 s ALA 478 Cb -0.38 0.59 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 1k93 s ALA 478 CO 0.49 -0.59 -0.05 -1.59 0.00 0.00 0.00 175.76 174.02 1k93 s LYS 479 N -3.38 2.55 -0.31 0.00 -2.85 0.12 -0.11 119.74 115.77 1k93 s LYS 479 Ca 0.00 -0.75 -0.29 0.00 -1.00 0.00 0.00 55.97 53.94 1k93 s LYS 479 Cb 0.01 -2.52 -0.00 0.00 -2.06 0.00 0.00 37.83 33.26 1k93 s LYS 479 CO -0.09 0.59 1.42 1.21 0.10 0.00 0.00 175.35 178.58 1k93 s ASN 480 N -1.63 6.50 -0.24 0.03 2.47 -0.43 0.22 114.94 121.87 1k93 s ASN 480 Ca 0.19 1.23 0.02 0.00 0.42 0.00 0.00 52.86 54.72 1k93 s ASN 480 Cb -0.11 -2.54 0.05 0.00 -1.45 0.00 0.00 41.25 37.20 1k93 s ASN 480 CO 0.10 -1.22 -0.10 -0.69 -3.72 0.00 0.00 177.10 171.46 1k93 s VAL 481 N 4.90 1.93 -1.29 -5.21 1.01 0.85 -4.74 120.40 117.85 1k93 s VAL 481 Ca 0.62 -1.40 -0.16 0.00 0.00 0.00 0.00 61.98 61.04 1k93 s VAL 481 Cb -0.18 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.16 1k93 s VAL 481 CO 0.27 0.03 0.55 -0.62 0.00 0.00 0.00 175.10 175.33 1k93 n GLU 482 N 4.54 -1.47 0.00 2.72 1.02 -1.26 -0.85 120.64 125.34 1k93 n GLU 482 Ca -0.14 0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1k93 n GLU 482 Cb 0.44 -3.71 0.00 0.00 -0.02 0.00 0.00 31.44 28.15 1k93 n GLU 482 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1k93 n GLY 483 N -2.01 2.93 3.56 0.62 0.00 -1.26 -4.98 105.19 104.05 1k93 n GLY 483 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 1k93 n GLY 483 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k93 s VAL 484 N -0.91 4.14 -0.04 1.61 1.01 -0.03 -5.06 120.40 121.11 1k93 s VAL 484 Ca 0.00 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1k93 s VAL 484 Cb 0.00 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1k93 s VAL 484 CO 0.00 0.51 1.26 -0.76 0.00 0.00 0.00 175.10 176.11 1k93 s LEU 485 N 0.10 4.29 0.01 3.92 1.02 -1.26 -0.10 118.68 126.65 1k93 s LEU 485 Ca 0.01 1.89 0.06 0.00 0.02 0.00 0.00 54.13 56.12 1k93 s LEU 485 Cb -0.13 -3.56 -0.03 0.00 0.02 0.00 0.00 46.19 42.49 1k93 s LEU 485 CO 0.02 -0.63 -0.18 -0.54 0.02 0.00 0.00 176.35 175.04 1k93 s LYS 486 N 2.30 2.16 0.49 1.70 -0.14 0.13 -4.89 119.74 121.49 1k93 s LYS 486 Ca 0.58 -0.92 -0.21 0.00 -1.36 0.00 0.00 55.97 54.06 1k93 s LYS 486 Cb -0.26 -2.21 -0.08 0.00 -1.68 0.00 0.00 37.83 33.61 1k93 s LYS 486 CO 0.23 0.56 1.08 -1.25 -0.76 0.00 0.00 175.35 175.21 1k93 s PRO 487 N -1.19 3.70 0.18 -1.68 0.04 -1.26 0.16 135.00 134.95 1k93 s PRO 487 Ca 0.13 1.51 0.05 0.00 0.04 0.00 0.00 61.00 62.73 1k93 s PRO 487 Cb -0.10 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1k93 s PRO 487 CO 0.03 -0.54 0.20 -0.51 0.04 0.00 0.00 177.00 176.22 1k93 s LEU 488 N -3.41 3.98 0.00 -3.56 1.43 -0.95 -3.48 118.68 112.69 1k93 s LEU 488 Ca 0.67 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.72 1k93 s LEU 488 Cb -0.21 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.44 1k93 s LEU 488 CO 0.25 0.04 0.00 0.41 0.23 0.00 0.00 176.35 177.28 1k93 n THR 489 N -0.57 0.00 -2.38 5.49 -1.04 0.91 -3.37 114.28 113.32 1k93 n THR 489 Ca -0.08 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.63 1k93 n THR 489 Cb 0.55 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.05 1k93 n THR 489 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1k93 s ALA 490 N -2.00 3.20 0.00 2.41 0.00 -1.26 -1.39 121.76 122.72 1k93 s ALA 490 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.85 1k93 s ALA 490 Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1k93 s ALA 490 CO 0.00 -0.35 0.00 -0.40 0.00 0.00 0.00 175.76 175.01 1k93 n ASP 491 N -2.00 0.77 -4.36 0.00 5.75 -1.26 -4.57 116.55 110.88 1k93 n ASP 491 Ca 0.04 -0.06 -0.37 0.00 -0.01 0.00 0.00 54.79 54.39 1k93 n ASP 491 Cb 0.54 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.51 1k93 n ASP 491 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1k93 s TYR 492 N 1.54 3.14 -0.26 2.11 2.02 -0.49 -4.93 117.35 120.49 1k93 s TYR 492 Ca 0.00 -0.89 -0.13 0.00 -0.37 0.00 0.00 57.07 55.68 1k93 s TYR 492 Cb 0.00 -2.26 -0.04 0.00 -0.40 0.00 0.00 41.96 39.25 1k93 s TYR 492 CO 0.00 -0.55 0.29 -0.51 -1.57 0.00 0.00 175.55 173.22 1k93 s ASP 493 N 1.52 6.20 -0.02 2.29 -0.00 -1.26 -4.60 116.67 120.80 1k93 s ASP 493 Ca 0.03 0.22 -0.30 0.00 -0.00 0.00 0.00 52.55 52.50 1k93 s ASP 493 Cb -0.17 -2.17 -0.04 0.00 -0.00 0.00 0.00 42.92 40.54 1k93 s ASP 493 CO 0.03 -0.09 1.23 -0.76 -0.00 0.00 0.00 175.17 175.58 1k93 s LEU 494 N 1.70 4.31 -0.06 1.23 1.43 -1.26 -0.19 118.68 125.84 1k93 s LEU 494 Ca 0.12 1.91 -0.23 0.00 -1.03 0.00 0.00 54.13 54.91 1k93 s LEU 494 Cb -0.15 -3.56 -0.31 0.00 0.03 0.00 0.00 46.19 42.19 1k93 s LEU 494 CO 0.09 -0.58 0.88 0.15 0.23 0.00 0.00 176.35 177.12 1k93 h PHE 495 N 7.35 0.49 -2.51 0.29 3.57 -0.70 -2.11 116.94 123.34 1k93 h PHE 495 Ca -0.37 -0.36 0.14 0.00 3.53 0.00 0.00 57.97 60.92 1k93 h PHE 495 Cb 1.18 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.82 1k93 h PHE 495 CO 0.72 1.28 0.42 0.00 -2.23 0.00 0.00 178.31 178.50 1k93 s ALA 496 N -2.41 -1.57 -0.03 2.41 0.00 -1.07 -2.87 121.76 116.21 1k93 s ALA 496 Ca -0.14 0.11 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 1k93 s ALA 496 Cb 0.01 0.68 0.03 0.00 0.00 0.00 0.00 23.12 23.83 1k93 s ALA 496 CO 0.82 -1.00 0.03 -0.51 0.00 0.00 0.00 175.76 175.10 1k93 s LEU 497 N -2.89 0.79 -0.47 0.00 1.43 -1.26 -1.59 118.68 114.68 1k93 s LEU 497 Ca 0.11 0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.28 1k93 s LEU 497 Cb -0.02 -0.14 0.12 0.00 0.03 0.00 0.00 46.19 46.18 1k93 s LEU 497 CO 0.02 -0.16 0.20 0.00 0.23 0.00 0.00 176.35 176.64 1k93 s ALA 498 N 1.44 3.19 0.15 4.21 0.00 -0.46 -4.76 121.76 125.53 1k93 s ALA 498 Ca -0.04 -3.07 -0.26 0.00 0.00 0.00 0.00 51.96 48.59 1k93 s ALA 498 Cb -0.13 -2.11 -0.08 0.00 0.00 0.00 0.00 23.12 20.81 1k93 s ALA 498 CO -0.03 -1.93 0.80 -1.25 0.00 0.00 0.00 175.76 173.35 1k93 s PRO 499 N 0.03 4.60 0.43 0.00 0.04 -1.24 0.12 135.00 138.97 1k93 s PRO 499 Ca 0.15 1.19 -0.26 0.00 0.04 0.00 0.00 61.00 62.13 1k93 s PRO 499 Cb -0.24 -3.28 -0.09 0.00 0.04 0.00 0.00 34.50 30.92 1k93 s PRO 499 CO -0.02 0.51 1.43 -1.54 0.04 0.00 0.00 177.00 177.41 1k93 s SER 500 N -0.93 6.05 0.52 6.66 1.04 0.50 -1.23 113.70 126.31 1k93 s SER 500 Ca 0.37 2.92 0.28 0.00 0.48 0.00 0.00 55.95 60.00 1k93 s SER 500 Cb -0.23 -2.66 1.39 0.00 0.10 0.00 0.00 66.02 64.63 1k93 s SER 500 CO 0.27 -1.05 1.92 -0.07 0.98 0.00 0.00 173.24 175.28 1k93 h LEU 501 N 2.55 0.06 -0.08 2.42 3.38 -1.74 -0.45 115.31 121.45 1k93 h LEU 501 Ca -0.51 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.51 1k93 h LEU 501 Cb 1.26 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.95 1k93 h LEU 501 CO 0.62 0.03 -0.26 0.71 0.09 0.00 0.00 178.44 179.62 1k93 h THR 502 N 0.06 0.39 -0.95 0.22 1.35 -1.88 -2.34 112.91 109.76 1k93 h THR 502 Ca 0.38 0.00 0.16 0.00 -0.55 0.00 0.00 66.41 66.40 1k93 h THR 502 Cb 1.41 0.39 -0.08 0.00 -1.73 0.00 0.00 68.15 68.14 1k93 h THR 502 CO -0.03 0.00 0.60 -0.33 -0.25 0.00 0.00 175.52 175.51 1k93 h GLU 503 N -0.36 0.71 0.00 4.72 4.39 -1.42 0.20 114.58 122.82 1k93 h GLU 503 Ca 0.09 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 1k93 h GLU 503 Cb 0.48 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1k93 h GLU 503 CO -0.29 0.47 -0.12 0.82 -1.16 0.00 0.00 179.01 178.74 1k93 h ILE 504 N 0.73 0.39 0.06 3.13 1.08 -1.42 -2.26 117.51 119.22 1k93 h ILE 504 Ca 0.50 -0.66 -0.15 0.00 -0.39 0.00 0.00 64.86 64.16 1k93 h ILE 504 Cb 0.80 1.48 0.02 0.00 -3.07 0.00 0.00 36.82 36.04 1k93 h ILE 504 CO -0.26 0.11 -0.64 0.50 -0.69 0.00 0.00 178.15 177.17 1k93 h LYS 505 N 0.00 0.33 0.00 2.37 3.64 -0.41 -3.09 116.57 119.42 1k93 h LYS 505 Ca -0.00 -0.43 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1k93 h LYS 505 Cb 0.47 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1k93 h LYS 505 CO 0.02 1.14 0.00 1.17 -2.27 0.00 0.00 179.45 179.51 1k93 n LYS 506 N -4.22 0.00 -0.11 1.90 4.81 -0.62 -0.79 118.16 119.13 1k93 n LYS 506 Ca -0.12 0.03 -0.15 0.00 -0.87 0.00 0.00 58.31 57.21 1k93 n LYS 506 Cb 0.71 -1.50 -0.14 0.00 0.02 0.00 0.00 35.03 34.12 1k93 n LYS 506 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1k93 n GLN 507 N -1.01 0.67 -2.28 1.64 -0.06 -1.07 -4.96 117.38 110.31 1k93 n GLN 507 Ca 0.00 0.11 -0.40 0.00 -2.00 0.00 0.00 57.00 54.70 1k93 n GLN 507 Cb 0.00 -1.54 -0.03 0.00 -4.06 0.00 0.00 30.24 24.61 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 -2.51 3.06 -0.20 1.69 1.01 0.03 -4.93 121.20 119.34 1k93 s ILE 508 Ca -0.25 1.07 -0.29 0.00 0.00 0.00 0.00 60.65 61.19 1k93 s ILE 508 Cb 0.08 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1k93 s ILE 508 CO 0.70 0.26 1.88 -2.16 0.00 0.00 0.00 174.94 175.61 1k93 s PRO 509 N -1.63 3.57 0.54 2.79 0.04 -1.26 -4.82 135.00 134.23 1k93 s PRO 509 Ca 0.47 1.87 0.23 0.00 0.04 0.00 0.00 61.00 63.61 1k93 s PRO 509 Cb -0.36 -4.18 0.80 0.00 0.04 0.00 0.00 34.50 30.80 1k93 s PRO 509 CO 0.48 -1.58 1.15 0.94 0.04 0.00 0.00 177.00 178.02 1k93 n GLN 510 N 8.10 0.01 -0.01 4.56 0.00 -1.26 -0.87 117.38 127.91 1k93 n GLN 510 Ca 0.23 0.91 -0.01 0.00 -0.00 0.00 0.00 57.00 58.12 1k93 n GLN 510 Cb 0.45 -2.26 -0.01 0.00 0.00 0.00 0.00 30.24 28.42 1k93 n GLN 510 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1k93 h LYS 511 N 0.00 -0.08 -0.03 3.69 1.57 -2.01 -3.27 116.57 116.44 1k93 h LYS 511 Ca 0.43 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.23 1k93 h LYS 511 Cb 2.61 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 34.93 1k93 h LYS 511 CO -0.00 -0.05 0.09 1.49 -0.57 0.00 0.00 179.45 180.41 1k93 h GLU 512 N -1.02 0.00 0.08 3.15 4.22 -1.39 -2.33 114.58 117.29 1k93 h GLU 512 Ca -0.01 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.43 1k93 h GLU 512 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1k93 h GLU 512 CO 0.01 0.00 -0.04 2.35 -2.18 0.00 0.00 179.01 179.15 1k93 h TRP 513 N 0.00 -0.10 -0.44 0.92 7.01 -1.56 -3.29 115.95 