#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mks n LYS 271 N 0.00 1.82 -3.77 3.23 5.02 -1.26 -5.19 118.16 118.01 3mks n LYS 271 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 3mks n LYS 271 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 3mks n LYS 271 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3mks s ARG 272 N -1.53 0.70 -0.94 1.97 3.52 -1.26 -5.08 118.95 116.34 3mks s ARG 272 Ca 0.00 -0.33 -0.18 0.00 -0.13 0.00 0.00 55.73 55.09 3mks s ARG 272 Cb 0.00 0.31 0.14 0.00 -1.56 0.00 0.00 34.95 33.83 3mks s ARG 272 CO 0.00 -0.20 1.12 0.34 -0.81 0.00 0.00 175.30 175.75 3mks s ASP 273 N -1.60 6.65 0.10 -2.12 2.15 -1.26 -4.86 116.67 115.73 3mks s ASP 273 Ca -0.11 -2.11 -0.16 0.00 0.43 0.00 0.00 52.55 50.60 3mks s ASP 273 Cb -0.04 -2.39 -0.05 0.00 -0.30 0.00 0.00 42.92 40.14 3mks s ASP 273 CO 0.01 -1.03 1.53 -0.07 -0.17 0.00 0.00 175.17 175.45 3mks h LEU 274 N 10.27 0.59 -0.71 -1.34 4.07 -1.98 -1.59 115.31 124.61 3mks h LEU 274 Ca 0.16 -0.33 0.15 0.00 0.08 0.00 0.00 57.88 57.95 3mks h LEU 274 Cb 1.02 -0.16 -0.11 0.00 1.08 0.00 0.00 40.66 42.49 3mks h LEU 274 CO 1.10 0.77 0.14 0.40 -1.08 0.00 0.00 178.44 179.76 3mks h ILE 275 N 0.39 0.50 0.04 1.22 5.03 -1.91 -0.43 117.51 122.35 3mks h ILE 275 Ca 0.09 -0.08 -0.23 0.00 -0.12 0.00 0.00 64.86 64.52 3mks h ILE 275 Cb 0.48 0.25 -0.02 0.00 -3.03 0.00 0.00 36.82 34.51 3mks h ILE 275 CO 0.02 0.04 -1.06 0.74 -0.68 0.00 0.00 178.15 177.21 3mks h THR 276 N 0.23 1.62 0.16 -0.27 2.02 -1.90 -3.34 112.91 111.43 3mks h THR 276 Ca 0.40 -3.21 -0.30 0.00 0.77 0.00 0.00 66.41 64.06 3mks h THR 276 Cb 0.68 2.84 0.03 0.00 -1.74 0.00 0.00 68.15 69.95 3mks h THR 276 CO -0.52 0.93 -1.31 0.28 0.37 0.00 0.00 175.52 175.27 3mks h SER 277 N 0.03 0.76 -3.98 4.18 0.02 -0.61 -3.45 113.55 110.51 3mks h SER 277 Ca -0.05 -0.76 -0.50 0.00 -0.84 0.00 0.00 61.79 59.64 3mks h SER 277 Cb 1.80 -0.24 0.05 0.00 0.14 0.00 0.00 62.40 64.15 3mks h SER 277 CO 0.15 1.57 0.47 -0.76 -1.14 0.00 0.00 176.83 177.13 3mks s LEU 278 N -7.63 4.08 0.45 5.07 2.01 -0.24 -5.01 118.68 117.42 3mks s LEU 278 Ca -0.08 2.24 -0.22 0.00 0.01 0.00 0.00 54.13 56.08 3mks s LEU 278 Cb 0.06 -4.18 -0.11 0.00 0.01 0.00 0.00 46.19 41.96 3mks s LEU 278 CO 0.93 -0.75 0.62 -2.65 1.01 0.00 0.00 176.35 175.51 3mks n PRO 279 N -0.26 0.69 -0.21 1.29 -0.02 -1.26 -4.69 135.00 130.53 3mks n PRO 279 Ca 0.06 0.25 -0.03 0.00 -2.02 0.00 0.00 63.50 61.76 3mks n PRO 279 Cb 0.48 -1.64 0.03 0.00 -0.02 0.00 0.00 33.50 32.35 3mks n PRO 279 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3mks h PHE 280 N 0.81 -0.71 -0.97 6.00 3.57 -1.94 -1.49 116.94 122.20 3mks h PHE 280 Ca -0.42 0.07 0.20 0.00 3.53 0.00 0.00 57.97 61.34 3mks h PHE 280 Cb 1.39 0.41 -0.09 0.00 2.79 0.00 0.00 35.95 40.45 3mks h PHE 280 CO 0.36 -0.35 0.61 0.93 -2.23 0.00 0.00 178.31 177.64 3mks h GLU 281 N -0.10 0.61 0.04 1.11 4.39 -1.99 -0.74 114.58 117.89 3mks h GLU 281 Ca 0.27 -0.04 -0.11 0.00 0.34 0.00 0.00 59.36 59.82 3mks h GLU 281 Cb 0.54 -0.14 0.01 0.00 -0.10 0.00 0.00 28.75 29.06 3mks h GLU 281 CO -0.69 0.41 -0.46 0.82 -1.16 0.00 0.00 179.01 177.92 3mks h ILE 282 N 0.63 1.54 -0.41 3.13 5.03 -1.62 -2.26 117.51 123.54 3mks h ILE 282 Ca 0.54 -2.19 -0.01 0.00 -0.12 0.00 0.00 64.86 63.08 3mks h ILE 282 Cb 1.01 2.92 -0.02 0.00 -3.03 0.00 0.00 36.82 37.70 3mks h ILE 282 CO -0.30 0.61 0.19 0.28 -0.68 0.00 0.00 178.15 178.26 3mks h SER 283 N -0.42 0.51 0.12 1.72 0.02 -1.21 -0.33 113.55 113.95 3mks h SER 283 Ca -0.07 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3mks h SER 283 Cb 1.26 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 3mks h SER 283 CO 0.09 0.44 -0.10 0.25 -1.14 0.00 0.00 176.83 176.37 3mks h LEU 284 N 0.57 -0.27 -1.75 5.07 7.12 -1.17 -1.09 115.31 123.80 3mks h LEU 284 Ca 0.15 0.03 0.04 0.00 0.13 0.00 0.00 57.88 58.22 3mks h LEU 284 Cb 0.07 0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.27 3mks h LEU 284 CO -0.02 -0.16 0.25 0.50 -0.13 0.00 0.00 178.44 178.88 3mks h LYS 285 N -0.24 0.31 -0.26 1.25 3.64 -0.70 0.31 116.57 120.88 3mks h LYS 285 Ca 0.00 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 3mks h LYS 285 Cb 0.22 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3mks h LYS 285 CO -0.02 0.21 0.10 0.82 -2.27 0.00 0.00 179.45 178.29 3mks h ILE 286 N 0.32 1.18 -0.59 2.00 2.04 -0.44 -3.18 117.51 118.84 3mks h ILE 286 Ca 0.16 -0.54 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 3mks h ILE 286 Cb 0.23 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 3mks h ILE 286 CO -0.03 0.18 0.21 -0.26 0.00 0.00 0.00 178.15 178.25 3mks h PHE 287 N 0.27 0.88 0.00 1.37 0.04 0.74 -1.45 116.94 118.79 3mks h PHE 287 Ca 0.09 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.80 3mks h PHE 287 Cb 0.19 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.07 3mks h PHE 287 CO -0.01 0.70 0.00 0.09 -0.60 0.00 0.00 178.31 178.49 3mks n ASN 288 N -4.31 0.00 0.07 2.17 3.02 0.16 -1.37 115.26 115.02 3mks n ASN 288 Ca 0.05 0.49 0.12 0.00 -0.03 0.00 0.00 54.58 55.21 3mks n ASN 288 Cb 0.18 -0.50 0.14 0.00 -0.61 0.00 0.00 39.78 39.00 3mks n ASN 288 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 3mks h TYR 289 N 0.00 0.00 -2.66 3.10 0.05 -1.30 -3.48 116.97 112.68 3mks h TYR 289 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.32 3mks h TYR 289 Cb 0.07 0.00 0.02 0.00 1.01 0.00 0.00 36.73 37.83 3mks h TYR 289 CO 0.00 0.00 -0.17 -0.51 -1.05 0.00 0.00 178.16 176.43 3mks s LEU 290 N -4.50 3.85 0.49 3.88 1.43 -0.47 -5.09 118.68 118.27 3mks s LEU 290 Ca 0.05 0.30 -0.15 0.00 -1.03 0.00 0.00 54.13 53.30 3mks s LEU 290 Cb 0.12 -3.