118.48 1k93 h TRP 513 Ca 0.02 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.05 1k93 h TRP 513 Cb 0.20 0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.25 1k93 h TRP 513 CO 0.00 0.39 0.21 -0.44 -2.79 0.00 0.00 178.44 175.82 1k93 h ASP 514 N -0.67 0.30 -0.38 2.65 3.32 -1.47 -2.19 116.42 117.99 1k93 h ASP 514 Ca -0.01 0.03 0.11 0.00 0.02 0.00 0.00 57.03 57.17 1k93 h ASP 514 Cb 0.54 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1k93 h ASP 514 CO 0.02 0.22 0.89 1.17 -1.72 0.00 0.00 179.24 179.81 1k93 n LYS 515 N -4.92 0.02 0.00 3.56 4.81 -1.04 -1.10 118.16 119.49 1k93 n LYS 515 Ca 0.03 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 1k93 n LYS 515 Cb 0.12 -2.06 0.00 0.00 0.02 0.00 0.00 35.03 33.11 1k93 n LYS 515 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1k93 n VAL 516 N -2.45 0.00 0.33 3.15 0.24 -1.15 -4.81 118.33 113.64 1k93 n VAL 516 Ca 0.08 -0.02 0.12 0.00 -2.04 0.00 0.00 64.34 62.49 1k93 n VAL 516 Cb 1.00 0.25 0.11 0.00 -1.47 0.00 0.00 33.84 33.73 1k93 n VAL 516 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1k93 h VAL 517 N 0.00 0.00 -0.17 3.34 3.04 -0.46 -3.27 116.25 118.73 1k93 h VAL 517 Ca 0.00 -0.78 -0.50 0.00 -1.01 0.00 0.00 66.70 64.41 1k93 h VAL 517 Cb 0.00 1.40 -0.03 0.00 -2.01 0.00 0.00 31.29 30.65 1k93 h VAL 517 CO 0.00 0.00 2.09 0.59 -1.01 0.00 0.00 177.57 179.24 1k93 n ASN 518 N -2.50 7.39 -1.50 3.17 5.03 -0.26 -4.69 115.26 121.90 1k93 n ASN 518 Ca 0.02 -2.63 -0.13 0.00 0.87 0.00 0.00 54.58 52.71 1k93 n ASN 518 Cb 0.50 -1.48 -0.01 0.00 -1.02 0.00 0.00 39.78 37.77 1k93 n ASN 518 CO 0.00 0.00 0.00 1.07 -1.83 0.00 0.00 177.26 176.50 1k93 n THR 519 N 2.89 -0.60 -1.77 3.41 5.66 -1.26 -4.96 114.28 117.65 1k93 n THR 519 Ca 0.64 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 61.45 1k93 n THR 519 Cb 0.48 -2.06 -0.07 0.00 -1.55 0.00 0.00 70.33 67.14 1k93 n THR 519 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 175.07 169.18 1k93 s PRO 520 N -4.58 1.89 0.48 1.09 0.02 -1.23 -4.90 135.00 127.77 1k93 s PRO 520 Ca 0.00 -0.08 0.17 0.00 0.02 0.00 0.00 61.00 61.11 1k93 s PRO 520 Cb 0.00 -4.95 1.18 0.00 0.02 0.00 0.00 34.50 30.75 1k93 s PRO 520 CO 0.00 -4.29 2.04 -0.91 -0.33 0.00 0.00 177.00 173.50 1k93 h ASN 521 N 11.77 0.18 0.00 2.53 2.35 -1.93 -3.33 115.58 127.15 1k93 h ASN 521 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1k93 h ASN 521 Cb 0.99 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.33 1k93 h ASN 521 CO 1.09 0.11 -0.78 -1.20 -1.65 0.00 0.00 177.43 175.00 1k93 n SER 522 N -4.46 3.90 -2.54 5.81 7.64 -1.26 -4.77 113.62 117.94 1k93 n SER 522 Ca 0.06 -0.06 -0.02 0.00 1.01 0.00 0.00 58.87 59.85 1k93 n SER 522 Cb 0.34 0.91 0.11 0.00 -1.01 0.00 0.00 64.21 64.56 1k93 n SER 522 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1k93 n LEU 523 N -1.30 -1.34 0.00 -3.43 -0.00 -1.26 -4.84 117.00 104.83 1k93 n LEU 523 Ca 0.00 -2.96 0.00 0.00 -0.00 0.00 0.00 56.01 53.05 1k93 n LEU 523 Cb 0.00 0.20 0.00 0.00 -0.00 0.00 0.00 43.42 43.62 1k93 n LEU 523 CO 0.00 1.64 0.00 -1.84 -0.00 0.00 0.00 177.39 177.19 1k93 n GLU 524 N -1.25 0.00 0.00 1.47 -0.00 -1.26 -4.67 120.64 114.93 1k93 n GLU 524 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.02 1k93 n GLU 524 Cb 0.83 -0.26 0.00 0.00 -0.00 0.00 0.00 31.44 32.01 1k93 n GLU 524 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1k93 n LYS 525 N 0.00 0.00 0.00 3.44 5.02 -1.25 -3.27 118.16 122.10 1k93 n LYS 525 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1k93 n LYS 525 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.17 1k93 n LYS 525 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1k93 n GLN 526 N 0.00 0.00 -0.32 1.97 3.00 -1.26 0.71 117.38 121.48 1k93 n GLN 526 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.11 1k93 n GLN 526 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 30.24 30.54 1k93 n GLN 526 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 1k93 h LYS 527 N 0.00 0.53 0.09 -1.09 3.64 -1.83 -1.78 116.57 116.13 1k93 h LYS 527 Ca 0.00 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1k93 h LYS 527 Cb 0.00 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1k93 h LYS 527 CO 0.00 0.35 -0.04 0.78 -2.27 0.00 0.00 179.45 178.27 1k93 h GLY 528 N 0.55 -0.13 -0.95 5.01 0.00 2.41 -1.90 103.07 108.07 1k93 h GLY 528 Ca 0.55 0.05 0.41 0.00 0.00 0.00 0.00 47.33 48.34 1k93 h GLY 528 CO -0.45 -0.05 0.59 -0.39 0.00 0.00 0.00 176.54 176.25 1k93 h VAL 529 N -0.15 0.06 0.08 4.60 -1.51 -1.28 0.15 116.25 118.21 1k93 h VAL 529 Ca -0.01 -0.02 -0.00 0.00 -1.23 0.00 0.00 66.70 65.43 1k93 h VAL 529 Cb 0.09 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.25 1k93 h VAL 529 CO 0.02 0.01 -0.04 0.71 -1.23 0.00 0.00 177.57 177.04 1k93 h THR 530 N 0.07 1.16 0.00 7.19 1.35 -1.36 -0.46 112.91 120.86 1k93 h THR 530 Ca 0.83 -1.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 1k93 h THR 530 Cb 2.21 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 70.59 1k93 h THR 530 CO -0.69 0.30 0.00 0.78 -0.25 0.00 0.00 175.52 175.66 1k93 h ASN 531 N -0.77 0.00 0.23 5.36 4.21 -0.25 1.01 115.58 125.37 1k93 h ASN 531 Ca -0.01 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 57.17 1k93 h ASN 531 Cb 0.58 0.00 0.03 0.00 -1.12 0.00 0.00 38.32 37.81 1k93 h ASN 531 CO 0.02 0.00 -1.53 -0.07 -1.29 0.00 0.00 177.43 174.56 1k93 h LEU 532 N 0.00 0.75 -1.82 1.61 3.38 -0.68 -1.24 115.31 117.32 1k93 h LEU 532 Ca 0.00 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 57.02 1k93 h LEU 532 Cb 0.10 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1k93 h LEU 532 CO 0.00 1.72 -0.11 0.25 0.09 0.00 0.00 178.44 180.39 1k93 h LEU 533 N 0.09 0.00 0.00 1.67 5.85 0.23 -2.55 115.31 120.60 1k93 h LEU 533 Ca -0.28 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.23 1k93 h LEU 533 Cb 2.11 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 43.11 1k93 h LEU 533 CO 0.24 0.11 -1.52 -0.38 -0.34 0.00 0.00 178.44 176.55 1k93 n ILE 534 N -3.47 1.33 0.13 4.05 5.41 0.28 -2.22 119.36 124.88 1k93 n ILE 534 Ca -0.01 -0.73 -0.24 0.00 1.00 0.00 0.00 62.75 62.77 1k93 n ILE 534 Cb 0.26 -0.84 -0.16 0.00 -0.71 0.00 0.00 39.64 38.19 1k93 n ILE 534 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1k93 h LYS 535 N 0.00 0.51 -0.76 0.38 1.79 -0.82 -0.98 116.57 116.69 1k93 h LYS 535 Ca -0.21 -0.87 -0.56 0.00 -2.18 0.00 0.00 60.65 56.83 1k93 h LYS 535 Cb 1.73 0.33 -0.42 0.00 -1.58 0.00 0.00 32.23 32.29 1k93 h LYS 535 CO 0.06 1.42 -0.72 0.66 -1.08 0.00 0.00 179.45 179.78 1k93 n TYR 536 N -3.74 2.77 0.00 -1.35 4.02 -1.07 -4.64 117.16 113.15 1k93 n TYR 536 Ca -0.18 -2.26 0.00 0.00 -0.01 0.00 0.00 57.90 55.45 1k93 n TYR 536 Cb 1.08 -0.40 0.00 0.00 -0.02 0.00 0.00 39.34 40.00 1k93 n TYR 536 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1k93 n GLY 537 N -0.72 0.12 0.24 2.72 0.00 -1.20 -4.81 105.19 101.54 1k93 n GLY 537 Ca 0.45 -0.12 -0.19 0.00 0.00 0.00 0.00 46.02 46.16 1k93 n GLY 537 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1k93 n ILE 538 N -1.69 1.38 -1.72 -0.61 2.08 -0.94 -4.99 119.36 112.87 1k93 n ILE 538 Ca 0.00 -0.15 -0.43 0.00 0.56 0.00 0.00 62.75 62.73 1k93 n ILE 538 Cb 0.00 -1.98 -0.02 0.00 -0.75 0.00 0.00 39.64 36.89 1k93 n ILE 538 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1k93 n GLU 539 N -4.17 2.44 -4.42 0.38 0.00 -0.38 -5.02 120.64 109.47 1k93 n GLU 539 Ca -0.35 0.87 -0.26 0.00 0.00 0.00 0.00 57.16 57.42 1k93 n GLU 539 Cb 0.70 -2.60 -0.13 0.00 0.00 0.00 0.00 31.44 29.41 1k93 n GLU 539 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1k93 s ARG 540 N -0.51 1.31 0.05 5.31 3.00 -1.26 -4.73 118.95 122.12 1k93 s ARG 540 Ca 0.65 -1.20 0.04 0.00 0.00 0.00 0.00 55.73 55.22 1k93 s ARG 540 Cb -0.55 -1.63 -0.02 0.00 0.00 0.00 0.00 34.95 32.74 1k93 s ARG 540 CO 0.49 0.39 -0.11 0.21 0.00 0.00 0.00 175.30 176.29 1k93 s LYS 541 N -1.81 0.68 0.00 3.54 2.20 -0.14 -4.89 119.74 119.33 1k93 s LYS 541 Ca 0.10 -0.78 0.00 0.00 -0.36 0.00 0.00 55.97 54.93 1k93 s LYS 541 Cb -0.10 -0.59 0.00 0.00 -1.51 0.00 0.00 37.83 35.64 1k93 s LYS 541 CO 0.04 0.13 0.00 -2.30 -0.36 0.00 0.00 175.35 172.86 1k93 n PRO 542 N 1.58 -1.02 0.00 4.03 -0.02 -1.26 -1.49 135.00 136.82 1k93 n PRO 542 Ca -0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 1k93 n PRO 542 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.03 1k93 n PRO 542 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1k93 n ASP 543 N -2.23 0.00 0.00 2.55 -0.08 -1.24 -4.51 116.55 111.05 1k93 n ASP 543 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1k93 n ASP 543 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1k93 n ASP 543 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1k93 n SER 544 N 0.00 0.00 0.20 1.67 2.88 -1.26 -4.15 113.62 112.96 1k93 n SER 544 Ca 0.00 0.09 0.07 0.00 -1.33 0.00 0.00 58.87 57.70 1k93 n SER 544 Cb 0.00 0.00 0.36 0.00 -0.75 0.00 0.00 64.21 63.82 1k93 n SER 544 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1k93 h THR 545 N 0.00 0.74 -2.87 2.46 2.02 -2.00 -3.40 112.91 109.85 1k93 h THR 545 Ca 0.00 -1.40 -0.64 0.00 0.77 0.00 0.00 66.41 65.14 1k93 h THR 545 Cb 0.00 1.90 -0.08 0.00 -1.74 0.00 0.00 68.15 68.23 1k93 h THR 545 CO 0.00 0.31 -0.44 -0.54 0.37 0.00 0.00 175.52 175.22 1k93 s LYS 546 N -3.57 3.72 0.00 6.66 3.01 -1.25 -4.44 119.74 123.87 1k93 s LYS 546 Ca 0.01 -0.08 0.00 0.00 -1.01 0.00 0.00 55.97 54.88 1k93 s LYS 546 Cb 0.10 -3.26 0.00 0.00 -1.01 0.00 0.00 37.83 33.66 1k93 s LYS 546 CO 0.67 0.62 0.00 0.41 0.51 0.00 0.00 175.35 177.56 1k93 n GLY 547 N 2.43 -1.80 3.74 -3.33 0.00 -1.26 -3.83 105.19 101.14 1k93 n GLY 547 Ca -0.18 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 1k93 n GLY 547 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1k93 n THR 548 N -0.11 0.82 -3.90 2.61 -1.04 -1.26 -3.66 114.28 107.73 1k93 n THR 548 Ca 0.00 -0.20 -0.11 0.00 -2.04 0.00 0.00 64.05 61.70 1k93 n THR 548 Cb 0.00 -1.99 0.00 0.00 -1.82 0.00 0.00 70.33 66.52 1k93 n THR 548 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1k93 s LEU 549 N -0.16 0.31 0.18 -4.42 2.96 -0.55 -4.49 118.68 112.51 1k93 s LEU 549 Ca 0.66 -1.23 0.09 0.00 -0.22 0.00 0.00 54.13 53.44 1k93 s LEU 549 Cb -0.49 2.39 -0.04 0.00 0.50 0.00 0.00 46.19 48.55 1k93 s LEU 549 CO 0.45 -1.54 -0.20 -0.94 -1.32 0.00 0.00 176.35 172.80 1k93 s SER 550 N -3.11 2.92 0.33 3.68 1.04 -1.26 -0.96 113.70 116.33 1k93 s SER 550 Ca 0.20 -0.88 0.01 0.00 0.48 0.00 0.00 55.95 55.76 1k93 s SER 550 Cb -0.04 -0.19 0.57 0.00 0.10 0.00 0.00 66.02 66.47 1k93 s SER 550 CO 0.14 0.00 1.98 0.78 0.98 0.00 0.00 173.24 177.13 1k93 h ASN 551 N 3.15 0.78 -0.50 7.02 -0.26 -1.96 0.31 115.58 124.12 1k93 h ASN 551 Ca -0.43 -0.03 -0.05 0.00 -0.56 0.00 0.00 56.30 55.23 1k93 h ASN 551 Cb 1.21 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 38.25 1k93 h ASN 551 CO 0.51 0.58 0.13 4.11 -1.06 0.00 0.00 177.43 181.71 1k93 h TRP 552 N 0.91 0.88 -0.57 1.19 0.09 -1.96 -2.92 115.95 113.57 1k93 h TRP 552 Ca 0.24 -0.08 -0.09 0.00 0.09 0.00 0.00 58.89 59.05 1k93 h TRP 552 Cb -0.07 -0.26 -0.02 0.00 0.08 0.00 0.00 29.16 28.90 1k93 h TRP 552 CO 0.00 0.73 -0.01 1.96 0.09 0.00 0.00 178.44 181.22 1k93 h GLN 553 N 0.82 1.01 0.47 0.12 4.20 -0.91 -2.82 115.11 118.00 1k93 h GLN 553 Ca 0.18 -0.33 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 1k93 h GLN 553 Cb 0.30 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1k93 h GLN 553 CO -0.00 1.01 -0.23 0.87 -0.67 0.00 0.00 178.83 179.81 1k93 h LYS 554 N 0.90 -0.61 -0.76 1.46 1.57 -0.72 0.28 116.57 118.69 1k93 h LYS 554 Ca 0.16 0.04 0.17 0.00 -1.87 0.00 0.00 60.65 59.15 1k93 h LYS 554 Cb 0.56 0.14 -0.12 0.00 0.08 0.00 0.00 32.23 32.89 1k93 h LYS 554 CO 0.03 -0.37 0.17 1.96 -0.57 0.00 0.00 179.45 180.67 1k93 h GLN 555 N -0.71 0.24 -0.88 3.15 4.20 -1.57 0.80 115.11 120.35 1k93 h GLN 555 Ca -0.06 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.65 1k93 h GLN 555 Cb 0.52 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.20 1k93 h GLN 555 CO 0.11 0.16 0.57 1.98 -0.67 0.00 0.00 178.83 180.98 1k93 h MET 556 N 0.25 1.11 0.38 1.46 4.05 -1.21 0.34 114.93 121.30 1k93 h MET 556 Ca 0.43 -0.07 -0.01 0.00 -0.28 0.00 0.00 59.70 59.78 1k93 h MET 556 Cb 0.76 -0.25 -0.01 0.00 -0.80 0.00 0.00 31.60 31.30 1k93 h MET 556 CO -0.54 0.73 -0.28 -0.07 0.23 0.00 0.00 176.91 176.98 1k93 h LEU 557 N 1.14 -0.71 -0.01 3.39 4.07 0.25 -1.35 115.31 122.10 1k93 h LEU 557 Ca 0.34 0.05 0.03 0.00 0.08 0.00 0.00 57.88 58.38 1k93 h LEU 557 Cb -0.06 0.22 -0.06 0.00 1.08 0.00 0.00 40.66 41.85 1k93 h LEU 557 CO -0.10 -0.42 -0.41 0.44 -1.08 0.00 0.00 178.44 176.88 1k93 h ASP 558 N -0.65 -1.23 -0.89 -0.43 3.45 0.41 -0.17 116.42 116.90 1k93 h ASP 558 Ca -0.03 0.15 0.14 0.00 0.43 0.00 0.00 57.03 57.72 1k93 h ASP 558 Cb 0.55 0.48 -0.07 0.00 -0.56 0.00 0.00 39.33 39.74 1k93 h ASP 558 CO 0.01 -0.45 0.58 0.03 -1.57 0.00 0.00 179.24 177.84 1k93 h ARG 559 N -0.55 0.69 0.42 3.56 3.08 -0.24 -0.40 114.38 120.95 1k93 h ARG 559 Ca 0.05 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1k93 h ARG 559 Cb 0.64 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1k93 h ARG 559 CO -0.32 0.46 -0.20 -0.07 -1.07 0.00 0.00 179.97 178.77 1k93 h LEU 560 N 0.72 -0.48 -0.37 3.04 3.38 -0.03 -1.12 115.31 120.44 1k93 h LEU 560 Ca 0.45 -0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.40 1k93 h LEU 560 Cb 0.69 0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.50 1k93 h LEU 560 CO -0.21 -0.17 -0.04 0.78 0.09 0.00 0.00 178.44 178.89 1k93 h ASN 561 N -0.80 -0.24 -0.63 -0.43 2.35 -0.41 -1.03 115.58 114.38 1k93 h ASN 561 Ca -0.06 0.10 0.06 0.00 -0.55 0.00 0.00 56.30 55.85 1k93 h ASN 561 Cb 0.54 0.19 -0.05 0.00 0.05 0.00 0.00 38.32 39.05 1k93 h ASN 561 CO 0.10 -0.08 0.33 -0.33 -1.65 0.00 0.00 177.43 175.80 1k93 h GLU 562 N 0.05 0.60 -0.93 0.81 5.08 -1.10 -1.09 114.58 118.01 1k93 h GLU 562 Ca 0.18 -0.04 0.26 0.00 -1.00 0.00 0.00 59.36 58.76 1k93 h GLU 562 Cb 0.27 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 1k93 h GLU 562 CO -0.34 0.39 0.65 0.00 -1.00 0.00 0.00 179.01 178.72 1k93 h ALA 563 N 1.34 2.70 0.00 3.43 0.00 0.15 -1.08 119.26 125.79 1k93 h ALA 563 Ca 0.28 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.95 1k93 h ALA 563 Cb 0.20 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1k93 h ALA 563 CO -0.19 -0.98 -1.34 -0.39 0.00 0.00 0.00 179.25 176.36 1k93 h VAL 564 N 0.11 1.06 -0.08 0.00 -1.51 -0.97 -3.32 116.25 111.55 1k93 h VAL 564 Ca 0.46 -2.77 0.04 0.00 -1.23 0.00 0.00 66.70 63.20 1k93 h VAL 564 Cb 1.63 2.49 -0.06 0.00 -2.13 0.00 0.00 31.29 33.23 1k93 h VAL 564 CO -0.06 0.61 -0.29 0.11 -1.23 0.00 0.00 177.57 176.70 1k93 h LYS 565 N 0.00 -0.38 0.00 5.19 1.79 -0.87 0.65 116.57 122.95 1k93 h LYS 565 Ca -0.16 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 1k93 h LYS 565 Cb 1.82 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 32.55 1k93 h LYS 565 CO 0.09 -0.25 0.06 0.66 -1.08 0.00 0.00 179.45 178.92 1k93 n TYR 566 N -5.40 0.00 -0.04 -1.35 4.02 -1.07 0.23 117.16 113.56 1k93 n TYR 566 Ca -0.04 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.87 1k93 n TYR 566 Cb 0.31 -0.06 -0.15 0.00 -0.02 0.00 0.00 39.34 39.42 1k93 n TYR 566 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1k93 n THR 567 N -0.87 0.70 0.00 -0.72 -1.04 0.23 -4.95 114.28 107.63 1k93 n THR 567 Ca 0.00 -0.66 0.00 0.00 -2.04 0.00 0.00 64.05 61.35 1k93 n THR 567 Cb 0.06 -0.28 0.00 0.00 -1.82 0.00 0.00 70.33 68.29 1k93 n THR 567 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1k93 n GLY 568 N 1.46 1.61 3.56 3.41 0.00 0.14 -5.07 105.19 110.29 1k93 n GLY 568 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1k93 n GLY 568 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1k93 s TYR 569 N -2.00 2.93 -0.10 1.61 5.04 -1.20 -4.89 117.35 118.73 1k93 s TYR 569 Ca 0.00 0.34 -0.25 0.00 -2.44 0.00 0.00 57.07 54.72 1k93 s TYR 569 Cb 0.00 -3.94 -0.22 0.00 0.35 0.00 0.00 41.96 38.15 1k93 s TYR 569 CO 0.00 -1.09 0.83 1.79 -1.34 0.00 0.00 175.55 175.73 1k93 h THR 570 N 6.07 1.46 -0.20 4.34 1.35 -1.91 -3.40 112.91 120.63 1k93 h THR 570 Ca -0.24 -1.85 0.06 0.00 -0.55 0.00 0.00 66.41 63.82 1k93 h THR 570 Cb 1.08 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 70.14 1k93 h THR 570 CO 1.02 0.45 0.18 0.61 -0.25 0.00 0.00 175.52 177.54 1k93 n GLY 571 N 1.22 -0.12 0.00 5.82 0.00 -0.97 -4.87 105.19 106.27 1k93 n GLY 571 Ca -0.09 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.00 0.27 3.77 -0.02 0.00 -1.26 -4.65 105.19 102.29 1k93 n GLY 572 Ca 0.05 -1.88 -0.39 0.00 0.00 0.00 0.00 46.02 43.80 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 6.60 0.00 1.61 -0.00 -1.26 -4.93 116.67 114.69 1k93 s ASP 573 Ca 0.00 2.37 0.09 0.00 -0.00 0.00 0.00 52.55 55.01 1k93 s ASP 573 Cb 0.00 -2.62 -0.08 0.00 -0.00 0.00 0.00 42.92 40.22 1k93 s ASP 573 CO 0.00 -0.62 0.41 0.55 -0.00 0.00 0.00 175.17 175.50 1k93 n VAL 574 N 0.22 0.00 -3.76 -1.27 3.14 -1.26 -4.54 118.33 110.86 1k93 n VAL 574 Ca 0.03 -0.31 -0.29 0.00 -2.96 0.00 0.00 64.34 60.82 1k93 n VAL 574 Cb 0.46 1.02 -0.16 0.00 -1.06 0.00 0.00 33.84 34.10 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 -1.75 0.76 -1.91 1.55 1.01 -1.26 -1.40 120.40 117.39 1k93 s VAL 575 Ca 0.04 -0.91 0.22 0.00 0.00 0.00 0.00 61.98 61.33 1k93 s VAL 575 Cb 0.07 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 1k93 s VAL 575 CO 0.34 -0.35 1.08 0.59 0.00 0.00 0.00 175.10 176.76 1k93 n ASN 576 N 4.94 1.90 -1.74 3.32 3.02 -1.26 -4.93 115.26 120.50 1k93 n ASN 576 Ca -0.07 -1.45 -0.03 0.00 -0.03 0.00 0.00 54.58 53.00 1k93 n ASN 576 Cb 0.45 0.53 0.01 0.00 -0.61 0.00 0.00 39.78 40.16 1k93 n ASN 576 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k93 n HIS 577 N -0.20 -1.39 0.00 3.10 1.44 -1.26 -3.84 115.22 113.06 1k93 n HIS 577 Ca 0.09 -0.68 0.00 0.00 -2.01 0.00 0.00 57.72 55.12 1k93 n HIS 577 Cb 0.45 0.34 0.00 0.00 0.12 0.00 0.00 29.99 30.90 1k93 n HIS 577 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1k93 n GLY 578 N -0.23 -3.20 3.81 -1.39 0.00 -1.26 -4.82 105.19 98.10 1k93 n GLY 578 Ca -0.03 -1.09 -0.24 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.01 4.43 0.58 2.61 -4.23 -1.26 -4.38 115.64 113.37 1k93 s THR 579 Ca 0.00 -1.28 0.37 0.00 -1.18 0.00 0.00 61.69 59.60 1k93 s THR 579 Cb 0.00 -3.34 0.39 0.00 1.34 0.00 0.00 72.50 70.90 1k93 s THR 579 CO 0.00 -0.25 2.28 -0.08 -0.54 0.00 0.00 174.62 176.03 1k93 h GLU 580 N 1.90 0.00 0.00 3.99 4.57 -1.23 -1.07 114.58 122.73 1k93 h GLU 580 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1k93 h GLU 580 Cb 1.