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.09 3mks s LEU 290 CO 0.73 -0.49 0.94 -1.10 0.23 0.00 0.00 176.35 176.66 3mks s GLN 291 N -4.41 3.89 0.42 1.70 -1.52 -1.26 -4.89 119.66 113.59 3mks s GLN 291 Ca 0.44 0.83 0.20 0.00 -1.95 0.00 0.00 55.36 54.88 3mks s GLN 291 Cb -0.10 -2.19 1.13 0.00 -0.22 0.00 0.00 33.01 31.63 3mks s GLN 291 CO 0.36 -0.23 1.81 0.27 -0.25 0.00 0.00 175.29 177.25 3mks h PHE 292 N 0.95 0.56 -0.73 0.91 -5.15 -1.98 0.33 116.94 111.83 3mks h PHE 292 Ca -0.47 0.02 0.11 0.00 -0.20 0.00 0.00 57.97 57.43 3mks h PHE 292 Cb 1.19 -0.17 -0.08 0.00 0.22 0.00 0.00 35.95 37.11 3mks h PHE 292 CO 0.63 0.09 0.35 0.93 -2.00 0.00 0.00 178.31 178.31 3mks h GLU 293 N 0.37 0.55 0.00 6.09 3.07 -2.00 -1.10 114.58 121.55 3mks h GLU 293 Ca 0.55 -0.03 -0.13 0.00 -0.50 0.00 0.00 59.36 59.24 3mks h GLU 293 Cb 1.44 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 29.21 3mks h GLU 293 CO -0.23 0.36 -0.64 -0.44 -1.40 0.00 0.00 179.01 176.67 3mks h ASP 294 N 0.57 0.00 -0.21 1.42 3.32 -0.71 -1.60 116.42 119.21 3mks h ASP 294 Ca 0.37 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.26 3mks h ASP 294 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 3mks h ASP 294 CO -0.31 0.64 -0.51 0.40 -1.72 0.00 0.00 179.24 177.74 3mks h ILE 295 N 0.00 1.31 0.74 0.35 2.04 -1.01 -1.29 117.51 119.65 3mks h ILE 295 Ca -0.01 -1.73 -0.03 0.00 1.00 0.00 0.00 64.86 64.09 3mks h ILE 295 Cb 1.41 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 39.35 3mks h ILE 295 CO 0.08 0.55 -0.39 0.40 0.00 0.00 0.00 178.15 178.79 3mks h ILE 296 N 0.42 0.20 -0.88 -0.67 2.04 -0.72 -2.04 117.51 115.86 3mks h ILE 296 Ca -0.01 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.02 3mks h ILE 296 Cb 1.13 0.20 -0.16 0.00 -0.74 0.00 0.00 36.82 37.25 3mks h ILE 296 CO 0.11 0.00 -0.26 0.59 0.00 0.00 0.00 178.15 178.59 3mks n ASN 297 N -5.55 -0.39 0.29 1.72 4.13 -0.65 0.13 115.26 114.94 3mks n ASN 297 Ca -0.14 1.52 0.15 0.00 1.68 0.00 0.00 54.58 57.79 3mks n ASN 297 Cb 0.43 -0.42 0.87 0.00 -1.54 0.00 0.00 39.78 39.11 3mks n ASN 297 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 3mks h SER 298 N 0.00 0.00 -0.23 6.41 0.02 -0.55 0.12 113.55 119.32 3mks h SER 298 Ca 0.39 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.30 3mks h SER 298 Cb 0.61 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.13 3mks h SER 298 CO -0.89 0.05 0.05 -0.07 -1.14 0.00 0.00 176.83 174.83 3mks h LEU 299 N 0.00 0.43 -5.84 5.07 3.38 0.16 -3.12 115.31 115.39 3mks h LEU 299 Ca -0.00 -0.06 -0.75 0.00 0.09 0.00 0.00 57.88 57.16 3mks h LEU 299 Cb 0.16 -0.11 -0.14 0.00 0.09 0.00 0.00 40.66 40.67 3mks h LEU 299 CO 0.01 0.46 2.28 0.61 0.09 0.00 0.00 178.44 181.89 3mks n GLY 300 N -1.05 5.15 0.21 0.83 0.00 0.43 -4.01 105.19 106.76 3mks n GLY 300 Ca 0.01 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.95 3mks n GLY 300 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3mks n VAL 301 N 1.99 0.00 -3.56 1.61 0.31 -1.18 -5.03 118.33 112.47 3mks n VAL 301 Ca 0.57 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.84 3mks n VAL 301 Cb 0.27 -0.15 -0.02 0.00 -0.91 0.00 0.00 33.84 33.04 3mks n VAL 301 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3mks s SER 302 N -3.37 -0.27 0.33 4.52 0.15 -1.26 -4.94 113.70 108.85 3mks s SER 302 Ca 0.00 -0.05 0.06 0.00 0.70 0.00 0.00 55.95 56.66 3mks s SER 302 Cb 0.00 0.33 0.71 0.00 -1.71 0.00 0.00 66.02 65.35 3mks s SER 302 CO 0.00 -0.55 1.86 1.56 1.20 0.00 0.00 173.24 177.32 3mks h GLN 303 N 2.00 0.79 0.09 5.44 1.08 -1.98 0.36 115.11 122.89 3mks h GLN 303 Ca -0.20 -0.05 -0.29 0.00 -1.45 0.00 0.00 58.65 56.67 3mks h GLN 303 Cb 1.22 -0.18 0.03 0.00 -0.05 0.00 0.00 27.48 28.50 3mks h GLN 303 CO 0.28 0.52 -1.18 -0.97 -0.95 0.00 0.00 178.83 176.53 3mks h ASN 304 N 0.81 0.89 0.61 1.46 -0.73 -1.98 -0.70 115.58 115.93 3mks h ASN 304 Ca 0.46 -0.80 -0.03 0.00 1.87 0.00 0.00 56.30 57.79 3mks h ASN 304 Cb 0.60 -0.28 0.01 0.00 0.27 0.00 0.00 38.32 38.92 3mks h ASN 304 CO -0.22 1.59 -0.29 -0.50 -0.37 0.00 0.00 177.43 177.64 3mks h TRP 305 N 0.29 -0.75 -0.94 0.67 4.06 -1.76 -0.32 115.95 117.20 3mks h TRP 305 Ca -0.17 -0.02 0.18 0.00 2.06 0.00 0.00 58.89 60.94 3mks h TRP 305 Cb 1.85 0.25 -0.18 0.00 -1.00 0.00 0.00 29.16 30.08 3mks h TRP 305 CO 0.11 -0.47 -0.25 -0.97 -3.56 0.00 0.00 178.44 173.31 3mks h ASN 306 N -0.82 -0.92 0.13 -3.49 -1.24 -0.44 -0.61 115.58 108.18 3mks h ASN 306 Ca -0.08 0.28 -0.00 0.00 0.71 0.00 0.00 56.30 57.21 3mks h ASN 306 Cb 0.62 0.60 -0.01 0.00 0.73 0.00 0.00 38.32 40.26 3mks h ASN 306 CO 0.14 -0.31 -0.19 0.50 -1.29 0.00 0.00 177.43 176.27 3mks h LYS 307 N -0.00 -0.33 -0.91 6.67 3.64 -1.00 -2.39 116.57 122.25 3mks h LYS 307 Ca 0.44 0.02 0.24 0.00 -1.27 0.00 0.00 60.65 60.08 3mks h LYS 307 Cb 0.68 0.07 -0.16 0.00 -0.41 0.00 0.00 32.23 32.41 3mks h LYS 307 CO -0.97 -0.22 0.04 0.82 -2.27 0.00 0.00 179.45 176.86 3mks h ILE 308 N -0.34 0.15 0.00 2.00 2.04 -0.12 0.42 117.51 121.65 3mks h ILE 308 Ca -0.02 -0.02 -0.08 0.00 1.00 0.00 0.00 64.86 65.74 3mks h ILE 308 Cb 0.31 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3mks h ILE 308 CO -0.06 0.01 -0.40 0.40 0.00 0.00 0.00 178.15 178.10 3mks h ILE 309 N 0.06 1.28 -0.02 -0.67 2.04 -1.02 -2.82 117.51 116.37 3mks h ILE 309 Ca 0.54 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 65.01 3mks h ILE 309 Cb 1.06 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 3mks h ILE 309 CO -0.82 0.40 -0.39 0.54 0.00 0.00 0.00 178.15 177.88 3mks n ARG 310 N -4.04 1.43 0.00 2.37 1.74 0.12 -3.28 116.66 114.99 3mks n ARG 310 Ca -0.02 -1.04 0.08 0.00 -0.77 0.00 0.00 57.85 56.11 3mks n ARG 310 Cb 0.44 -1.42 0.39 0.00 -1.02 0.00 0.00 32.46 30.85 3mks n ARG 310 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 3mks n LYS 311 N 0.09 0.09 -3.73 5.56 4.81 0.17 -4.76 118.16 120.39 3mks n LYS 311 Ca 0.09 0.18 -0.37 0.00 -0.87 0.00 0.00 58.31 57.33 3mks n LYS 311 Cb 0.44 -1.50 -0.12 0.00 0.02 0.00 0.00 35.03 33.87 3mks n LYS 311 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3mks s SER 312 N -2.84 5.23 -0.04 3.14 0.15 -1.21 -4.92 113.70 113.21 3mks s SER 312 Ca 0.11 -0.57 -0.12 0.00 0.70 0.00 0.00 55.95 56.07 3mks s SER 312 Cb 0.11 -1.92 -0.31 0.00 -1.71 0.00 0.00 66.02 62.19 3mks s SER 312 CO 0.29 -0.17 0.70 0.74 1.20 0.00 0.00 173.24 176.01 3mks h THR 313 N 5.75 0.97 -0.42 6.45 2.02 -1.89 -3.35 112.91 122.45 3mks h THR 313 Ca -0.33 -2.53 0.03 0.00 0.77 0.00 0.00 66.41 64.36 3mks h THR 313 Cb 1.14 2.80 -0.04 0.00 -1.74 0.00 0.00 68.15 70.31 3mks h THR 313 CO 0.60 0.85 0.20 0.28 0.37 0.00 0.00 175.52 177.83 3mks h SER 314 N 0.10 0.29 -0.38 4.18 0.02 -1.98 -0.24 113.55 115.55 3mks h SER 314 Ca -0.34 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 60.70 3mks h SER 314 Cb 2.10 -0.03 -0.09 0.00 0.14 0.00 0.00 62.40 