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 1k93 h GLU 580 CO 0.62 0.01 0.00 1.04 -1.18 0.00 0.00 179.01 179.50 1k93 n GLN 581 N -3.41 0.06 -0.08 1.92 1.13 -1.23 -1.44 117.38 114.34 1k93 n GLN 581 Ca -0.03 0.42 0.04 0.00 -1.94 0.00 0.00 57.00 55.49 1k93 n GLN 581 Cb 0.11 -1.65 0.07 0.00 0.11 0.00 0.00 30.24 28.88 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 -1.77 2.36 -4.24 1.08 8.00 -0.41 -3.45 116.55 118.12 1k93 n ASP 582 Ca 0.01 -2.29 -0.42 0.00 0.71 0.00 0.00 54.79 52.80 1k93 n ASP 582 Cb 0.11 -0.16 -0.04 0.00 -0.02 0.00 0.00 41.12 41.00 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 -1.44 6.42 0.00 -2.24 2.47 -0.52 -4.72 114.94 114.91 1k93 s ASN 583 Ca 0.13 -3.14 0.24 0.00 0.42 0.00 0.00 52.86 50.52 1k93 s ASN 583 Cb 0.10 -2.08 0.33 0.00 -1.45 0.00 0.00 41.25 38.15 1k93 s ASN 583 CO 0.04 -0.39 1.29 -0.62 -3.72 0.00 0.00 177.10 173.70 1k93 n GLU 584 N 3.25 0.55 0.00 0.43 1.02 -1.26 -3.50 120.64 121.13 1k93 n GLU 584 Ca 0.16 -0.39 -0.18 0.00 -0.02 0.00 0.00 57.16 56.74 1k93 n GLU 584 Cb 0.41 -1.49 -0.14 0.00 -0.02 0.00 0.00 31.44 30.20 1k93 n GLU 584 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1k93 h GLU 585 N 0.95 0.20 -2.04 3.49 5.08 -1.96 -3.40 114.58 116.90 1k93 h GLU 585 Ca 0.00 -0.34 -0.55 0.00 -1.00 0.00 0.00 59.36 57.47 1k93 h GLU 585 Cb 0.56 0.13 -0.40 0.00 0.50 0.00 0.00 28.75 29.54 1k93 h GLU 585 CO 0.00 1.02 -1.03 1.19 -1.00 0.00 0.00 179.01 179.19 1k93 n PHE 586 N -3.37 0.58 -1.94 4.33 3.01 -1.26 -0.96 117.46 117.85 1k93 n PHE 586 Ca -0.27 -3.73 -0.37 0.00 1.01 0.00 0.00 57.45 54.09 1k93 n PHE 586 Cb 1.05 -0.40 0.03 0.00 -0.01 0.00 0.00 39.48 40.15 1k93 n PHE 586 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1k93 s PRO 587 N -1.77 3.10 -0.10 -1.08 0.02 -1.23 -5.00 135.00 128.94 1k93 s PRO 587 Ca 0.38 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.39 1k93 s PRO 587 Cb 0.21 -2.11 0.02 0.00 0.02 0.00 0.00 34.50 32.65 1k93 s PRO 587 CO -0.09 -1.15 -0.08 -1.21 -0.33 0.00 0.00 177.00 174.14 1k93 s GLU 588 N -3.09 1.53 -0.15 5.54 0.41 -1.26 -4.92 118.70 116.75 1k93 s GLU 588 Ca 0.74 -0.27 -0.16 0.00 -0.41 0.00 0.00 54.97 54.87 1k93 s GLU 588 Cb -0.35 -1.52 -0.04 0.00 -1.78 0.00 0.00 34.13 30.44 1k93 s GLU 588 CO 0.39 -0.21 0.38 0.21 -0.49 0.00 0.00 175.26 175.54 1k93 s LYS 589 N 1.49 4.27 0.14 1.61 2.20 -1.26 -5.07 119.74 123.12 1k93 s LYS 589 Ca 0.01 0.24 0.10 0.00 -0.36 0.00 0.00 55.97 55.96 1k93 s LYS 589 Cb -0.13 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 1k93 s LYS 589 CO -0.06 0.16 -0.24 -0.51 -0.36 0.00 0.00 175.35 174.34 1k93 s ASP 590 N 0.64 3.52 0.00 1.43 1.01 -1.26 -5.07 116.67 116.93 1k93 s ASP 590 Ca 0.20 -0.71 0.00 0.00 0.71 0.00 0.00 52.55 52.75 1k93 s ASP 590 Cb -0.14 -0.33 0.00 0.00 1.01 0.00 0.00 42.92 43.46 1k93 s ASP 590 CO 0.07 0.17 0.34 0.59 0.21 0.00 0.00 175.17 176.54 1k93 n ASN 591 N 0.74 0.00 -4.73 0.27 3.02 -1.26 -4.33 115.26 108.97 1k93 n ASN 591 Ca -0.16 0.50 -0.41 0.00 -0.03 0.00 0.00 54.58 54.48 1k93 n ASN 591 Cb 0.54 -0.29 -0.04 0.00 -0.61 0.00 0.00 39.78 39.37 1k93 n ASN 591 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1k93 s GLU 592 N -1.25 4.59 -0.03 3.52 2.02 -1.26 -3.65 118.70 122.64 1k93 s GLU 592 Ca 0.00 1.28 0.06 0.00 0.02 0.00 0.00 54.97 56.32 1k93 s GLU 592 Cb 0.00 -3.39 -0.01 0.00 0.10 0.00 0.00 34.13 30.83 1k93 s GLU 592 CO 0.00 0.20 -0.20 0.42 0.02 0.00 0.00 175.26 175.70 1k93 s ILE 593 N 0.15 1.60 -0.17 -1.63 -1.09 -1.20 -4.22 121.20 114.65 1k93 s ILE 593 Ca 0.44 -0.84 -0.12 0.00 -2.23 0.00 0.00 60.65 57.90 1k93 s ILE 593 Cb -0.22 -1.35 -0.05 0.00 -1.58 0.00 0.00 42.46 39.27 1k93 s ILE 593 CO 0.27 0.45 0.23 0.12 -1.23 0.00 0.00 174.94 174.78 1k93 s PHE 594 N -0.27 3.46 -0.03 3.97 5.36 -0.79 -1.34 117.98 128.34 1k93 s PHE 594 Ca 0.03 0.51 0.05 0.00 -0.96 0.00 0.00 56.93 56.56 1k93 s PHE 594 Cb -0.10 -2.25 -0.01 0.00 -0.34 0.00 0.00 43.02 40.32 1k93 s PHE 594 CO 0.01 0.30 -0.17 0.42 -1.46 0.00 0.00 175.22 174.31 1k93 s ILE 595 N 0.28 1.43 -0.24 3.12 1.01 0.28 -0.40 121.20 126.68 1k93 s ILE 595 Ca 0.14 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1k93 s ILE 595 Cb -0.12 -1.21 0.04 0.00 0.01 0.00 0.00 42.46 41.17 1k93 s ILE 595 CO 0.02 0.41 -0.11 -0.63 0.00 0.00 0.00 174.94 174.63 1k93 s ILE 596 N -0.14 2.43 0.61 2.92 1.01 -0.38 0.06 121.20 127.72 1k93 s ILE 596 Ca 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 60.65 59.33 1k93 s ILE 596 Cb -0.10 -2.25 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1k93 s ILE 596 CO 0.01 0.20 1.00 0.54 0.00 0.00 0.00 174.94 176.70 1k93 s ASN 597 N 1.24 6.16 0.63 3.58 2.20 -0.77 -1.40 114.94 126.57 1k93 s ASN 597 Ca -0.02 1.33 0.30 0.00 -0.94 0.00 0.00 52.86 53.53 1k93 s ASN 597 Cb -0.17 -2.39 1.62 0.00 -2.00 0.00 0.00 41.25 38.31 1k93 s ASN 597 CO -0.07 -0.88 1.96 1.55 -2.94 0.00 0.00 177.10 176.73 1k93 h PRO 598 N -0.28 0.00 0.00 3.55 0.13 -1.76 1.71 132.00 135.35 1k93 h PRO 598 Ca -0.44 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 1k93 h PRO 598 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1k93 h PRO 598 CO 0.62 0.00 -0.12 0.93 -0.23 0.00 0.00 178.00 179.20 1k93 h GLU 599 N 0.00 0.00 0.00 0.86 4.39 -1.91 -3.22 114.58 114.69 1k93 h GLU 599 Ca 0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.78 1k93 h GLU 599 Cb 0.77 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 1k93 h GLU 599 CO -0.00 0.12 0.00 0.41 -1.16 0.00 0.00 179.01 178.38 1k93 n GLY 600 N 0.21 1.21 3.97 -3.84 0.00 0.58 -4.96 105.19 102.37 1k93 n GLY 600 Ca 0.01 -0.19 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.86 3.32 -0.12 1.61 2.02 -1.24 -4.83 118.70 118.60 1k93 s GLU 601 Ca 0.00 -0.75 -0.04 0.00 0.02 0.00 0.00 54.97 54.20 1k93 s GLU 601 Cb 0.00 -2.81 -0.03 0.00 0.10 0.00 0.00 34.13 31.38 1k93 s GLU 601 CO 0.00 0.23 0.02 -0.06 0.02 0.00 0.00 175.26 175.47 1k93 s PHE 602 N -2.13 3.19 -0.02 1.61 2.99 -1.26 -1.85 117.98 120.51 1k93 s PHE 602 Ca 0.39 0.11 -0.02 0.00 0.00 0.00 0.00 56.93 57.41 1k93 s PHE 602 Cb -0.09 -1.89 0.00 0.00 0.00 0.00 0.00 43.02 41.04 1k93 s PHE 602 CO 0.31 0.33 0.06 0.42 -0.00 0.00 0.00 175.22 176.34 1k93 s ILE 603 N -0.41 0.01 -0.13 0.64 1.01 0.11 -3.45 121.20 118.98 1k93 s ILE 603 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.67 1k93 s ILE 603 Cb -0.12 -0.11 0.02 0.00 0.01 0.00 0.00 42.46 42.27 1k93 s ILE 603 CO 0.02 -0.03 -0.11 -0.22 0.00 0.00 0.00 174.94 174.59 1k93 s LEU 604 N -0.07 1.46 0.40 2.97 2.96 -0.98 0.98 118.68 126.40 1k93 s LEU 604 Ca -0.01 -0.40 -0.24 0.00 -0.22 0.00 0.00 54.13 53.25 1k93 s LEU 604 Cb -0.01 -1.03 -0.09 0.00 0.50 0.00 0.00 46.19 45.57 1k93 s LEU 604 CO 0.00 -0.08 1.09 -0.89 -1.32 0.00 0.00 176.35 175.15 1k93 s THR 605 N 1.57 3.53 -0.56 3.68 2.01 -0.45 -2.48 115.64 122.94 1k93 s THR 605 Ca 0.05 1.21 0.21 0.00 0.31 0.00 0.00 61.69 63.47 1k93 s THR 605 Cb -0.13 -3.64 -0.27 0.00 0.01 0.00 0.00 72.50 68.47 1k93 s THR 605 CO -0.09 0.04 0.70 0.29 -0.69 0.00 0.00 174.62 174.87 1k93 n LYS 606 N -0.02 0.36 -3.66 4.92 5.02 -1.26 -3.22 118.16 120.31 1k93 n LYS 606 Ca 0.05 -0.09 -0.09 0.00 -2.02 0.00 0.00 58.31 56.16 1k93 n LYS 606 Cb 0.49 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.98 1k93 n LYS 606 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1k93 s ASN 607 N -3.63 -0.39 0.18 4.39 4.22 -1.24 -4.36 114.94 114.11 1k93 s ASN 607 Ca 0.01 -0.34 -0.17 0.00 -2.14 0.00 0.00 52.86 50.22 1k93 s ASN 607 Cb 0.15 0.65 0.13 0.00 1.28 0.00 0.00 41.25 43.46 1k93 s ASN 607 CO 0.87 -1.14 1.65 -0.25 -2.04 0.00 0.00 177.10 176.19 1k93 h TRP 608 N 2.04 -0.30 -0.39 1.54 -0.00 -1.75 0.24 115.95 117.33 1k93 h TRP 608 Ca -0.27 0.04 -0.03 0.00 -0.00 0.00 0.00 58.89 58.63 1k93 h TRP 608 Cb 1.28 0.20 -0.02 0.00 -0.00 0.00 0.00 29.16 30.62 1k93 h TRP 608 CO 0.33 -0.22 0.12 0.93 -0.00 0.00 0.00 178.44 179.60 1k93 h GLU 609 N -0.03 0.60 -0.89 2.65 3.07 -1.95 -1.37 114.58 116.66 1k93 h GLU 609 Ca 0.22 -0.13 0.04 0.00 -0.50 0.00 0.00 59.36 58.99 1k93 h GLU 609 Cb 0.36 -0.09 -0.05 0.00 -0.84 0.00 0.00 28.75 28.14 1k93 h GLU 609 CO -0.48 0.61 0.59 1.98 -1.40 0.00 0.00 179.01 180.30 1k93 h MET 610 N 0.48 1.08 -0.45 2.33 1.85 -1.60 -0.75 114.93 117.88 1k93 h MET 610 Ca 0.12 -0.07 -0.04 0.00 -0.61 0.00 0.00 59.70 59.11 1k93 h MET 610 Cb 0.26 -0.24 -0.02 0.00 0.43 0.00 0.00 31.60 32.03 1k93 h MET 610 CO -0.00 0.72 0.11 1.15 -0.40 0.00 0.00 176.91 178.48 1k93 h THR 611 N 1.12 1.23 -0.14 -0.77 2.02 -0.10 -2.06 112.91 114.21 1k93 h THR 611 Ca 0.36 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.72 1k93 h THR 611 Cb 0.02 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1k93 h THR 611 CO -0.11 0.29 0.07 1.23 0.37 0.00 0.00 175.52 177.37 1k93 h GLY 612 N 0.60 0.21 0.26 2.16 0.00 -0.62 -0.93 103.07 104.74 1k93 h GLY 612 Ca 0.14 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.41 1k93 h GLY 612 CO 0.00 0.10 -0.30 -0.09 0.00 0.00 0.00 176.54 176.25 1k93 h ARG 613 N 0.10 -0.40 -0.77 4.80 2.43 -1.06 -0.69 114.38 118.79 1k93 h ARG 613 Ca 0.05 0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.37 1k93 h ARG 613 Cb 0.11 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 1k93 h ARG 613 CO -0.01 -0.26 0.51 0.35 -1.51 0.00 0.00 179.97 179.05 1k93 h PHE 614 N -0.41 0.63 -0.32 2.20 3.57 -1.15 -1.87 116.94 119.59 1k93 h PHE 614 Ca 0.08 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.50 1k93 h PHE 614 Cb 0.53 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1k93 h PHE 614 CO -0.36 0.26 -0.16 0.82 -2.23 0.00 0.00 178.31 176.64 1k93 h ILE 615 N 0.56 1.29 -0.13 1.41 2.04 0.27 -2.62 117.51 120.34 1k93 h ILE 615 Ca 0.37 -1.28 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 1k93 h ILE 615 Cb 0.66 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 38.18 1k93 h ILE 615 CO -0.14 0.41 -0.02 1.05 0.00 0.00 0.00 178.15 179.45 1k93 h GLU 616 N 0.43 0.24 0.26 2.37 4.11 -0.87 0.18 114.58 121.30 1k93 h GLU 616 Ca 0.07 -0.09 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1k93 h GLU 616 Cb 0.70 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 1k93 h GLU 616 CO 0.05 0.52 -0.28 -0.22 0.07 0.00 0.00 179.01 179.15 1k93 h LYS 617 N -0.06 -0.56 0.00 1.06 3.64 -1.39 -2.03 116.57 117.23 1k93 h LYS 617 Ca 0.03 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1k93 h LYS 617 Cb 0.43 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1k93 h LYS 617 CO 0.01 -0.37 -0.73 0.09 -2.27 0.00 0.00 179.45 176.18 1k93 n ASN 618 N -5.40 0.65 0.00 4.20 3.02 -0.99 -4.55 115.26 112.19 1k93 n ASN 618 Ca -0.09 -0.41 0.00 0.00 -0.03 0.00 0.00 54.58 54.06 1k93 n ASN 618 Cb 0.31 0.53 0.00 0.00 -0.61 0.00 0.00 39.78 40.01 1k93 n ASN 618 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1k93 n ILE 619 N -1.61 0.00 0.00 2.41 5.41 0.54 -4.51 119.36 121.60 1k93 n ILE 619 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.79 1k93 n ILE 619 Cb 0.36 -0.29 0.00 0.00 -0.71 0.00 0.00 39.64 38.99 1k93 n ILE 619 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 1k93 n THR 620 N -0.81 0.90 -2.28 1.39 5.66 -0.66 0.14 114.28 118.62 1k93 n THR 620 Ca 0.00 0.38 -0.15 0.00 -3.05 0.00 0.00 64.05 61.23 1k93 n THR 620 Cb 0.00 -1.38 0.04 0.00 -1.55 0.00 0.00 70.33 67.43 1k93 n THR 620 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1k93 n GLY 621 N -1.18 4.82 0.70 1.09 0.00 -0.76 -4.81 105.19 105.05 1k93 n GLY 621 Ca 0.00 -2.09 -0.01 0.00 0.00 0.00 0.00 46.02 43.91 1k93 n GLY 621 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1k93 n LYS 622 N -0.67 0.00 -0.99 1.61 3.00 0.38 -4.74 118.16 116.74 1k93 n LYS 622 Ca 0.31 -0.57 0.00 0.00 -0.00 0.00 0.00 58.31 58.05 1k93 n LYS 622 Cb 0.91 0.03 0.00 0.00 0.00 0.00 0.00 35.03 35.97 1k93 n LYS 622 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1k93 n ASP 623 N 0.04 -1.18 -4.74 3.14 8.00 -1.25 -4.97 116.55 115.59 1k93 n ASP 623 Ca -0.06 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.06 1k93 n ASP 623 Cb 0.63 -0.20 -0.06 0.00 -0.02 0.00 0.00 41.12 41.48 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 -3.19 3.56 0.28 1.24 1.51 -1.25 -1.97 117.35 117.53 1k93 s TYR 624 Ca 0.00 0.97 -0.29 0.00 -1.01 0.00 0.00 57.07 56.73 1k93 s TYR 624 Cb 0.00 -2.55 -0.10 0.00 -0.11 0.00 0.00 41.96 39.20 1k93 s TYR 624 CO 0.00 0.24 1.28 -1.17 -1.11 0.00 0.00 175.55 174.78 1k93 s LEU 625 N 0.35 4.44 -0.04 -1.29 2.96 -0.37 -4.46 118.68 120.27 1k93 s LEU 625 Ca 0.27 2.53 -0.30 0.00 -0.22 0.00 0.00 54.13 56.42 1k93 s LEU 625 Cb -0.16 -3.63 0.08 0.00 0.50 0.00 0.00 46.19 42.98 1k93 s LEU 625 CO 0.12 -0.47 0.75 -0.47 -1.32 0.00 0.00 176.35 174.96 1k93 s TYR 626 N -0.73 -0.56 0.08 5.38 5.04 -1.26 -3.62 117.35 121.69 1k93 s TYR 626 Ca 0.51 0.85 -0.13 0.00 -2.44 0.00 0.00 57.07 55.86 1k93 s TYR 626 Cb -0.38 0.45 0.02 0.00 0.35 0.00 0.00 41.96 42.40 1k93 s TYR 626 CO 0.46 -0.58 0.30 1.52 -1.34 0.00 0.00 175.55 175.91 1k93 s TYR 627 N -1.66 -0.05 0.18 4.97 -0.85 -1.26 -5.01 117.35 113.66 1k93 s TYR 627 Ca -0.06 -0.24 0.11 0.00 -0.52 0.00 0.00 57.07 56.36 1k93 s TYR 627 Cb -0.00 0.10 -0.04 0.00 0.38 0.00 0.00 41.96 42.39 1k93 s TYR 627 CO 0.04 -0.58 -0.22 -0.59 -1.52 0.00 0.00 175.55 172.68 1k93 s PHE 628 N -3.39 2.37 -0.44 -3.49 -0.12 -1.26 -4.97 117.98 106.68 1k93 s PHE 628 Ca 0.01 -0.33 -0.42 0.00 -0.05 0.00 0.00 56.93 56.13 1k93 s PHE 628 Cb 0.02 -1.19 -0.17 0.00 -0.63 0.00 0.00 43.02 41.05 1k93 s PHE 628 CO -0.09 0.48 2.00 -1.71 -0.05 0.00 0.00 175.22 175.85 1k93 n ASN 629 N 0.33 1.32 0.00 1.98 4.05 -1.22 -4.73 115.26 116.99 1k93 n ASN 629 Ca -0.13 0.77 0.00 0.00 0.45 0.00 0.00 54.58 55.67 1k93 n ASN 629 Cb 0.55 -1.00 0.00 0.00 1.23 0.00 0.00 39.78 40.56 1k93 n ASN 629 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1k93 n ARG 630 N 6.72 0.00 -0.00 1.20 1.74 -1.26 -1.10 116.66 123.95 1k93 n ARG 630 Ca 0.44 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.63 1k93 n ARG 630 Cb 0.03 -1.35 -0.13 0.00 -1.02 0.00 0.00 32.46 30.00 1k93 n ARG 630 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1k93 n SER 631 N -0.82 0.61 -4.41 0.55 7.64 -1.26 -4.94 113.62 110.98 1k93 n SER 631 Ca 0.00 -0.58 -0.32 0.00 1.01 0.00 0.00 58.87 58.98 1k93 n SER 631 Cb 0.00 1.34 0.16 0.00 -1.01 0.00 0.00 64.21 64.69 1k93 n SER 631 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1k93 n TYR 632 N -1.80 -1.12 -3.50 1.43 0.53 -0.26 -2.76 117.16 109.67 1k93 n TYR 632 Ca 0.01 0.19 -0.24 0.00 -1.02 0.00 0.00 57.90 56.84 1k93 n TYR 632 Cb 0.42 -1.74 -0.02 0.00 -1.03 0.00 0.00 39.34 36.97 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 -2.19 -2.85 -3.65 7.72 3.02 0.33 -4.88 115.26 112.77 1k93 n ASN 633 Ca 0.05 -0.44 -0.10 0.00 -0.03 0.00 0.00 54.58 54.06 1k93 n ASN 633 Cb 0.56 -2.40 -0.03 0.00 -0.61 0.00 0.00 39.78 37.30 1k93 n ASN 633 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1k93 s LYS 634 N -6.13 1.43 -0.57 3.52 1.02 -1.11 -5.05 119.74 112.83 1k93 s LYS 634 Ca 0.44 -0.74 -0.25 0.00 0.02 0.00 0.00 55.97 55.44 1k93 s LYS 634 Cb -0.24 0.56 0.04 0.00 -0.52 0.00 0.00 37.83 37.67 1k93 s LYS 634 CO 0.54 -0.62 1.00 0.42 -0.92 0.00 0.00 175.35 175.77 1k93 s ILE 635 N -3.84 4.29 0.13 2.17 1.01 -1.26 -4.30 121.20 119.40 1k93 s ILE 635 Ca 0.06 0.36 -0.34 0.00 0.00 0.00 0.00 60.65 60.73 1k93 s ILE 635 Cb -0.02 -4.60 -0.14 0.00 0.01 0.00 0.00 42.46 37.71 1k93 s ILE 635 CO -0.05 -1.21 1.57 0.00 0.00 0.00 0.00 174.94 175.25 1k93 n ALA 636 N 7.74 0.98 -0.34 9.38 0.00 0.13 -4.84 120.51 133.55 1k93 n ALA 636 Ca 0.03 0.44 0.12 0.00 0.00 0.00 0.00 53.44 54.03 1k93 n ALA 636 Cb 0.48 -2.32 0.32 0.00 0.00 0.00 0.00 19.45 17.93 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 5.96 0.77 0.00 0.00 0.11 -1.77 0.21 132.00 137.28 1k93 h PRO 637 Ca -0.46 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1k93 h PRO 637 Cb 1.27 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1k93 h PRO 637 CO 0.88 0.51 -0.00 0.78 -0.21 0.00 0.00 178.00 179.95 1k93 h GLY 638 N 0.79 -0.01 0.94 -0.55 0.00 -1.33 -3.40 103.07 99.51 1k93 h GLY 638 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1k93 h GLY 638 CO -0.32 -0.00 -0.60 1.16 0.00 0.00 0.00 176.54 176.78 1k93 n ASN 639 N -2.07 0.56 -0.27 0.19 2.04 -0.64 -4.95 115.26 110.13 1k93 n ASN 639 Ca -0.00 -0.22 -0.03 0.00 -0.44 0.00 0.00 54.58 53.88 1k93 n ASN 639 Cb 0.00 0.33 -0.01 0.00 -2.53 0.00 0.00 39.78 37.57 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 -1.64 -0.23 -2.52 -3.83 4.76 0.73 -5.00 118.16 110.42 1k93 n LYS 640 Ca 0.05 0.57 -0.37 0.00 -2.87 0.00 0.00 58.31 55.68 1k93 n LYS 640 Cb 0.36 -4.21 -0.04 0.00 -1.84 0.00 0.00 35.03 29.30 1k93 n LYS 640 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1k93 s ALA 641 N -2.13 3.13 -0.48 7.82 0.00 -1.25 -4.53 121.76 124.32 1k93 s ALA 641 Ca 0.00 0.74 0.04 0.00 0.00 0.00 0.00 51.96 52.74 1k93 s ALA 641 Cb 0.00 -3.29 0.12 0.00 0.00 0.00 0.00 23.12 19.96 1k93 s ALA 641 CO 0.00 -0.22 0.22 -0.47 0.00 0.00 0.00 175.76 175.28 1k93 s TYR 642 N -1.57 3.33 -0.21 0.00 5.04 -1.26 0.17 117.35 122.85 1k93 s TYR 642 Ca 0.56 -3.11 -0.08 0.00 -2.44 0.00 0.00 57.07 52.00 1k93 s TYR 642 Cb -0.24 -2.86 -0.04 0.00 0.35 0.00 0.00 41.96 39.17 1k93 s TYR 642 CO 0.30 -0.80 0.08 0.42 -1.34 0.00 0.00 175.55 174.21 1k93 s ILE 643 N 0.01 4.70 -0.12 3.14 1.01 -1.26 -4.93 121.20 123.74 1k93 s ILE 643 Ca 0.15 -0.05 -0.08 0.00 0.00 0.00 0.00 60.65 60.67 1k93 s ILE 643 Cb -0.24 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 1k93 s ILE 643 CO -0.02 0.40 0.17 -1.61 0.00 0.00 0.00 174.94 173.88 1k93 s GLU 644 N 0.92 3.61 -0.02 2.79 2.02 -1.26 0.12 118.70 126.89 1k93 s GLU 644 Ca 0.04 -0.08 -0.08 0.00 0.02 0.00 0.00 54.97 54.88 1k93 s GLU 644 Cb -0.14 -3.23 0.01 0.00 0.10 0.00 0.00 34.13 30.87 1k93 s GLU 644 CO 0.03 0.69 0.16 -0.46 0.02 0.00 0.00 175.26 175.70 1k93 s TRP 645 N -0.80 -0.03 0.24 1.61 -0.11 -1.26 -4.90 118.94 113.68 1k93 s TRP 645 Ca 0.15 0.04 -0.30 0.00 1.22 0.00 0.00 56.10 57.22 1k93 s TRP 645 Cb -0.12 -0.01 -0.09 0.00 -1.50 0.00 0.00 33.47 31.75 1k93 s TRP 645 CO 0.04 -0.25 1.10 0.99 -4.62 0.00 0.00 176.95 174.21 1k93 s THR 646 N -1.02 3.65 -0.31 5.86 2.01 -1.26 -4.80 115.64 119.76 1k93 s THR 646 Ca -0.11 1.55 0.00 0.00 0.31 0.00 0.00 61.69 63.44 1k93 s THR 646 Cb -0.06 -3.99 0.10 0.00 0.01 0.00 0.00 72.50 68.56 1k93 s THR 646 CO 0.01 0.32 0.09 -0.62 -0.69 0.00 0.00 174.62 173.74 1k93 s ASP 647 N -0.55 4.14 0.44 3.53 2.15 -1.26 -5.03 116.67 120.09 1k93 s ASP 647 Ca 0.47 -1.71 0.26 0.00 0.43 0.00 0.00 52.55 52.00 1k93 s ASP 647 Cb -0.31 -1.00 1.31 0.00 -0.30 0.00 0.00 42.92 42.62 1k93 s ASP 647 CO 0.38 -0.41 1.71 -0.65 -0.17 0.00 0.00 175.17 176.04 1k93 h PRO 648 N 8.01 0.20 0.00 4.34 0.11 -1.97 0.64 132.00 143.33 1k93 h PRO 648 Ca -0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.98 1k93 h PRO 648 Cb 1.02 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1k93 h PRO 648 CO 0.48 0.13 0.08 -0.89 -0.21 0.00 0.00 178.00 177.59 1k93 n ILE 649 N -4.56 1.50 0.03 4.15 5.41 -1.26 0.70 119.36 125.32 1k93 n ILE 649 Ca 0.30 0.56 0.03 0.00 1.00 0.00 0.00 62.75 64.64 1k93 n ILE 649 Cb 1.17 -1.56 -0.04 0.00 -0.71 0.00 0.00 39.64 38.50 1k93 n ILE 649 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1k93 n THR 650 N -1.63 0.00 0.00 1.39 -1.04 0.22 -4.50 114.28 108.72 1k93 n THR 650 Ca -0.00 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1k93 n THR 650 Cb 0.09 0.46 0.00 0.00 -1.82 0.00 0.00 70.33 69.06 1k93 n THR 650 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1k93 n LYS 651 N -1.60 0.00 -0.71 -2.82 3.00 0.22 -2.63 118.16 113.61 1k93 n LYS 651 Ca -0.01 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.10 1k93 n LYS 651 Cb 0.12 -0.21 -0.02 0.00 0.00 0.00 0.00 35.03 34.92 1k93 n LYS 651 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1k93 n ALA 652 N -3.00 4.60 -2.27 3.14 0.00 -1.18 -4.67 120.51 117.12 1k93 n ALA 652 Ca 0.00 -1.89 -0.41 0.00 0.00 0.00 0.00 53.44 51.15 1k93 n ALA 652 Cb 0.00 -2.94 0.01 0.00 0.00 0.00 0.00 19.45 16.52 1k93 n ALA 652 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1k93 n LYS 653 N 4.11 4.86 -3.37 0.00 3.00 -1.08 -4.73 118.16 120.95 1k93 n LYS 653 Ca 0.42 -3.93 -0.27 0.00 -0.00 0.00 0.00 58.31 54.53 1k93 n LYS 653 Cb 0.15 -2.58 -0.08 0.00 0.00 0.00 0.00 35.03 32.52 1k93 n LYS 653 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.40 177.84 1k93 n ILE 654 N 1.15 2.06 -2.75 3.15 -5.35 -1.26 -5.04 119.36 111.31 1k93 n ILE 654 Ca 0.55 -5.11 0.00 0.00 -0.27 0.00 0.00 62.75 57.92 1k93 n ILE 654 Cb 0.26 -2.05 0.00 0.00 -1.74 0.00 0.00 39.64 36.11 1k93 n ILE 654 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1k93 n ASN 655 N 0.86 0.00 -3.22 7.28 5.03 -1.26 -4.13 115.26 119.81 1k93 n ASN 655 Ca 0.29 0.00 -0.01 0.00 0.87 0.00 0.00 54.58 55.73 1k93 n ASN 655 Cb 0.42 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.15 1k93 n ASN 655 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1k93 s THR 656 N -1.20 -0.84 0.25 3.41 -4.23 -1.26 -4.75 115.64 