64.52 3mks h SER 314 CO 0.19 0.21 -0.45 0.25 -1.14 0.00 0.00 176.83 175.88 3mks h LEU 315 N 0.41 -1.50 -0.54 5.07 6.46 -1.94 0.11 115.31 123.38 3mks h LEU 315 Ca 0.18 0.22 -0.16 0.00 -0.12 0.00 0.00 57.88 58.00 3mks h LEU 315 Cb 0.09 0.64 -0.01 0.00 -0.73 0.00 0.00 40.66 40.66 3mks h LEU 315 CO -0.13 -0.38 -0.62 -0.50 -0.62 0.00 0.00 178.44 176.19 3mks h TRP 316 N -0.36 0.50 -0.43 1.25 4.06 -1.64 -2.14 115.95 117.19 3mks h TRP 316 Ca 0.12 -0.20 0.01 0.00 2.06 0.00 0.00 58.89 60.88 3mks h TRP 316 Cb 0.59 -0.09 -0.02 0.00 -1.00 0.00 0.00 29.16 28.64 3mks h TRP 316 CO -0.63 0.91 0.28 -0.22 -3.56 0.00 0.00 178.44 175.21 3mks h LYS 317 N 0.29 0.54 -0.36 0.49 3.64 -0.75 -0.62 116.57 119.81 3mks h LYS 317 Ca -0.01 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 3mks h LYS 317 Cb 1.15 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 3mks h LYS 317 CO 0.11 0.36 -0.10 0.87 -2.27 0.00 0.00 179.45 178.42 3mks h LYS 318 N 0.56 0.61 0.16 1.90 1.57 -0.35 -2.44 116.57 118.59 3mks h LYS 318 Ca 0.16 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3mks h LYS 318 Cb -0.04 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3mks h LYS 318 CO -0.05 0.70 -0.08 -0.07 -0.57 0.00 0.00 179.45 179.38 3mks h LEU 319 N 0.57 -0.19 -0.58 2.94 3.38 -1.10 0.65 115.31 120.97 3mks h LEU 319 Ca 0.10 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.05 3mks h LEU 319 Cb 0.50 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.23 3mks h LEU 319 CO 0.03 0.00 0.19 -0.07 0.09 0.00 0.00 178.44 178.69 3mks h LEU 320 N -0.37 0.17 -0.12 1.67 3.38 -0.99 -2.15 115.31 116.90 3mks h LEU 320 Ca -0.02 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3mks h LEU 320 Cb 0.29 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3mks h LEU 320 CO 0.04 0.11 0.07 0.40 0.09 0.00 0.00 178.44 179.14 3mks h ILE 321 N 0.36 1.08 0.00 1.22 2.04 -1.42 0.21 117.51 121.00 3mks h ILE 321 Ca 0.29 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.93 3mks h ILE 321 Cb 0.37 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 3mks h ILE 321 CO -0.31 0.07 0.00 0.77 0.00 0.00 0.00 178.15 178.68 3mks h SER 322 N 0.11 0.00 -0.47 1.72 4.64 -0.25 0.27 113.55 119.57 3mks h SER 322 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3mks h SER 322 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3mks h SER 322 CO -0.01 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.33 3mks n GLU 323 N -3.04 2.21 -3.41 4.77 -0.58 -0.90 -4.95 120.64 114.74 3mks n GLU 323 Ca 0.02 -1.86 -0.20 0.00 -0.42 0.00 0.00 57.16 54.70 3mks n GLU 323 Cb 0.36 -1.43 0.07 0.00 -0.57 0.00 0.00 31.44 29.87 3mks n GLU 323 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3mks n ASN 324 N 1.03 -5.01 -0.25 1.62 3.02 0.08 -4.91 115.26 110.84 3mks n ASN 324 Ca 0.18 -0.48 0.12 0.00 -0.03 0.00 0.00 54.58 54.37 3mks n ASN 324 Cb 0.46 -4.46 0.22 0.00 -0.61 0.00 0.00 39.78 35.39 3mks n ASN 324 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3mks n PHE 325 N -4.48 0.00 -3.64 3.10 0.99 0.69 -4.82 117.46 109.30 3mks n PHE 325 Ca -0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.37 3mks n PHE 325 Cb 0.57 -0.10 -0.01 0.00 -1.00 0.00 0.00 39.48 38.94 3mks n PHE 325 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3mks s VAL 326 N -2.61 0.00 0.20 -4.37 0.11 -1.25 -4.99 120.40 107.49 3mks s VAL 326 Ca 0.20 -0.30 0.11 0.00 -2.93 0.00 0.00 61.98 59.06 3mks s VAL 326 Cb 0.18 -1.63 -0.04 0.00 -1.53 0.00 0.00 36.38 33.36 3mks s VAL 326 CO 0.59 0.00 -0.24 -0.94 -3.33 0.00 0.00 175.10 171.18 3mks s SER 327 N -2.74 3.44 0.29 3.54 1.04 -1.26 -4.30 113.70 113.71 3mks s SER 327 Ca 0.11 -0.88 0.05 0.00 0.48 0.00 0.00 55.95 55.71 3mks s SER 327 Cb 0.00 -0.26 0.80 0.00 0.10 0.00 0.00 66.02 66.67 3mks s SER 327 CO -0.03 0.11 1.43 -2.65 0.98 0.00 0.00 173.24 173.08 3mks n PRO 328 N 0.18 -0.07 -0.03 4.02 -0.02 -1.26 -0.58 135.00 137.25 3mks n PRO 328 Ca -0.12 1.34 -0.16 0.00 -2.02 0.00 0.00 63.50 62.55 3mks n PRO 328 Cb 0.56 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 3mks n PRO 328 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3mks h LYS 329 N 0.00 0.77 0.00 -0.52 6.56 -2.06 -3.18 116.57 118.15 3mks h LYS 329 Ca 0.60 -0.59 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 3mks h LYS 329 Cb 1.31 0.11 0.00 0.00 -0.57 0.00 0.00 32.23 33.08 3mks h LYS 329 CO -0.83 1.20 0.00 0.41 -2.06 0.00 0.00 179.45 178.18 3mks n GLY 330 N 0.58 -1.07 0.48 3.86 0.00 0.26 -4.42 105.19 104.88 3mks n GLY 330 Ca -0.06 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 3mks n GLY 330 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3mks h PHE 331 N 0.00 -1.31 -1.01 1.61 3.57 -1.42 -2.04 116.94 116.34 3mks h PHE 331 Ca 0.00 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.75 3mks h PHE 331 Cb 0.27 0.50 -0.11 0.00 2.79 0.00 0.00 35.95 39.40 3mks h PHE 331 CO 0.00 -0.66 0.62 -0.91 -2.23 0.00 0.00 178.31 175.14 3mks h ASN 332 N -1.01 0.62 0.58 0.41 2.35 -1.84 0.22 115.58 116.91 3mks h ASN 332 Ca -0.07 0.11 -0.16 0.00 -0.55 0.00 0.00 56.30 55.63 3mks h ASN 332 Cb 0.86 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 39.22 3mks h ASN 332 CO -0.02 0.13 -0.72 -1.28 -1.65 0.00 0.00 177.43 173.90 3mks h SER 333 N 0.55 0.14 0.04 5.81 0.87 -1.79 -0.49 113.55 118.69 3mks h SER 333 Ca 0.62 -0.09 -0.22 0.00 -1.23 0.00 0.00 61.79 60.86 3mks h SER 333 Cb 1.26 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 63.19 3mks h SER 333 CO -0.40 0.81 -0.82 0.25 -0.53 0.00 0.00 176.83 176.13 3mks h LEU 334 N 0.08 0.77 -0.63 2.23 5.85 -0.26 -2.51 115.31 120.82 3mks h LEU 334 Ca -0.02 -0.53 0.11 0.00 0.84 0.00 0.00 57.88 58.28 3mks h LEU 334 Cb 1.27 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 41.99 3mks h LEU 334 CO 0.10 1.31 0.20 -1.13 -0.34 0.00 0.00 178.44 178.58 3mks h ASN 335 N 0.41 0.14 -0.33 1.25 -0.00 -0.53 -1.91 115.58 114.61 3mks h ASN 335 Ca -0.06 0.10 -0.05 0.00 -0.00 0.00 0.00 56.30 56.29 3mks h ASN 335 Cb 1.44 0.10 -0.01 0.00 -0.00 0.00 0.00 38.32 39.85 3mks h ASN 335 CO 0.16 0.07 0.01 0.25 -0.00 0.00 0.00 177.43 177.92 3mks h LEU 336 N 0.35 0.57 -1.48 0.34 5.85 -1.05 -1.37 115.31 118.51 3mks h LEU 336 Ca 0.33 -0.30 0.12 0.00 0.84 0.00 0.00 57.88 58.87 3mks h LEU 336 Cb 0.46 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 3mks h LEU 336 CO -0.37 0.72 0.50 0.50 -0.34 0.00 0.00 178.44 179.46 3mks h LYS 337 N 0.39 0.53 0.10 1.25 3.64 -1.15 0.23 116.57 121.56 3mks h LYS 337 Ca 0.10 -0.03 -0.26 0.00 -1.27 0.00 0.00 60.65 59.18 3mks h LYS 337 Cb 0.43 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 3mks h LYS 337 CO 0.01 0.35 -1.22 -0.07 -2.27 0.00 0.00 179.45 176.25 3mks h LEU 338 N 0.54 0.33 -0.04 5.20 3.38 -1.04 -1.96 115.31 121.73 3mks h LEU 338 Ca 0.36 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.97 3mks h LEU 338 Cb 0.65 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3mks h LEU 338 CO -0.13 1.28 0.00 -1.28 0.09 0.00 0.00 178.44 178.41 3mks h SER 339 N 0.06 -0.01 0.17 -0.43 0.87 -0.63 0.83 113.55 114.41 3mks h SER 339 Ca -0.12 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.44 3mks h SER 339 Cb 1.93 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 63.91 3mks h SER 339 CO 0.18 0.00 -0.04 1.56 -0.53 0.00 0.00 176.83 178.01 3mks h GLN 340 N 0.02 0.00 0.00 2.24 4.20 -0.36 -3.07 115.11 118.14 3mks h GLN 340 Ca 0.02 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.37 3mks h GLN 340 Cb 0.02 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.73 3mks h GLN 340 CO -0.03 0.04 -2.36 1.17 -0.67 0.00 0.00 178.83 176.98 3mks n LYS 341 N -3.55 0.77 -3.17 1.46 4.81 -0.75 -4.68 118.16 113.04 3mks n LYS 341 Ca -0.02 0.03 -0.27 0.00 -0.87 0.00 0.00 58.31 57.17 3mks n LYS 341 Cb 0.14 -1.50 -0.06 0.00 0.02 0.00 0.00 35.03 33.63 3mks n LYS 341 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3mks n TYR 342 N -2.84 3.79 0.16 5.64 4.01 0.29 -4.92 117.16 123.29 3mks n TYR 342 Ca -0.35 -4.07 0.16 0.00 -0.16 0.00 0.00 57.90 53.48 3mks n TYR 342 Cb 1.10 -0.52 0.75 0.00 -0.31 0.00 0.00 39.34 40.36 3mks n TYR 342 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3mks h PRO 343 N 3.55 0.00 -0.12 -0.72 0.11 -1.75 -1.65 132.00 131.42 3mks h PRO 343 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 3mks h PRO 343 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 3mks h PRO 343 CO 0.82 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.24 3mks n LYS 344 N -4.14 2.05 -3.49 1.05 5.02 -1.26 -4.87 118.16 112.52 3mks n LYS 344 Ca 0.03 -1.54 -0.26 0.00 -2.02 0.00 0.00 58.31 54.51 3mks n LYS 344 Cb 0.35 -1.46 -0.02 0.00 -0.02 0.00 0.00 35.03 33.87 3mks n LYS 344 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3mks s LEU 345 N -1.81 4.10 0.73 -0.35 1.43 -0.62 -5.10 118.68 117.05 3mks s LEU 345 Ca 0.34 0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 53.82 3mks s LEU 345 Cb 0.20 -3.31 0.03 0.00 0.03 0.00 0.00 46.19 43.14 3mks s LEU 345 CO 0.31 -0.18 1.09 -0.94 0.23 0.00 0.00 176.35 176.85 3mks s SER 346 N -3.53 5.17 0.24 2.29 1.04 -1.26 -4.84 113.70 112.81 3mks s SER 346 Ca 0.40 1.23 -0.05 0.00 0.48 0.00 0.00 55.95 58.02 3mks s SER 346 Cb -0.10 -2.03 0.39 0.00 0.10 0.00 0.00 66.02 64.38 3mks s SER 346 CO 0.32 -1.53 1.79 -0.61 0.98 0.00 0.00 173.24 174.19 3mks h GLN 347 N -0.78 0.65 0.03 4.02 4.15 -1.98 0.11 115.11 121.32 3mks h GLN 347 Ca -0.45 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 58.92 3mks h GLN 347 Cb 1.25 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.79 3mks h GLN 347 CO 0.62 0.43 -0.02 1.96 -1.93 0.00 0.00 178.83 179.90 3mks h GLN 348 N 0.67 -0.04 -0.45 1.69 7.50 -1.89 -0.08 115.11 122.52 3mks h GLN 348 Ca 0.39 0.00 -0.11 0.00 0.50 0.00 0.00 58.65 59.42 3mks h GLN 348 Cb 0.41 0.01 -0.01 0.00 0.05 0.00 0.00 27.48 27.94 3mks h GLN 348 CO -0.28 0.11 -0.17 -0.44 -1.50 0.00 0.00 178.83 176.56 3mks h ASP 349 N -0.19 0.92 -0.27 1.46 3.32 -1.65 -0.33 116.42 119.69 3mks h ASP 349 Ca -0.00 -0.39 0.04 0.00 0.02 0.00 0.00 57.03 56.70 3mks h ASP 349 Cb 0.17 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 39.40 3mks h ASP 349 CO 0.01 1.10 -0.55 0.03 -1.72 0.00 0.00 179.24 178.10 3mks h ARG 350 N 0.74 -0.48 -0.78 3.56 3.08 -0.67 -0.61 114.38 119.22 3mks h ARG 350 Ca 0.11 0.03 0.15 0.00 0.07 0.00 0.00 59.98 60.34 3mks h ARG 350 Cb 0.73 0.11 -0.10 0.00 0.08 0.00 0.00 29.97 30.79 3mks h ARG 350 CO 0.06 -0.32 0.32 -0.07 -1.07 0.00 0.00 179.97 178.88 3mks h LEU 351 N -0.50 0.30 -0.66 3.04 3.38 -0.53 0.16 115.31 120.50 3mks h LEU 351 Ca 0.05 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 3mks h LEU 351 Cb 0.64 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 3mks h LEU 351 CO -0.51 0.10 0.37 -0.09 0.09 0.00 0.00 178.44 178.39 3mks h ARG 352 N 0.45 0.92 -0.22 1.13 2.43 -0.51 0.71 114.38 119.28 3mks h ARG 352 Ca 0.43 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.50 3mks h ARG 352 Cb 0.67 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 3mks h ARG 352 CO -0.42 0.68 0.13 1.25 -1.51 0.00 0.00 179.97 180.11 3mks h LEU 353 N 0.90 0.28 -0.30 3.80 7.12 -0.24 0.04 115.31 126.92 3mks h LEU 353 Ca 0.23 -0.07 -0.15 0.00 0.13 0.00 0.00 57.88 58.02 3mks h LEU 353 Cb 0.03 -0.07 -0.00 0.00 -0.53 0.00 0.00 40.66 40.09 3mks h LEU 353 CO -0.04 0.27 -0.39 -1.28 -0.13 0.00 0.00 178.44 176.87 3mks h SER 354 N 0.26 0.86 -0.12 1.25 0.87 -0.59 0.21 113.55 116.29 3mks h SER 354 Ca 0.08 -0.50 0.01 0.00 -1.23 0.00 0.00 61.79 60.15 3mks h SER 354 Cb 0.05 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 3mks h SER 354 CO -0.01 1.19 0.05 0.15 -0.53 0.00 0.00 176.83 177.68 3mks h PHE 355 N 0.55 0.10 -0.19 2.24 3.04 -0.71 0.05 116.94 122.02 3mks h PHE 355 Ca 0.04 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.92 3mks h PHE 355 Cb 0.98 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 39.45 3mks h PHE 355 CO 0.07 0.06 -0.19 -0.07 -2.02 0.00 0.00 178.31 176.16 3mks h LEU 356 N 0.12 0.31 -0.02 0.59 3.38 -0.65 0.24 115.31 119.28 3mks h LEU 356 Ca 0.05 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3mks h LEU 356 Cb 0.01 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 3mks h LEU 356 CO -0.04 0.52 -0.01 -0.08 0.09 0.00 0.00 178.44 178.92 3mks h GLU 357 N 0.29 0.05 -0.58 1.13 4.81 -0.27 -3.07 114.58 116.94 3mks h GLU 357 Ca 0.05 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 3mks h GLU 357 Cb 0.51 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.85 3mks h GLU 