107.03 1k93 s THR 656 Ca 0.00 -0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 60.32 1k93 s THR 656 Cb 0.00 -0.96 -0.00 0.00 1.34 0.00 0.00 72.50 72.88 1k93 s THR 656 CO 0.00 -0.08 0.47 -0.51 -0.54 0.00 0.00 174.62 173.96 1k93 s ILE 657 N 2.72 0.00 1.18 2.99 2.07 -1.26 -4.92 121.20 123.97 1k93 s ILE 657 Ca 0.14 -1.43 -0.20 0.00 -1.41 0.00 0.00 60.65 57.75 1k93 s ILE 657 Cb -0.13 -2.26 0.30 0.00 0.13 0.00 0.00 42.46 40.50 1k93 s ILE 657 CO -0.23 0.00 0.75 -2.65 -1.91 0.00 0.00 174.94 170.90 1k93 n PRO 658 N -0.39 -4.11 -0.02 3.50 -0.02 -1.26 -5.23 135.00 127.47 1k93 n PRO 658 Ca -0.01 -1.24 -0.01 0.00 -2.02 0.00 0.00 63.50 60.22 1k93 n PRO 658 Cb 0.62 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 1k93 n PRO 658 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1k93 n SER 693 N -5.20 -0.07 -2.72 2.55 3.41 -1.26 -5.32 113.62 105.01 1k93 n SER 693 Ca 0.12 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.70 1k93 n SER 693 Cb 0.49 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 1k93 n SER 693 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1k93 n VAL 694 N -0.07-11.24 -3.78 -3.33 0.31 -1.26 -4.98 118.33 93.98 1k93 n VAL 694 Ca -0.00 2.11 -0.37 0.00 -0.01 0.00 0.00 64.34 66.07 1k93 n VAL 694 Cb 0.01 -6.28 -0.12 0.00 -0.91 0.00 0.00 33.84 26.54 1k93 n VAL 694 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1k93 s LYS 695 N -1.06 2.43 0.00 5.55 2.20 -1.26 -4.80 119.74 122.80 1k93 s LYS 695 Ca -0.13 -1.38 0.00 0.00 -0.36 0.00 0.00 55.97 54.10 1k93 s LYS 695 Cb 0.01 -3.44 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 1k93 s LYS 695 CO 0.70 -0.78 0.00 1.17 -0.36 0.00 0.00 175.35 176.09 1k93 n LYS 696 N 4.72 0.00 0.28 4.03 4.81 -1.26 -4.85 118.16 125.90 1k93 n LYS 696 Ca -0.10 0.00 0.16 0.00 -0.87 0.00 0.00 58.31 57.50 1k93 n LYS 696 Cb 0.43 -0.06 0.78 0.00 0.02 0.00 0.00 35.03 36.20 1k93 n LYS 696 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1k93 h ILE 697 N 0.00 0.21 -3.30 3.15 1.08 -1.94 -3.43 117.51 113.28 1k93 h ILE 697 Ca 0.00 -0.49 -0.65 0.00 -0.39 0.00 0.00 64.86 63.33 1k93 h ILE 697 Cb 0.00 1.40 -0.12 0.00 -3.07 0.00 0.00 36.82 35.03 1k93 h ILE 697 CO 0.00 0.06 -0.64 0.00 -0.69 0.00 0.00 178.15 176.88 1k93 s ALA 698 N -3.89 3.37 0.00 1.87 0.00 -1.26 -5.00 121.76 116.85 1k93 s ALA 698 Ca -0.01 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.92 1k93 s ALA 698 Cb 0.11 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.91 1k93 s ALA 698 CO 0.54 0.70 0.00 0.41 0.00 0.00 0.00 175.76 177.40 1k93 n GLY 699 N 0.83 0.38 3.43 0.00 0.00 -1.26 -4.89 105.19 103.68 1k93 n GLY 699 Ca -0.11 -2.27 -0.43 0.00 0.00 0.00 0.00 46.02 43.20 1k93 n GLY 699 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1k93 n TYR 700 N 0.80 4.69 -2.59 1.61 4.02 -1.26 -4.63 117.16 119.80 1k93 n TYR 700 Ca 0.00 -3.14 -0.04 0.00 -0.01 0.00 0.00 57.90 54.71 1k93 n TYR 700 Cb 0.00 -2.33 0.05 0.00 -0.02 0.00 0.00 39.34 37.03 1k93 n TYR 700 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1k93 n LEU 701 N 6.42 2.17 0.00 7.72 4.32 -1.26 -4.86 117.00 131.51 1k93 n LEU 701 Ca 0.42 -3.24 0.00 0.00 -0.02 0.00 0.00 56.01 53.17 1k93 n LEU 701 Cb 0.43 0.22 0.00 0.00 -1.62 0.00 0.00 43.42 42.45 1k93 n LEU 701 CO 0.69 1.17 0.00 -1.54 -1.22 0.00 0.00 177.39 176.50 1k93 n SER 702 N -0.49 0.00 -0.95 -1.43 3.41 -1.26 -4.88 113.62 108.02 1k93 n SER 702 Ca 0.14 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1k93 n SER 702 Cb 0.88 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.82 1k93 n SER 702 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1k93 n ASP 703 N 0.00 0.11 -0.15 4.04 5.68 -1.26 -4.97 116.55 120.00 1k93 n ASP 703 Ca 0.00 -1.83 0.11 0.00 -0.50 0.00 0.00 54.79 52.57 1k93 n ASP 703 Cb 0.00 -0.08 0.20 0.00 -1.14 0.00 0.00 41.12 40.10 1k93 n ASP 703 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1k93 n TYR 704 N 0.17 0.41 -2.41 2.11 9.36 -1.26 -1.56 117.16 123.97 1k93 n TYR 704 Ca -0.04 0.54 -0.43 0.00 3.32 0.00 0.00 57.90 61.29 1k93 n TYR 704 Cb 0.82 -0.91 0.00 0.00 -0.63 0.00 0.00 39.34 38.62 1k93 n TYR 704 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1k93 n TYR 705 N -4.25 3.13 -2.42 2.98 4.02 -1.26 -4.97 117.16 114.40 1k93 n TYR 705 Ca 0.14 -2.84 -0.43 0.00 -0.01 0.00 0.00 57.90 54.75 1k93 n TYR 705 Cb 0.46 -1.96 -0.02 0.00 -0.02 0.00 0.00 39.34 37.81 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 1.00 6.42 0.13 7.72 3.84 -0.60 -4.91 114.94 128.54 1k93 s ASN 706 Ca 0.40 0.72 -0.30 0.00 0.21 0.00 0.00 52.86 53.88 1k93 s ASN 706 Cb 0.08 -2.54 -0.09 0.00 -0.55 0.00 0.00 41.25 38.15 1k93 s ASN 706 CO 0.01 -1.39 1.51 -1.28 -2.79 0.00 0.00 177.10 173.16 1k93 h SER 707 N 10.30 -1.87 0.00 -4.21 0.87 -1.93 -3.18 113.55 113.53 1k93 h SER 707 Ca -0.26 0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1k93 h SER 707 Cb 1.09 0.80 0.00 0.00 -0.44 0.00 0.00 62.40 63.85 1k93 h SER 707 CO 1.10 -0.31 0.75 0.00 -0.53 0.00 0.00 176.83 177.84 1k93 n ALA 708 N -3.13 0.83 0.00 6.23 0.00 -1.26 -3.83 120.51 119.35 1k93 n ALA 708 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1k93 n ALA 708 Cb 0.29 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.69 1k93 n ALA 708 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1k93 n ASN 709 N 4.22 0.06 0.00 0.00 2.85 -1.20 -4.60 115.26 116.60 1k93 n ASN 709 Ca 0.00 -0.29 0.04 0.00 -0.11 0.00 0.00 54.58 54.22 1k93 n ASN 709 Cb 0.00 0.59 0.18 0.00 1.24 0.00 0.00 39.78 41.78 1k93 n ASN 709 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1k93 n HIS 710 N -0.59 0.00 -0.08 1.20 1.44 -1.25 -1.79 115.22 114.15 1k93 n HIS 710 Ca 0.00 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.48 1k93 n HIS 710 Cb 0.00 -0.48 -0.12 0.00 0.12 0.00 0.00 29.99 29.51 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 -1.48 1.61 -1.79 0.61 -5.35 -1.26 -4.68 119.36 107.02 1k93 n ILE 711 Ca 0.02 -0.32 -0.22 0.00 -0.27 0.00 0.00 62.75 61.96 1k93 n ILE 711 Cb 0.09 -1.87 -0.09 0.00 -1.74 0.00 0.00 39.64 36.03 1k93 n ILE 711 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1k93 n PHE 712 N -4.01 1.81 0.00 4.28 3.01 -0.74 -4.87 117.46 116.94 1k93 n PHE 712 Ca -0.36 -0.84 0.00 0.00 1.01 0.00 0.00 57.45 57.26 1k93 n PHE 712 Cb 0.85 -2.57 0.00 0.00 -0.01 0.00 0.00 39.48 37.75 1k93 n PHE 712 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1k93 n SER 713 N 16.88 0.00 -0.31 4.37 3.41 -1.26 -3.17 113.62 133.55 1k93 n SER 713 Ca 0.43 0.00 0.25 0.00 -0.26 0.00 0.00 58.87 59.29 1k93 n SER 713 Cb 0.47 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 64.87 1k93 n SER 713 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k93 n GLN 714 N 0.00 -0.06 -0.15 4.33 -0.00 -1.26 0.19 117.38 120.42 1k93 n GLN 714 Ca 0.00 1.32 -0.01 0.00 -0.00 0.00 0.00 57.00 58.31 1k93 n GLN 714 Cb 0.00 -2.28 0.24 0.00 -0.00 0.00 0.00 30.24 28.21 1k93 n GLN 714 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1k93 h GLU 715 N 0.00 0.86 -0.31 2.61 5.08 -2.01 -2.49 114.58 118.32 1k93 h GLU 715 Ca 0.72 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.86 1k93 h GLU 715 Cb 1.79 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.86 1k93 h GLU 715 CO -0.77 0.66 -0.25 -0.22 -1.00 0.00 0.00 179.01 177.44 1k93 h LYS 716 N 0.86 0.72 0.07 2.33 3.64 0.19 -2.73 116.57 121.65 1k93 h LYS 716 Ca 0.21 -0.36 0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1k93 h LYS 716 Cb 0.08 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.85 1k93 h LYS 716 CO -0.03 0.97 -0.35 0.87 -2.27 0.00 0.00 179.45 178.64 1k93 h LYS 717 N 0.48 -0.53 -0.51 1.90 1.57 -0.98 2.01 116.57 120.49 1k93 h LYS 717 Ca 0.06 0.04 0.15 0.00 -1.87 0.00 0.00 60.65 59.02 1k93 h LYS 717 Cb 0.81 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 1k93 h LYS 717 CO 0.06 -0.36 0.40 0.00 -0.57 0.00 0.00 179.45 178.99 1k93 h ARG 718 N -0.55 0.00 0.05 3.15 3.08 -1.50 0.48 114.38 119.08 1k93 h ARG 718 Ca 0.04 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 1k93 h ARG 718 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1k93 h ARG 718 CO -0.24 0.00 -0.02 -0.22 -1.07 0.00 0.00 179.97 178.42 1k93 h LYS 719 N 0.00 -0.06 0.00 0.04 3.64 0.16 -3.22 116.57 117.12 1k93 h LYS 719 Ca 0.24 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1k93 h LYS 719 Cb 1.04 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1k93 h LYS 719 CO -0.00 -0.04 0.00 0.44 -2.27 0.00 0.00 179.45 177.58 1k93 n ILE 720 N -4.51 0.73 -0.05 2.00 -5.35 0.63 -3.35 119.36 109.46 1k93 n ILE 720 Ca -0.01 0.18 -0.00 0.00 -0.27 0.00 0.00 62.75 62.65 1k93 n ILE 720 Cb 0.02 -0.89 -0.00 0.00 -1.74 0.00 0.00 39.64 37.03 1k93 n ILE 720 CO 0.00 0.00 0.00 -1.28 -1.76 0.00 0.00 176.55 173.51 1k93 h SER 721 N 0.00 0.00 -1.14 7.28 0.87 -0.18 -3.05 113.55 117.32 1k93 h SER 721 Ca 0.00 -0.00 0.32 0.00 -1.23 0.00 0.00 61.79 60.88 1k93 h SER 721 Cb 0.25 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 62.13 1k93 h SER 721 CO 0.00 0.52 0.77 0.40 -0.53 0.00 0.00 176.83 177.99 1k93 h ILE 722 N -1.00 0.43 -0.05 2.23 2.04 -1.56 0.13 117.51 119.72 1k93 h ILE 722 Ca -0.00 -0.07 -0.14 0.00 1.00 0.00 0.00 64.86 65.65 1k93 h ILE 722 Cb 0.04 0.21 0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1k93 h ILE 722 CO -0.00 0.04 -0.51 0.15 0.00 0.00 0.00 178.15 177.82 1k93 h PHE 723 N 0.20 0.61 -0.79 1.37 3.57 -1.68 0.37 116.94 120.59 1k93 h PHE 723 Ca 0.61 -0.30 0.02 0.00 3.53 0.00 0.00 57.97 61.83 1k93 h PHE 723 Cb 1.96 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 40.57 1k93 h PHE 723 CO -0.00 1.09 0.52 0.00 -2.23 0.00 0.00 178.31 177.69 1k93 h ARG 724 N -0.04 1.00 -0.01 1.11 2.47 -0.92 1.82 114.38 119.81 1k93 h ARG 724 Ca -0.05 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.61 1k93 h ARG 724 Cb 1.19 -0.23 -0.00 0.00 -1.65 0.00 0.00 29.97 29.29 1k93 h ARG 724 CO 0.10 0.66 -0.00 0.78 0.56 0.00 0.00 179.97 