357 CO 0.03 0.45 0.36 -0.91 -0.73 0.00 0.00 179.01 178.21 3mks h ASN 358 N -0.35 0.59 -0.61 1.04 -0.26 -0.42 -1.96 115.58 113.60 3mks h ASN 358 Ca 0.01 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.68 3mks h ASN 358 Cb 0.43 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 37.54 3mks h ASN 358 CO 0.00 0.41 0.12 -0.29 -1.06 0.00 0.00 177.43 176.62 3mks h ILE 359 N 0.71 1.25 -0.53 2.81 6.09 -0.63 -0.45 117.51 126.76 3mks h ILE 359 Ca 0.23 -0.97 -0.10 0.00 -1.37 0.00 0.00 64.86 62.65 3mks h ILE 359 Cb 0.01 0.64 -0.02 0.00 0.47 0.00 0.00 36.82 37.91 3mks h ILE 359 CO -0.09 0.36 -0.06 0.15 -3.07 0.00 0.00 178.15 175.44 3mks h PHE 360 N 0.97 1.03 -0.32 2.19 3.57 -1.41 -0.40 116.94 122.56 3mks h PHE 360 Ca 0.20 -0.18 -0.15 0.00 3.53 0.00 0.00 57.97 61.37 3mks h PHE 360 Cb 0.39 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3mks h PHE 360 CO 0.03 0.95 -0.39 0.82 -2.23 0.00 0.00 178.31 177.49 3mks h ILE 361 N 0.85 1.28 -0.34 1.41 2.04 -0.95 -2.87 117.51 118.93 3mks h ILE 361 Ca 0.15 -1.56 -0.13 0.00 1.00 0.00 0.00 64.86 64.32 3mks h ILE 361 Cb 0.58 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 3mks h ILE 361 CO 0.04 0.51 -0.29 0.25 0.00 0.00 0.00 178.15 178.65 3mks h LEU 362 N 0.63 0.76 -0.41 1.44 5.85 -0.74 -1.63 115.31 121.21 3mks h LEU 362 Ca 0.05 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.51 3mks h LEU 362 Cb 0.94 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 3mks h LEU 362 CO 0.09 1.00 0.21 0.11 -0.34 0.00 0.00 178.44 179.50 3mks h LYS 363 N 0.62 0.40 0.04 1.25 6.56 -1.05 0.40 116.57 124.80 3mks h LYS 363 Ca 0.07 -0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.66 3mks h LYS 363 Cb 0.81 -0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 32.36 3mks h LYS 363 CO 0.07 0.27 -0.13 -0.91 -2.06 0.00 0.00 179.45 176.69 3mks h ASN 364 N 0.42 -0.36 -0.63 0.86 -0.26 -1.21 -0.99 115.58 113.41 3mks h ASN 364 Ca 0.17 0.05 0.09 0.00 -0.56 0.00 0.00 56.30 56.05 3mks h ASN 364 Cb 0.08 0.14 -0.04 0.00 -1.06 0.00 0.00 38.32 37.44 3mks h ASN 364 CO -0.12 -0.18 0.42 -0.50 -1.06 0.00 0.00 177.43 175.99 3mks h TRP 365 N -0.23 0.53 -0.00 1.19 4.06 -0.81 -1.99 115.95 118.70 3mks h TRP 365 Ca 0.03 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.00 3mks h TRP 365 Cb 0.27 -0.17 0.00 0.00 -1.00 0.00 0.00 29.16 28.26 3mks h TRP 365 CO -0.17 0.26 -0.31 0.66 -3.56 0.00 0.00 178.44 175.32 3mks n TYR 366 N -4.48 0.00 -3.23 0.49 4.02 0.09 -4.85 117.16 109.19 3mks n TYR 366 Ca 0.10 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.56 3mks n TYR 366 Cb 0.33 -0.22 -0.07 0.00 -0.02 0.00 0.00 39.34 39.36 3mks n TYR 366 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 3mks s ASN 367 N -2.75 6.23 0.55 7.72 3.84 -0.45 -4.93 114.94 125.16 3mks s ASN 367 Ca 0.19 -0.71 0.30 0.00 0.21 0.00 0.00 52.86 52.85 3mks s ASN 367 Cb 0.19 -2.26 1.47 0.00 -0.55 0.00 0.00 41.25 40.09 3mks s ASN 367 CO 0.59 -0.72 1.89 1.55 -2.79 0.00 0.00 177.10 177.62 3mks h PRO 368 N 8.84 0.00 -0.01 0.43 0.13 -1.87 0.04 132.00 139.56 3mks h PRO 368 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3mks h PRO 368 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3mks h PRO 368 CO 0.87 0.00 -0.38 1.63 -0.23 0.00 0.00 178.00 179.89 3mks n LYS 369 N -4.08 0.81 -2.98 0.86 5.02 -1.26 -4.85 118.16 111.68 3mks n LYS 369 Ca 0.15 -0.55 -0.40 0.00 -2.02 0.00 0.00 58.31 55.48 3mks n LYS 369 Cb 0.86 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.34 3mks n LYS 369 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3mks s PHE 370 N -2.57 3.57 -0.12 2.13 2.19 -0.00 -5.08 117.98 118.10 3mks s PHE 370 Ca 0.21 1.30 0.02 0.00 0.33 0.00 0.00 56.93 58.79 3mks s PHE 370 Cb 0.19 -2.87 -0.00 0.00 -1.31 0.00 0.00 43.02 39.02 3mks s PHE 370 CO 0.57 0.03 -0.20 0.08 1.83 0.00 0.00 175.22 177.54 3mks s VAL 371 N 1.00 2.41 0.63 3.12 1.01 -1.26 -4.89 120.40 122.42 3mks s VAL 371 Ca 0.39 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 61.35 3mks s VAL 371 Cb -0.18 -1.97 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 3mks s VAL 371 CO 0.19 0.54 1.06 -2.16 0.00 0.00 0.00 175.10 174.73 3mks s PRO 372 N 0.45 3.18 0.39 2.72 0.04 -1.26 -5.02 135.00 135.49 3mks s PRO 372 Ca -0.14 1.10 -0.26 0.00 0.04 0.00 0.00 61.00 61.74 3mks s PRO 372 Cb -0.17 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 3mks s PRO 372 CO 0.06 -0.92 1.23 -0.65 0.04 0.00 0.00 177.00 176.76 3mks s GLN 373 N -4.45 4.09 -0.05 4.56 -0.21 -0.87 -4.77 119.66 117.95 3mks s GLN 373 Ca 0.61 1.99 0.06 0.00 0.02 0.00 0.00 55.36 58.04 3mks s GLN 373 Cb -0.15 -2.78 -0.01 0.00 1.00 0.00 0.00 33.01 31.07 3mks s GLN 373 CO 0.44 -0.33 -0.23 0.50 -2.12 0.00 0.00 175.29 173.54 3mks s ARG 374 N -2.16 2.36 -0.09 2.91 3.52 -1.26 -1.48 118.95 122.75 3mks s ARG 374 Ca 0.55 -0.85 0.00 0.00 -0.13 0.00 0.00 55.73 55.31 3mks s ARG 374 Cb -0.34 -2.02 0.02 0.00 -1.56 0.00 0.00 34.95 31.04 3mks s ARG 374 CO 0.44 0.37 -0.07 0.99 -0.81 0.00 0.00 175.30 176.21 3mks s THR 375 N -0.16 0.90 -0.29 4.11 2.01 -0.54 -5.00 115.64 116.67 3mks s THR 375 Ca -0.03 -0.25 -0.09 0.00 0.31 0.00 0.00 61.69 61.63 3mks s THR 375 Cb -0.13 -0.92 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 3mks s THR 375 CO 0.03 0.33 0.13 -0.89 -0.69 0.00 0.00 174.62 173.54 3mks s THR 376 N 1.44 4.58 0.18 -0.82 2.01 -1.26 -0.23 115.64 121.54 3mks s THR 376 Ca -0.01 -0.31 0.07 0.00 0.31 0.00 0.00 61.69 61.76 3mks s THR 376 Cb -0.13 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.06 3mks s THR 376 CO -0.04 0.15 -0.00 -0.76 -0.69 0.00 0.00 174.62 173.28 3mks s LEU 377 N 1.63 3.30 0.41 4.42 1.43 0.35 -4.90 118.68 125.30 3mks s LEU 377 Ca 0.05 -0.42 -0.26 0.00 -1.03 0.00 0.00 54.13 52.47 3mks s LEU 377 Cb -0.16 -1.94 -0.10 0.00 0.03 0.00 0.00 46.19 44.01 3mks s LEU 377 CO 0.06 0.08 1.35 -1.14 0.23 0.00 0.00 176.35 176.93 3mks n ARG 378 N -0.17 2.17 0.00 1.70 0.63 -1.26 0.12 116.66 119.85 3mks n ARG 378 Ca -0.09 0.77 0.00 0.00 -0.92 0.00 0.00 57.85 57.60 3mks n ARG 378 Cb 0.55 -2.48 0.00 0.00 0.45 0.00 0.00 32.46 30.99 3mks n ARG 378 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3mks n GLY 379 N 0.69 0.64 3.97 5.14 0.00 -0.60 -4.27 105.19 110.77 3mks n GLY 379 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 3mks n GLY 379 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3mks s HIS 380 N 3.79 2.23 -1.02 1.61 3.76 -1.25 -4.96 115.29 119.45 3mks s HIS 380 Ca 0.00 -0.57 0.14 0.00 -0.15 0.00 0.00 55.06 54.48 3mks s HIS 380 Cb 0.00 -2.22 0.61 0.00 1.11 0.00 0.00 32.58 32.08 3mks s HIS 380 CO 0.00 -0.56 1.45 -1.33 -0.85 0.00 0.00 174.74 173.45 3mks n MET 381 N -1.87 0.01 -4.33 1.40 0.00 -1.26 -4.54 117.12 106.53 3mks n MET 381 Ca 0.08 0.25 -0.24 0.00 0.00 0.00 0.00 57.70 57.79 3mks n MET 381 Cb 0.61 -1.50 -0.12 0.00 0.00 0.00 0.00 33.22 32.21 3mks n MET 381 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 175.97 175.89 3mks s THR 382 N -2.98 1.88 0.28 2.03 -1.32 -1.26 -4.99 115.64 109.28 3mks s THR 382 Ca 0.07 -1.74 0.08 0.00 -1.21 0.00 0.00 61.69 58.89 3mks s THR 382 Cb 0.09 -1.76 0.01 0.00 -1.51 0.00 0.00 72.50 69.33 3mks s THR 382 CO 0.26 -0.13 1.66 0.77 -2.21 0.00 0.00 174.62 174.97 3mks h SER 383 N 3.71 0.14 -3.38 8.08 4.64 -1.85 -3.37 113.55 121.53 3mks h SER 383 Ca -0.46 -0.07 -0.56 0.00 -0.47 0.00 0.00 61.79 60.24 3mks h SER 383 Cb 1.19 -0.04 -0.05 0.00 -0.31 0.00 0.00 62.40 63.19 3mks h SER 383 CO 0.44 0.64 0.13 -0.69 -0.87 0.00 0.00 176.83 176.48 3mks s VAL 384 N -3.89 4.99 -0.20 0.95 1.01 -1.26 -4.28 120.40 117.72 3mks s VAL 384 Ca -0.03 1.55 -0.11 0.00 0.00 0.00 0.00 61.98 63.39 3mks s VAL 384 Cb 0.13 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 3mks s VAL 384 CO 0.77 0.25 0.17 -0.63 0.00 0.00 0.00 175.10 175.66 3mks s ILE 385 N 0.72 5.38 -0.17 2.22 -1.09 -1.26 -4.28 121.20 122.72 3mks s ILE 385 Ca 0.40 0.26 0.18 0.00 -2.23 0.00 0.00 60.65 59.25 3mks s ILE 385 Cb -0.18 -3.51 -0.25 0.00 -1.58 0.00 0.00 42.46 36.93 3mks s ILE 385 CO 0.20 0.41 0.19 0.35 -1.23 0.00 0.00 174.94 174.86 3mks n THR 386 N 3.69 1.26 -3.95 2.92 -2.24 0.16 -4.84 114.28 111.28 3mks n THR 386 Ca -0.15 -0.81 -0.09 0.00 -2.27 0.00 0.00 64.05 60.73 3mks n THR 386 Cb 0.52 -0.47 -0.08 0.00 -2.10 0.00 0.00 70.33 68.20 3mks n THR 386 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mks s LEU 388 N -2.93 -0.32 -0.06 0.00 0.20 -1.26 -1.50 118.68 112.81 3mks s LEU 388 Ca 0.13 0.83 0.03 0.00 0.69 0.00 0.00 54.13 55.80 3mks s LEU 388 Cb 0.05 1.14 -0.03 0.00 -0.43 0.00 0.00 46.19 46.92 3mks s LEU 388 CO -0.05 -0.22 -0.13 -1.10 -0.29 0.00 0.00 176.35 174.57 3mks s GLN 389 N 2.13 2.63 -0.20 1.98 -1.52 -0.23 -5.00 119.66 119.45 3mks s GLN 389 Ca -0.04 -0.67 -0.01 0.00 -1.95 0.00 0.00 55.36 52.70 3mks s GLN 389 Cb -0.11 -2.44 0.06 0.00 -0.22 0.00 0.00 33.01 30.30 3mks s GLN 389 CO -0.11 0.60 -0.02 0.12 -0.25 0.00 0.00 175.29 175.63 3mks s PHE 390 N -0.65 1.68 -0.06 0.91 5.36 -1.26 -0.44 117.98 123.51 3mks s PHE 390 Ca 0.10 -1.24 -0.26 0.00 -0.96 0.00 0.00 56.93 54.57 3mks s PHE 390 Cb -0.11 -1.29 0.06 0.00 -0.34 0.00 0.00 43.02 41.34 3mks s PHE 390 CO 0.01 -0.67 0.58 -1.21 -1.46 0.00 0.00 175.22 172.47 3mks s GLU 391 N 1.64 0.92 -1.52 10.12 0.41 -0.62 -4.97 118.70 124.67 3mks s GLU 391 Ca -0.03 0.22 -0.15 0.00 -0.41 0.00 0.00 54.97 54.61 3mks s GLU 391 Cb -0.17 0.43 0.11 0.00 -1.78 0.00 0.00 34.13 32.72 3mks s GLU 391 CO -0.07 -0.26 0.75 -0.25 -0.49 0.00 0.00 175.26 174.93 3mks n ASP 392 N 1.22 -3.87 -0.32 -0.19 9.92 -1.26 -0.79 116.55 121.26 3mks n ASP 392 Ca -0.19 -0.75 -0.04 0.00 -0.53 0.00 0.00 54.79 53.28 3mks n ASP 392 Cb 0.57 -3.15 -0.02 0.00 -0.64 0.00 0.00 41.12 37.88 3mks n ASP 392 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3mks n ASN 393 N -2.58 -4.93 -4.68 -2.24 3.02 -1.26 -4.99 115.26 97.60 3mks n ASN 393 Ca 0.04 0.10 -0.35 0.00 -0.03 0.00 0.00 54.58 54.35 3mks n ASN 393 Cb 0.51 -2.80 -0.10 0.00 -0.61 0.00 0.00 39.78 36.79 3mks n ASN 393 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3mks s TYR 394 N -1.68 3.16 -0.15 3.10 2.02 0.03 -0.41 117.35 123.42 3mks s TYR 394 Ca 0.00 0.19 -0.03 0.00 -0.37 0.00 0.00 57.07 56.86 3mks s TYR 394 Cb 0.00 -1.79 -0.02 0.00 -0.40 0.00 0.00 41.96 39.74 3mks s TYR 394 CO 0.00 0.46 -0.07 0.08 -1.57 0.00 0.00 175.55 174.45 3mks s VAL 395 N -0.86 3.62 -0.09 0.71 1.01 -0.14 -1.60 120.40 123.07 3mks s VAL 395 Ca 0.13 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.67 3mks s VAL 395 Cb -0.11 -2.57 0.02 0.00 0.00 0.00 0.00 36.38 33.72 3mks s VAL 395 CO 0.02 0.50 -0.10 -0.63 0.00 0.00 0.00 175.10 174.89 3mks s ILE 396 N 0.35 1.10 0.17 2.22 1.09 0.42 -0.59 121.20 125.96 3mks s ILE 396 Ca -0.06 -0.41 0.07 0.00 -1.10 0.00 0.00 60.65 59.15 3mks s ILE 396 Cb -0.15 -1.05 -0.04 0.00 -1.06 0.00 0.00 42.46 40.16 3mks s ILE 396 CO 0.04 0.36 -0.14 0.42 -0.10 0.00 0.00 174.94 175.52 3mks s THR 397 N 1.09 1.56 0.01 2.92 -4.23 -0.58 -1.07 115.64 115.34 3mks s THR 397 Ca -0.07 -2.04 -0.08 0.00 -1.18 0.00 0.00 61.69 58.33 3mks s THR 397 Cb -0.14 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 71.83 3mks s THR 397 CO -0.01 -0.54 0.14 -0.83 -0.54 0.00 0.00 174.62 172.84 3mks s GLY 398 N -3.01 0.05 0.29 3.99 0.00 -0.56 -0.89 107.32 107.19 3mks s GLY 398 Ca 0.18 -0.17 -0.12 0.00 0.00 0.00 0.00 44.72 44.61 3mks s GLY 398 CO 0.05 -0.31 0.54 0.00 0.00 0.00 0.00 173.10 173.38 3mks s ALA 399 N -1.57 -0.18 0.60 3.20 0.00 -1.19 0.35 121.76 122.97 3mks s ALA 399 Ca -0.13 -0.95 0.29 0.00 0.00 0.00 0.00 51.96 51.17 3mks s ALA 399 Cb -0.07 1.02 1.61 0.00 0.00 0.00 0.00 23.12 25.68 3mks s ALA 399 CO 0.01 -0.88 2.02 0.22 0.00 0.00 0.00 175.76 177.13 3mks h ASP 400 N 2.17 0.00 0.00 0.00 3.58 -1.79 -2.15 116.42 118.23 3mks h ASP 400 Ca -0.27 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.18 3mks h ASP 400 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 3mks h ASP 400 CO 0.36 0.00 0.00 -0.90 -2.88 0.00 0.00 179.24 175.82 3mks n ASP 401 N -3.68 0.00 0.00 2.28 5.75 -1.26 -3.61 116.55 116.03 3mks n ASP 401 Ca 0.03 -0.67 0.00 0.00 -0.01 0.00 0.00 54.79 54.15 3mks n ASP 401 Cb 0.44 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 3mks n ASP 401 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3mks n LYS 402 N -0.82 0.00 -3.82 0.11 5.02 -0.86 -4.95 118.16 112.85 3mks n LYS 402 Ca 0.07 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.13 3mks n LYS 402 Cb 0.03 -1.10 -0.02 0.00 -0.02 0.00 0.00 35.03 33.93 3mks n LYS 