182.07 1k93 h GLY 725 N 1.03 0.02 1.93 0.04 0.00 -1.11 -0.87 103.07 104.10 1k93 h GLY 725 Ca 0.30 -0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.52 1k93 h GLY 725 CO -0.07 0.01 -0.43 -2.22 0.00 0.00 0.00 176.54 173.83 1k93 h ILE 726 N -0.38 1.31 -0.85 2.60 2.04 -0.37 1.73 117.51 123.59 1k93 h ILE 726 Ca 0.00 -1.51 -0.03 0.00 1.00 0.00 0.00 64.86 64.32 1k93 h ILE 726 Cb 0.41 1.77 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 1k93 h ILE 726 CO 0.00 0.44 0.41 -0.61 0.00 0.00 0.00 178.15 178.39 1k93 h GLN 727 N 0.07 1.22 0.00 2.37 -0.00 0.29 -0.47 115.11 118.59 1k93 h GLN 727 Ca 0.00 -0.18 -0.11 0.00 -0.00 0.00 0.00 58.65 58.36 1k93 h GLN 727 Cb 0.79 -0.22 -0.02 0.00 0.00 0.00 0.00 27.48 28.03 1k93 h GLN 727 CO 0.06 0.93 -0.61 0.00 0.00 0.00 0.00 178.83 179.22 1k93 h ALA 728 N 1.24 0.66 0.00 3.38 0.00 -0.17 0.12 119.26 124.49 1k93 h ALA 728 Ca 0.29 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1k93 h ALA 728 Cb 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1k93 h ALA 728 CO -0.04 0.66 0.33 0.98 0.00 0.00 0.00 179.25 181.18 1k93 n TYR 729 N -3.19 0.43 -1.99 0.00 4.19 0.58 -2.44 117.16 114.74 1k93 n TYR 729 Ca 0.01 0.23 0.00 0.00 3.31 0.00 0.00 57.90 61.44 1k93 n TYR 729 Cb 0.75 -0.64 0.00 0.00 0.49 0.00 0.00 39.34 39.93 1k93 n TYR 729 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 1k93 n ASN 730 N -2.05 0.00 -0.33 2.98 4.05 -1.18 -4.65 115.26 114.08 1k93 n ASN 730 Ca -0.01 -1.00 0.14 0.00 0.45 0.00 0.00 54.58 54.16 1k93 n ASN 730 Cb 0.35 -0.00 0.28 0.00 1.23 0.00 0.00 39.78 41.63 1k93 n ASN 730 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 177.26 172.37 1k93 n GLU 731 N 0.00 -0.08 -0.16 1.20 0.28 0.02 -3.29 120.64 118.63 1k93 n GLU 731 Ca 0.00 1.44 0.00 0.00 -0.16 0.00 0.00 57.16 58.44 1k93 n GLU 731 Cb 0.50 -2.28 0.00 0.00 1.43 0.00 0.00 31.44 31.09 1k93 n GLU 731 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1k93 n ILE 732 N -5.43 0.00 -0.01 3.84 5.41 -1.26 -4.97 119.36 116.93 1k93 n ILE 732 Ca 0.22 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.86 1k93 n ILE 732 Cb 0.73 0.00 -0.07 0.00 -0.71 0.00 0.00 39.64 39.60 1k93 n ILE 732 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1k93 h GLU 733 N 0.00 0.13 0.00 0.38 4.81 -1.77 -2.51 114.58 115.62 1k93 h GLU 733 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1k93 h GLU 733 Cb 0.98 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.34 1k93 h GLU 733 CO 0.00 0.28 0.00 -1.71 -0.73 0.00 0.00 179.01 176.85 1k93 n ASN 734 N -4.92 0.00 -0.94 1.04 2.85 -1.26 -3.16 115.26 108.87 1k93 n ASN 734 Ca -0.06 -0.26 0.00 0.00 -0.11 0.00 0.00 54.58 54.15 1k93 n ASN 734 Cb 0.13 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.15 1k93 n ASN 734 CO 0.00 0.00 0.00 0.55 -2.11 0.00 0.00 177.26 175.70 1k93 n VAL 735 N -0.62 0.60 0.13 3.44 3.14 -0.95 -4.26 118.33 119.82 1k93 n VAL 735 Ca 0.01 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.34 1k93 n VAL 735 Cb 0.00 -0.78 -0.02 0.00 -1.06 0.00 0.00 33.84 31.98 1k93 n VAL 735 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1k93 h LEU 736 N 1.21 -0.29 -0.39 6.55 3.38 -1.83 -3.06 115.31 120.88 1k93 h LEU 736 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1k93 h LEU 736 Cb 0.64 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1k93 h LEU 736 CO 0.00 -0.20 0.00 0.29 0.09 0.00 0.00 178.44 178.62 1k93 n LYS 737 N -2.96 1.09 0.00 1.13 4.76 -1.26 -4.25 118.16 116.66 1k93 n LYS 737 Ca -0.04 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.29 1k93 n LYS 737 Cb 0.13 -1.17 0.00 0.00 -1.84 0.00 0.00 35.03 32.16 1k93 n LYS 737 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1k93 n SER 738 N -0.29 0.00 -0.21 4.39 2.88 -1.16 -4.75 113.62 114.48 1k93 n SER 738 Ca 0.01 0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 1k93 n SER 738 Cb 0.10 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 1k93 n SER 738 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1k93 n LYS 739 N -1.55 0.00 -2.13 -1.46 5.02 -1.26 -5.02 118.16 111.76 1k93 n LYS 739 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 1k93 n LYS 739 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 34.96 1k93 n LYS 739 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1k93 s GLN 740 N 0.37 2.68 -0.25 1.97 2.00 -1.26 -4.90 119.66 120.27 1k93 s GLN 740 Ca 0.00 -1.09 -0.23 0.00 -2.00 0.00 0.00 55.36 52.04 1k93 s GLN 740 Cb 0.00 -5.24 -0.01 0.00 0.80 0.00 0.00 33.01 28.56 1k93 s GLN 740 CO 0.00 -3.65 0.76 0.42 -0.50 0.00 0.00 175.29 172.31 1k93 s ILE 741 N 10.01 4.88 0.00 -2.34 1.01 -1.26 -4.99 121.20 128.52 1k93 s ILE 741 Ca 0.67 1.38 -0.26 0.00 0.00 0.00 0.00 60.65 62.44 1k93 s ILE 741 Cb -0.01 -4.06 -0.13 0.00 0.01 0.00 0.00 42.46 38.27 1k93 s ILE 741 CO 0.09 -0.06 0.68 0.00 0.00 0.00 0.00 174.94 175.66 1k93 n ALA 742 N 5.92 -2.53 -0.19 9.38 0.00 -1.26 -4.58 120.51 127.26 1k93 n ALA 742 Ca 0.03 0.38 0.26 0.00 0.00 0.00 0.00 53.44 54.11 1k93 n ALA 742 Cb 0.48 -1.13 0.67 0.00 0.00 0.00 0.00 19.45 19.46 1k93 n ALA 742 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1k93 h PRO 743 N 1.90 0.10 0.00 0.00 0.11 -1.99 0.15 132.00 132.26 1k93 h PRO 743 Ca -0.32 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 1k93 h PRO 743 Cb 0.92 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1k93 h PRO 743 CO 0.42 0.07 -0.26 0.93 -0.21 0.00 0.00 178.00 178.95 1k93 h GLU 744 N 0.10 0.00 0.06 1.05 4.39 -1.98 0.30 114.58 118.51 1k93 h GLU 744 Ca 0.43 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 60.05 1k93 h GLU 744 Cb 1.54 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.20 1k93 h GLU 744 CO -0.05 0.26 -0.34 1.88 -1.16 0.00 0.00 179.01 179.60 1k93 h TYR 745 N 0.00 0.23 0.61 4.33 -1.99 -1.05 -3.23 116.97 115.87 1k93 h TYR 745 Ca -0.00 -0.17 -0.03 0.00 2.00 0.00 0.00 58.73 60.53 1k93 h TYR 745 Cb 0.91 -0.01 0.01 0.00 2.00 0.00 0.00 36.73 39.63 1k93 h TYR 745 CO 0.00 1.12 -0.29 -0.22 -0.00 0.00 0.00 178.16 178.77 1k93 h LYS 746 N -0.72 -0.79 -0.76 4.88 3.64 -1.33 0.12 116.57 121.61 1k93 h LYS 746 Ca -0.06 0.05 0.22 0.00 -1.27 0.00 0.00 60.65 59.60 1k93 h LYS 746 Cb 1.26 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 33.22 1k93 h LYS 746 CO 0.06 -0.53 0.99 -0.97 -2.27 0.00 0.00 179.45 176.74 1k93 h ASN 747 N -0.99 0.00 0.00 4.20 -0.73 -0.58 1.19 115.58 118.67 1k93 h ASN 747 Ca -0.08 0.00 -0.08 0.00 1.87 0.00 0.00 56.30 58.01 1k93 h ASN 747 Cb 0.63 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.21 1k93 h ASN 747 CO 0.14 0.00 -0.82 0.00 -0.37 0.00 0.00 177.43 176.38 1k93 n TYR 748 N -3.26 0.83 0.14 0.67 9.36 -1.10 -1.04 117.16 122.76 1k93 n TYR 748 Ca 0.17 0.36 0.09 0.00 3.32 0.00 0.00 57.90 61.83 1k93 n TYR 748 Cb 1.23 -0.84 0.47 0.00 -0.63 0.00 0.00 39.34 39.58 1k93 n TYR 748 CO 0.00 0.00 0.00 1.19 0.22 0.00 0.00 176.86 178.27 1k93 n PHE 749 N -4.54 0.59 -0.09 2.98 0.99 0.40 0.25 117.46 118.04 1k93 n PHE 749 Ca -0.16 0.31 -0.14 0.00 -0.00 0.00 0.00 57.45 57.46 1k93 n PHE 749 Cb 0.41 -0.99 -0.06 0.00 -1.00 0.00 0.00 39.48 37.84 1k93 n PHE 749 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.76 177.70 1k93 n GLN 750 N -2.11 0.52 -0.08 -1.08 0.00 0.40 -3.88 117.38 111.14 1k93 n GLN 750 Ca -0.01 0.49 -0.07 0.00 -0.00 0.00 0.00 57.00 57.41 1k93 n GLN 750 Cb 0.03 -1.67 -0.00 0.00 0.00 0.00 0.00 30.24 28.60 1k93 n GLN 750 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.06 176.14 1k93 h TYR 751 N -1.00 -0.48 -0.99 3.69 3.20 0.70 0.65 116.97 122.74 1k93 h TYR 751 Ca -0.20 0.04 0.33 0.00 3.14 0.00 0.00 58.73 62.03 1k93 h TYR 751 Cb 0.97 0.26 -0.18 0.00 1.54 0.00 0.00 36.73 39.32 1k93 h TYR 751 CO -0.11 -0.27 0.24 1.25 -1.64 0.00 0.00 178.16 177.63 1k93 h LEU 752 N -0.15 -0.15 0.29 2.82 6.46 0.31 1.31 115.31 126.20 1k93 h LEU 752 Ca 0.16 0.27 -0.01 0.00 -0.12 0.00 0.00 57.88 58.19 1k93 h LEU 752 Cb 0.40 0.39 -0.01 0.00 -0.73 0.00 0.00 40.66 40.72 1k93 h LEU 752 CO -0.41 -0.38 -0.19 0.50 -0.62 0.00 0.00 178.44 177.34 1k93 h LYS 753 N 0.02 -0.45 -1.72 1.25 3.64 -0.99 -1.03 116.57 117.28 1k93 h LYS 753 Ca 0.70 0.03 0.51 0.00 -1.27 0.00 0.00 60.65 60.61 1k93 h LYS 753 Cb 1.62 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 33.47 1k93 h LYS 753 CO -0.85 -0.30 1.23 0.93 -2.27 0.00 0.00 179.45 178.18 1k93 h GLU 754 N -0.47 0.01 0.05 1.90 5.08 0.21 0.38 114.58 121.74 1k93 h GLU 754 Ca -0.03 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1k93 h GLU 754 Cb 0.40 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1k93 h GLU 754 CO 0.02 0.01 -0.02 0.00 -1.00 0.00 0.00 179.01 178.01 1k93 h ARG 755 N 0.01 -0.07 -1.45 2.33 3.08 -0.49 -3.30 114.38 114.50 1k93 h ARG 755 Ca 0.84 0.00 0.46 0.00 0.07 0.00 0.00 59.98 61.36 1k93 h ARG 755 Cb 3.30 0.02 -0.12 0.00 0.08 0.00 0.00 29.97 33.24 1k93 h ARG 755 CO -0.05 -0.04 0.96 0.82 -1.07 0.00 0.00 179.97 180.59 1k93 h ILE 756 N -0.78 0.10 0.57 2.04 2.04 0.58 0.13 117.51 122.18 1k93 h ILE 756 Ca -0.01 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 1k93 h ILE 756 Cb 0.05 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.17 1k93 h ILE 756 CO 0.01 0.01 -0.32 0.74 0.00 0.00 0.00 178.15 178.59 1k93 h THR 757 N 0.05 0.00 0.12 -0.27 2.02 -0.94 -1.86 112.91 112.03 1k93 h THR 757 Ca 0.84 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 68.01 1k93 h THR 757 Cb 2.82 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 1k93 h THR 757 CO -0.33 0.00 -0.06 0.78 0.37 0.00 0.00 175.52 176.28 1k93 h ASN 758 N -0.83 -0.14 -0.96 4.18 2.35 -1.01 0.42 115.58 119.60 1k93 h ASN 758 Ca -0.08 -0.21 0.29 0.00 -0.55 0.00 0.00 56.30 55.75 1k93 h ASN 758 Cb 0.65 0.04 -0.17 0.00 0.05 0.00 0.00 38.32 38.89 1k93 h ASN 758 CO 0.10 0.14 0.23 -0.61 -1.65 0.00 0.00 177.43 175.64 1k93 h GLN 759 N -0.42 0.08 0.11 0.81 4.15 -0.93 0.56 115.11 119.48 1k93 h GLN 759 Ca -0.02 -0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.23 