402 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3mks s MET 403 N -0.38 3.46 -0.05 1.97 -1.94 -1.26 -4.30 119.30 116.80 3mks s MET 403 Ca 0.00 -0.60 0.06 0.00 -1.71 0.00 0.00 55.69 53.44 3mks s MET 403 Cb 0.00 -2.85 -0.01 0.00 2.01 0.00 0.00 34.83 33.98 3mks s MET 403 CO 0.00 0.39 -0.23 0.42 -0.01 0.00 0.00 175.02 175.59 3mks s ILE 404 N -1.99 1.86 -0.09 2.53 1.01 -0.73 -3.16 121.20 120.62 3mks s ILE 404 Ca 0.36 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 60.07 3mks s ILE 404 Cb -0.10 -1.57 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 3mks s ILE 404 CO 0.30 0.52 -0.18 -0.13 0.00 0.00 0.00 174.94 175.45 3mks s ARG 405 N -0.18 2.90 -0.16 2.79 0.52 -0.07 -1.24 118.95 123.52 3mks s ARG 405 Ca -0.01 -0.77 0.00 0.00 -0.52 0.00 0.00 55.73 54.42 3mks s ARG 405 Cb -0.12 -2.40 -0.00 0.00 0.52 0.00 0.00 34.95 32.94 3mks s ARG 405 CO 0.02 0.36 -0.15 0.08 0.02 0.00 0.00 175.30 175.63 3mks s VAL 406 N -0.05 2.71 0.11 3.52 1.01 -0.59 -1.52 120.40 125.58 3mks s VAL 406 Ca -0.04 -0.76 0.09 0.00 0.00 0.00 0.00 61.98 61.27 3mks s VAL 406 Cb -0.14 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 3mks s VAL 406 CO 0.04 0.51 -0.22 -0.31 0.00 0.00 0.00 175.10 175.12 3mks s TYR 407 N 0.82 1.89 -0.30 5.22 1.51 0.24 0.31 117.35 127.04 3mks s TYR 407 Ca -0.05 -0.41 -0.14 0.00 -1.01 0.00 0.00 57.07 55.46 3mks s TYR 407 Cb -0.15 -1.03 -0.03 0.00 -0.11 0.00 0.00 41.96 40.64 3mks s TYR 407 CO -0.00 0.24 0.33 0.34 -1.11 0.00 0.00 175.55 175.34 3mks s ASP 408 N -1.96 6.17 0.24 2.29 3.68 0.16 -0.96 116.67 126.29 3mks s ASP 408 Ca 0.08 0.02 0.26 0.00 2.13 0.00 0.00 52.55 55.04 3mks s ASP 408 Cb -0.10 -2.19 0.77 0.00 -1.45 0.00 0.00 42.92 39.95 3mks s ASP 408 CO 0.05 -0.22 1.76 0.77 0.13 0.00 0.00 175.17 177.66 3mks h SER 409 N 8.33 0.00 0.01 -0.34 4.64 -1.04 -0.33 113.55 124.82 3mks h SER 409 Ca -0.32 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3mks h SER 409 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3mks h SER 409 CO 0.64 0.00 -0.00 0.40 -0.87 0.00 0.00 176.83 177.00 3mks h ILE 410 N 0.00 1.37 -0.07 0.95 2.04 -1.93 -3.34 117.51 116.53 3mks h ILE 410 Ca 0.00 -1.96 0.00 0.00 1.00 0.00 0.00 64.86 63.90 3mks h ILE 410 Cb 0.75 2.56 0.00 0.00 -0.74 0.00 0.00 36.82 39.38 3mks h ILE 410 CO 0.00 0.45 0.00 0.59 0.00 0.00 0.00 178.15 179.19 3mks n ASN 411 N -4.67 1.66 -3.67 1.72 5.03 -1.25 -4.97 115.26 109.11 3mks n ASN 411 Ca -0.08 -1.59 -0.23 0.00 0.87 0.00 0.00 54.58 53.54 3mks n ASN 411 Cb 0.36 -0.04 0.03 0.00 -1.02 0.00 0.00 39.78 39.12 3mks n ASN 411 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3mks n LYS 412 N 0.30 -3.58 -4.08 3.52 5.02 -0.18 -4.99 118.16 114.16 3mks n LYS 412 Ca 0.18 0.59 -0.14 0.00 -2.02 0.00 0.00 58.31 56.92 3mks n LYS 412 Cb 0.36 -4.94 -0.12 0.00 -0.02 0.00 0.00 35.03 30.32 3mks n LYS 412 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3mks s LYS 413 N -5.85 0.58 0.07 1.97 3.01 -0.89 -4.96 119.74 113.66 3mks s LYS 413 Ca 0.17 -0.79 -0.31 0.00 -1.01 0.00 0.00 55.97 54.03 3mks s LYS 413 Cb -0.05 -0.38 -0.08 0.00 -1.01 0.00 0.00 37.83 36.31 3mks s LYS 413 CO 0.82 0.07 1.66 0.12 0.51 0.00 0.00 175.35 178.54 3mks s PHE 414 N -1.35 2.40 -0.15 3.18 5.36 -1.26 0.38 117.98 126.54 3mks s PHE 414 Ca -0.09 0.30 -0.11 0.00 -0.96 0.00 0.00 56.93 56.08 3mks s PHE 414 Cb -0.10 -3.97 -0.06 0.00 -0.34 0.00 0.00 43.02 38.55 3mks s PHE 414 CO 0.01 -3.91 -0.05 -0.07 -1.46 0.00 0.00 175.22 169.73 3mks h LEU 415 N 8.58 0.00 -7.00 6.12 3.38 -0.47 -3.46 115.31 122.46 3mks h LEU 415 Ca -0.43 -0.12 0.13 0.00 0.09 0.00 0.00 57.88 57.56 3mks h LEU 415 Cb 1.20 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.79 3mks h LEU 415 CO 0.93 0.85 0.56 -1.48 0.09 0.00 0.00 178.44 179.39 3mks s LEU 416 N -8.21 -0.32 -0.19 1.67 0.05 -1.02 -5.03 118.68 105.62 3mks s LEU 416 Ca -0.15 0.04 -0.07 0.00 0.05 0.00 0.00 54.13 53.99 3mks s LEU 416 Cb 0.02 1.89 -0.04 0.00 -2.05 0.00 0.00 46.19 46.02 3mks s LEU 416 CO 0.27 -0.52 0.07 -1.58 -0.55 0.00 0.00 176.35 174.03 3mks s GLN 417 N -2.80 3.93 -0.37 1.48 0.74 -1.26 -1.55 119.66 119.83 3mks s GLN 417 Ca 0.05 -0.36 -0.18 0.00 0.05 0.00 0.00 55.36 54.91 3mks s GLN 417 Cb -0.01 -3.24 0.00 0.00 1.10 0.00 0.00 33.01 30.86 3mks s GLN 417 CO -0.07 0.20 0.53 -0.51 -0.55 0.00 0.00 175.29 174.89 3mks s LEU 418 N 0.58 4.43 0.26 3.68 1.43 -0.37 -5.00 118.68 123.69 3mks s LEU 418 Ca 0.03 -0.15 0.11 0.00 -1.03 0.00 0.00 54.13 53.10 3mks s LEU 418 Cb -0.13 -2.59 -0.05 0.00 0.03 0.00 0.00 46.19 43.45 3mks s LEU 418 CO 0.01 -0.55 -0.17 -0.94 0.23 0.00 0.00 176.35 174.93 3mks s SER 419 N 1.81 3.73 0.00 2.29 1.04 -1.26 -1.78 113.70 119.54 3mks s SER 419 Ca 0.19 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.70 3mks s SER 419 Cb -0.15 -0.39 0.00 0.00 0.10 0.00 0.00 66.02 65.57 3mks s SER 419 CO 0.14 0.05 0.00 0.61 0.98 0.00 0.00 173.24 175.03 3mks n GLY 420 N -0.45 2.05 3.57 7.32 0.00 -1.26 -4.80 105.19 111.61 3mks n GLY 420 Ca -0.07 -0.20 -0.49 0.00 0.00 0.00 0.00 46.02 45.26 3mks n GLY 420 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3mks n HIS 421 N 0.00 1.24 -0.10 1.61 8.25 -1.26 -4.86 115.22 120.10 3mks n HIS 421 Ca 0.00 0.70 0.03 0.00 -0.26 0.00 0.00 57.72 58.18 3mks n HIS 421 Cb 0.00 -2.27 0.22 0.00 1.12 0.00 0.00 29.99 29.07 3mks n HIS 421 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3mks n ASP 422 N 1.99 3.70 0.00 0.41 8.00 -1.26 -4.91 116.55 124.48 3mks n ASP 422 Ca 0.15 -2.56 0.00 0.00 0.71 0.00 0.00 54.79 53.09 3mks n ASP 422 Cb 0.24 -0.61 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 3mks n ASP 422 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mks n GLY 423 N 0.29 0.71 1.81 0.44 0.00 -1.26 -4.70 105.19 102.49 3mks n GLY 423 Ca 0.17 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.18 3mks n GLY 423 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mks n GLY 424 N -0.12 -1.07 3.80 -0.02 0.00 -1.24 -4.33 105.19 102.21 3mks n GLY 424 Ca 0.00 0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 3mks n GLY 424 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mks s VAL 425 N -0.63 5.42 0.00 1.61 1.01 -0.91 -1.87 120.40 125.04 3mks s VAL 425 Ca 0.34 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.58 