1k93 h GLN 759 Cb 0.34 -0.02 0.02 0.00 0.21 0.00 0.00 27.48 28.03 1k93 h GLN 759 CO 0.03 0.05 -0.74 0.28 -1.93 0.00 0.00 178.83 176.52 1k93 h VAL 760 N 0.08 1.51 -0.96 2.39 2.07 -1.19 -3.32 116.25 116.84 1k93 h VAL 760 Ca 0.65 -2.45 0.14 0.00 0.82 0.00 0.00 66.70 65.85 1k93 h VAL 760 Cb 1.44 3.12 -0.08 0.00 -1.52 0.00 0.00 31.29 34.25 1k93 h VAL 760 CO -0.79 0.69 0.61 -0.61 0.02 0.00 0.00 177.57 177.49 1k93 h GLN 761 N -0.36 0.82 -0.51 1.57 5.75 0.36 0.02 115.11 122.76 1k93 h GLN 761 Ca -0.12 -0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.37 1k93 h GLN 761 Cb 1.56 -0.19 -0.04 0.00 1.07 0.00 0.00 27.48 29.88 1k93 h GLN 761 CO 0.14 0.55 0.27 1.25 -2.65 0.00 0.00 178.83 178.39 1k93 h LEU 762 N 0.85 0.41 -0.14 -2.39 5.85 -0.18 4.27 115.31 123.97 1k93 h LEU 762 Ca 0.49 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 59.21 1k93 h LEU 762 Cb 0.63 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1k93 h LEU 762 CO -0.26 0.28 0.01 -0.07 -0.34 0.00 0.00 178.44 178.07 1k93 h LEU 763 N 0.53 0.24 0.36 2.25 3.38 -1.38 1.32 115.31 122.01 1k93 h LEU 763 Ca 0.22 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1k93 h LEU 763 Cb 0.11 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1k93 h LEU 763 CO -0.14 0.47 -0.19 -0.07 0.09 0.00 0.00 178.44 178.59 1k93 h LEU 764 N 0.00 -0.48 -1.89 1.67 3.38 -0.34 -1.66 115.31 115.99 1k93 h LEU 764 Ca 0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1k93 h LEU 764 Cb 0.34 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1k93 h LEU 764 CO 0.01 -0.31 0.28 0.71 0.09 0.00 0.00 178.44 179.21 1k93 h THR 765 N -0.51 0.00 0.40 0.22 1.35 0.83 0.41 112.91 115.61 1k93 h THR 765 Ca -0.05 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.80 1k93 h THR 765 Cb 0.40 0.63 -0.03 0.00 -1.73 0.00 0.00 68.15 67.42 1k93 h THR 765 CO 0.07 0.00 -0.50 -0.74 -0.25 0.00 0.00 175.52 174.10 1k93 h HIS 766 N 0.00 -1.39 -1.66 4.73 6.17 0.27 -3.39 115.15 119.88 1k93 h HIS 766 Ca 0.00 0.02 -0.19 0.00 0.71 0.00 0.00 60.37 60.90 1k93 h HIS 766 Cb 0.55 0.56 -0.28 0.00 2.52 0.00 0.00 27.41 30.76 1k93 h HIS 766 CO 0.00 -0.63 -0.54 -1.14 0.71 0.00 0.00 177.93 176.32 1k93 s GLN 767 N -5.72 0.47 0.00 5.26 2.00 0.64 -5.07 119.66 117.25 1k93 s GLN 767 Ca -0.17 0.00 0.00 0.00 -2.00 0.00 0.00 55.36 53.20 1k93 s GLN 767 Cb 0.04 -0.30 0.00 0.00 0.80 0.00 0.00 33.01 33.55 1k93 s GLN 767 CO 0.58 -1.07 0.00 1.17 -0.50 0.00 0.00 175.29 175.47 1k93 n LYS 768 N 5.17 3.11 -0.03 1.67 3.00 0.11 -4.74 118.16 126.44 1k93 n LYS 768 Ca 0.03 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.31 1k93 n LYS 768 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.52 1k93 n LYS 768 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1k93 n PHE 773 N 0.00 0.22 0.15 5.64 0.99 -1.26 -5.04 117.46 118.16 1k93 n PHE 773 Ca 0.00 0.10 0.05 0.00 -0.00 0.00 0.00 57.45 57.60 1k93 n PHE 773 Cb 0.00 -0.35 0.29 0.00 -1.00 0.00 0.00 39.48 38.42 1k93 n PHE 773 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 1k93 n LYS 774 N -3.23 0.07 -0.28 -1.08 3.00 -1.26 0.38 118.16 115.76 1k93 n LYS 774 Ca -0.04 0.53 0.10 0.00 -0.00 0.00 0.00 58.31 58.90 1k93 n LYS 774 Cb 0.15 -2.08 0.25 0.00 0.00 0.00 0.00 35.03 33.34 1k93 n LYS 774 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1k93 h LEU 775 N 0.00 -0.09 -5.36 3.14 -0.00 -2.07 -3.38 115.31 107.55 1k93 h LEU 775 Ca 0.00 0.19 0.20 0.00 -0.00 0.00 0.00 57.88 58.28 1k93 h LEU 775 Cb 0.67 0.28 -0.17 0.00 -0.00 0.00 0.00 40.66 41.44 1k93 h LEU 775 CO 0.00 -0.15 0.01 -0.76 -0.00 0.00 0.00 178.44 177.54 1k93 s LEU 776 N -10.69 -0.06 0.00 1.67 1.43 0.16 -4.98 118.68 106.22 1k93 s LEU 776 Ca -0.12 -0.02 0.17 0.00 -1.03 0.00 0.00 54.13 53.13 1k93 s LEU 776 Cb 0.25 0.40 0.05 0.00 0.03 0.00 0.00 46.19 46.91 1k93 s LEU 776 CO 0.77 -0.01 0.95 0.00 0.23 0.00 0.00 176.35 178.28 1k93 n TYR 777 N 4.04 0.00 0.14 0.29 9.36 -0.51 -4.22 117.16 126.26 1k93 n TYR 777 Ca 0.06 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.30 1k93 n TYR 777 Cb 0.63 0.00 0.10 0.00 -0.63 0.00 0.00 39.34 39.44 1k93 n TYR 777 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 1k93 h LYS 778 N 2.46 0.00 0.00 2.98 1.57 -1.91 -2.92 116.57 118.75 1k93 h LYS 778 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1k93 h LYS 778 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1k93 h LYS 778 CO 0.00 0.58 0.00 1.04 -0.57 0.00 0.00 179.45 180.50 1k93 n GLN 779 N -3.40 0.23 -3.95 3.15 6.02 -1.26 -4.43 117.38 113.75 1k93 n GLN 779 Ca 0.01 0.10 -0.35 0.00 -0.01 0.00 0.00 57.00 56.75 1k93 n GLN 779 Cb 0.70 -1.50 -0.14 0.00 1.02 0.00 0.00 30.24 30.32 1k93 n GLN 779 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1k93 s LEU 780 N -2.29 2.86 -0.69 1.08 1.43 -1.10 -4.95 118.68 115.02 1k93 s LEU 780 Ca 0.12 -0.54 0.05 0.00 -1.03 0.00 0.00 54.13 52.73 1k93 s LEU 780 Cb 0.07 -1.68 0.17 0.00 0.03 0.00 0.00 46.19 44.77 1k93 s LEU 780 CO 0.13 -0.04 0.48 0.21 0.23 0.00 0.00 176.35 177.36 1k93 s ASN 781 N 1.42 4.67 -0.64 2.29 3.84 -1.26 -5.01 114.94 120.25 1k93 s ASN 781 Ca 0.04 -3.79 -0.28 0.00 0.21 0.00 0.00 52.86 49.05 1k93 s ASN 781 Cb -0.15 -1.59 0.03 0.00 -0.55 0.00 0.00 41.25 39.00 1k93 s ASN 781 CO -0.05 -0.09 1.23 -0.36 -2.79 0.00 0.00 177.10 175.04 1k93 s PHE 782 N -1.35 2.47 0.00 0.43 0.40 -1.26 -4.48 117.98 114.19 1k93 s PHE 782 Ca 0.25 0.23 0.00 0.00 -0.60 0.00 0.00 56.93 56.81 1k93 s PHE 782 Cb -0.05 -4.56 0.00 0.00 0.51 0.00 0.00 43.02 38.92 1k93 s PHE 782 CO -0.16 -1.79 0.00 0.25 0.70 0.00 0.00 175.22 174.22 1k93 n THR 783 N 6.56 0.00 -2.80 0.64 -2.24 -1.26 -5.11 114.28 110.07 1k93 n THR 783 Ca 0.06 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.63 1k93 n THR 783 Cb 0.49 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.80 1k93 n THR 783 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1k93 s GLU 784 N -0.43 2.07 0.30 -0.78 4.04 -1.26 -5.07 118.70 117.57 1k93 s GLU 784 Ca 0.00 -1.31 -0.29 0.00 0.04 0.00 0.00 54.97 53.41 1k93 s GLU 784 Cb 0.00 -2.50 -0.10 0.00 0.02 0.00 0.00 34.13 31.55 1k93 s GLU 784 CO 0.00 -1.08 1.15 0.54 -1.84 0.00 0.00 175.26 174.03 1k93 s ASN 785 N -4.66 7.10 0.24 0.83 2.20 -1.26 -4.88 114.94 114.51 1k93 s ASN 785 Ca 0.63 2.37 0.03 0.00 -0.94 0.00 0.00 52.86 54.95 1k93 s ASN 785 Cb -0.06 -2.63 0.63 0.00 -2.00 0.00 0.00 41.25 37.19 1k93 s ASN 785 CO 0.41 -0.27 1.18 -0.62 -2.94 0.00 0.00 177.10 174.86 1k93 n GLU 786 N 1.00 -0.06 0.19 3.55 1.02 -1.26 0.22 120.64 125.30 1k93 n GLU 786 Ca -0.00 1.11 0.18 0.00 -0.02 0.00 0.00 57.16 58.43 1k93 n GLU 786 Cb 0.44 -1.80 0.81 0.00 -0.02 0.00 0.00 31.44 30.88 1k93 n GLU 786 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1k93 h THR 787 N 0.00 0.35 0.05 2.62 1.03 -1.98 0.12 112.91 115.10 1k93 h THR 787 Ca 0.48 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.88 1k93 h THR 787 Cb 1.03 0.75 0.00 0.00 -1.07 0.00 0.00 68.15 68.86 1k93 h THR 787 CO -0.69 0.00 -0.02 -0.78 -0.01 0.00 0.00 175.52 174.01 1k93 h ASP 788 N 0.00 -0.06 0.87 0.00 3.58 0.24 -3.33 116.42 117.73 1k93 h ASP 788 Ca 0.11 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.56 1k93 h ASP 788 Cb 0.72 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.78 1k93 h ASP 788 CO -0.00 0.00 0.00 -1.13 -2.88 0.00 0.00 179.24 175.23 1k93 h ASN 789 N -0.16 0.00 -1.73 2.28 -1.24 -1.63 -3.12 115.58 109.98 1k93 h ASN 789 Ca -0.01 0.00 0.51 0.00 0.71 0.00 0.00 56.30 57.52 1k93 h ASN 789 Cb 0.05 0.00 -0.08 0.00 0.73 0.00 0.00 38.32 39.02 1k93 h ASN 789 CO 0.01 0.00 1.23 0.15 -1.29 0.00 0.00 177.43 177.53 1k93 h PHE 790 N 0.00 0.09 0.00 0.67 3.57 -0.85 0.71 116.94 121.12 1k93 h PHE 790 Ca 0.00 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 1k93 h PHE 790 Cb 0.44 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 1k93 h PHE 790 CO 0.00 -0.04 -0.57 1.05 -2.23 0.00 0.00 178.31 176.53 1k93 h GLU 791 N 0.01 0.00 -0.80 1.11 4.11 -1.74 -3.13 114.58 114.14 1k93 h GLU 791 Ca 0.86 0.00 0.16 0.00 0.07 0.00 0.00 59.36 60.45 1k93 h GLU 791 Cb 3.33 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 32.47 1k93 h GLU 791 CO -0.08 0.49 0.34 0.28 0.07 0.00 0.00 179.01 180.10 1k93 h VAL 792 N -1.00 0.62 -0.16 -1.06 2.07 -0.78 -1.70 116.25 114.24 1k93 h VAL 792 Ca -0.11 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1k93 h VAL 792 Cb 0.75 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1k93 h VAL 792 CO -0.07 0.08 0.01 0.15 0.02 0.00 0.00 177.57 177.76 1k93 h PHE 793 N 0.46 0.30 0.00 1.57 3.57 0.07 -1.55 116.94 121.36 1k93 h PHE 793 Ca 0.45 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.90 1k93 h PHE 793 Cb 0.73 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.39 1k93 h PHE 793 CO -0.15 0.49 0.06 0.94 -2.23 0.00 0.00 178.31 177.42 1k93 n GLN 794 N -4.75 0.00 0.00 1.11 7.27 -0.66 0.14 117.38 120.48 1k93 n GLN 794 Ca -0.05 0.40 0.03 0.00 0.07 0.00 0.00 57.00 57.45 1k93 n GLN 794 Cb 0.21 -1.56 -0.02 0.00 2.41 0.00 0.00 30.24 31.28 1k93 n GLN 794 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1k93 n LYS 795 N -1.39 3.68 0.04 3.69 5.02 -0.97 -4.69 118.16 123.54 1k93 n LYS 795 Ca 0.00 -0.23 -0.10 0.00 -2.02 0.00 0.00 58.31 55.96 1k93 n LYS 795 Cb 0.06 -0.89 -0.07 0.00 -0.02 0.00 0.00 35.03 34.11 1k93 n LYS 795 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1k93 h ILE 796 N 0.35 0.81 -0.14 -0.18 1.08 0.22 -3.19 117.51 116.46 1k93 h ILE 796 Ca 0.00 -1.18 0.04 0.00 -0.39 0.00 0.00 64.86 63.33 1k93 h ILE 796 Cb 0.19 1.39 -0.01 0.00 -3.07 0.00 0.00 36.82 35.33 1k93 h ILE 796 CO 0.00 0.22 0.48 0.16 -0.69 0.00 0.00 178.15 178.32 1k93 h ILE 797 N -0.89 0.09 -0.02 -0.67 3.07 -1.82 -3.51 117.51 113.75 1k93 h ILE 797 Ca -0.02 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.39 1k93 h ILE 797 Cb 0.52 0.55 0.00 0.00 -0.27 0.00 0.00 36.82 37.62 1k93 h ILE 797 CO 0.03 0.00 0.00 0.47 -1.05 0.00 0.00 178.15 177.60