3mks s VAL 425 Cb -0.46 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.45 3mks s VAL 425 CO 0.31 0.51 0.03 0.79 0.00 0.00 0.00 175.10 176.75 3mks n TRP 426 N 2.83 0.00 -3.71 5.22 7.02 -0.61 -3.94 117.44 124.25 3mks n TRP 426 Ca -0.17 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.18 3mks n TRP 426 Cb 0.53 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.32 3mks n TRP 426 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3mks s ALA 427 N -0.16 -1.11 0.03 6.99 0.00 -1.20 -4.78 121.76 121.53 3mks s ALA 427 Ca 0.00 1.35 0.05 0.00 0.00 0.00 0.00 51.96 53.36 3mks s ALA 427 Cb 0.00 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.31 3mks s ALA 427 CO 0.00 -0.23 -0.16 -0.51 0.00 0.00 0.00 175.76 174.86 3mks s LEU 428 N 0.55 2.15 -0.04 0.00 1.43 -1.26 -0.41 118.68 121.10 3mks s LEU 428 Ca -0.03 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.62 3mks s LEU 428 Cb -0.04 -0.73 0.03 0.00 0.03 0.00 0.00 46.19 45.47 3mks s LEU 428 CO -0.03 0.09 0.03 -0.75 0.23 0.00 0.00 176.35 175.92 3mks s LYS 429 N -1.01 0.16 0.26 1.70 2.47 0.15 -4.92 119.74 118.55 3mks s LYS 429 Ca 0.04 0.23 -0.29 0.00 -1.56 0.00 0.00 55.97 54.38 3mks s LYS 429 Cb -0.08 -0.57 -0.09 0.00 -1.46 0.00 0.00 37.83 35.63 3mks s LYS 429 CO 0.01 -0.26 1.13 -0.47 0.16 0.00 0.00 175.35 175.92 3mks s TYR 430 N 1.72 3.51 0.04 4.03 6.14 -1.26 -0.24 117.35 131.30 3mks s TYR 430 Ca -0.00 1.63 0.09 0.00 0.64 0.00 0.00 57.07 59.43 3mks s TYR 430 Cb -0.13 -3.34 -0.03 0.00 0.42 0.00 0.00 41.96 38.89 3mks s TYR 430 CO -0.03 -0.75 -0.24 0.00 0.64 0.00 0.00 175.55 175.16 3mks s ALA 431 N -0.94 2.35 0.07 3.97 0.00 0.23 -4.95 121.76 122.49 3mks s ALA 431 Ca 0.46 -1.25 -0.35 0.00 0.00 0.00 0.00 51.96 50.82 3mks s ALA 431 Cb -0.33 -0.55 -0.15 0.00 0.00 0.00 0.00 23.12 22.10 3mks s ALA 431 CO 0.41 0.54 1.56 1.58 0.00 0.00 0.00 175.76 179.85 3mks n HIS 432 N 1.72 2.02 0.00 0.00 -0.00 -1.26 -2.22 115.22 115.48 3mks n HIS 432 Ca -0.17 0.37 0.00 0.00 0.46 0.00 0.00 57.72 58.38 3mks n HIS 432 Cb 0.52 -2.49 0.00 0.00 -0.12 0.00 0.00 29.99 27.90 3mks n HIS 432 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3mks n GLY 433 N 3.32 1.79 2.32 1.57 0.00 -1.26 -4.52 105.19 108.42 3mks n GLY 433 Ca 0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.05 3mks n GLY 433 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mks n GLY 434 N -0.27 -0.21 3.87 -0.02 0.00 -1.21 -4.92 105.19 102.42 3mks n GLY 434 Ca 0.00 -0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 3mks n GLY 434 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mks s ILE 435 N -2.81 5.46 0.08 -0.61 -1.09 -0.94 -1.99 121.20 119.29 3mks s ILE 435 Ca 0.00 0.27 0.06 0.00 -2.23 0.00 0.00 60.65 58.75 3mks s ILE 435 Cb 0.00 -3.43 -0.03 0.00 -1.58 0.00 0.00 42.46 37.41 3mks s ILE 435 CO 0.00 0.61 -0.15 -1.48 -1.23 0.00 0.00 174.94 172.68 3mks s LEU 436 N -0.96 2.29 -0.08 2.97 0.05 -0.80 0.77 118.68 122.92 3mks s LEU 436 Ca 0.15 -0.65 0.04 0.00 0.05 0.00 0.00 54.13 53.73 3mks s LEU 436 Cb -0.12 -0.58 -0.01 0.00 -2.05 0.00 0.00 46.19 43.43 3mks s LEU 436 CO 0.05 -0.06 -0.21 -0.69 -0.55 0.00 0.00 176.35 174.89 3mks s VAL 437 N -1.35 2.43 -0.01 1.48 1.01 0.67 -0.42 120.40 124.21 3mks s VAL 437 Ca 0.00 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 61.14 3mks s VAL 437 Cb -0.09 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 3mks s VAL 437 CO 0.03 0.56 -0.21 -0.94 0.00 0.00 0.00 175.10 174.53 3mks s SER 438 N -0.02 2.51 0.16 3.32 1.04 -0.30 0.29 113.70 120.70 3mks s SER 438 Ca -0.07 -0.39 0.04 0.00 0.48 0.00 0.00 55.95 56.01 3mks s SER 438 Cb -0.15 -0.28 -0.04 0.00 0.10 0.00 0.00 66.02 65.66 3mks s SER 438 CO 0.05 0.26 0.19 -0.83 0.98 0.00 0.00 173.24 173.88 3mks s GLY 439 N -0.54 1.71 0.31 7.32 0.00 0.46 -1.69 107.32 114.90 3mks s GLY 439 Ca 0.08 -1.15 -0.09 0.00 0.00 0.00 0.00 44.72 43.56 3mks s GLY 439 CO -0.01 -1.16 0.54 -0.45 0.00 0.00 0.00 173.10 172.03 3mks s SER 440 N -3.15 0.32 0.37 1.64 0.15 -1.24 -1.57 113.70 110.23 3mks s SER 440 Ca 0.32 -1.18 0.20 0.00 0.70 0.00 0.00 55.95 55.99 3mks s SER 440 Cb -0.10 0.67 0.50 0.00 -1.71 0.00 0.00 66.02 65.38 3mks s SER 440 CO 0.25 -1.31 1.64 0.71 1.20 0.00 0.00 173.24 175.74 3mks h THR 441 N 2.15 0.62 0.00 6.45 1.35 -1.56 -0.12 112.91 121.79 3mks h THR 441 Ca -0.28 -1.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.02 3mks h THR 441 Cb 1.25 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.73 3mks h THR 441 CO 0.37 0.31 0.00 -0.90 -0.25 0.00 0.00 175.52 175.05 3mks n ASP 442 N -3.29 0.00 -0.23 5.36 5.68 -1.26 -4.44 116.55 118.36 3mks n ASP 442 Ca 0.01 0.09 -0.03 0.00 -0.50 0.00 0.00 54.79 54.36 3mks n ASP 442 Cb 0.57 -0.31 -0.01 0.00 -1.14 0.00 0.00 41.12 40.22 3mks n ASP 442 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3mks n ARG 443 N -1.31 -0.72 -2.29 0.11 1.74 -1.13 -5.01 116.66 108.04 3mks n ARG 443 Ca 0.08 0.42 -0.28 0.00 -0.77 0.00 0.00 57.85 57.29 3mks n ARG 443 Cb 0.15 -4.11 0.02 0.00 -1.02 0.00 0.00 32.46 27.50 3mks n ARG 443 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3mks s THR 444 N -1.86 4.18 -0.25 0.55 -4.23 -1.26 -4.48 115.64 108.29 3mks s THR 444 Ca 0.00 0.30 0.02 0.00 -1.18 0.00 0.00 61.69 60.82 3mks s THR 444 Cb 0.00 -3.65 0.06 0.00 1.34 0.00 0.00 72.50 70.25 3mks s THR 444 CO 0.00 -0.73 -0.06 -0.69 -0.54 0.00 0.00 174.62 172.60 3mks s VAL 445 N -3.01 1.75 -0.02 2.29 1.01 -0.83 -3.74 120.40 117.86 3mks s VAL 445 Ca 0.53 -1.42 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 3mks s VAL 445 Cb -0.11 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 3mks s VAL 445 CO 0.48 -0.12 0.15 -0.13 0.00 0.00 0.00 175.10 175.48 3mks s ARG 446 N 1.28 3.33 -0.13 2.72 0.52 -0.68 -0.77 118.95 125.22 3mks s ARG 446 Ca -0.06 -0.35 0.01 0.00 -0.52 0.00 0.00 55.73 54.81 3mks s ARG 446 Cb -0.19 -3.04 -0.01 0.00 0.52 0.00 0.00 34.95 32.23 3mks s ARG 446 CO -0.06 0.68 -0.16 0.08 0.02 0.00 0.00 175.30 175.85 3mks s VAL 447 N -1.26 2.73 0.09 3.52 1.01 -0.48 -1.15 120.40 124.85 3mks s VAL 447 Ca 0.25 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.53 3mks s VAL 447 Cb -0.12 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 3mks s VAL 447 CO 0.16 0.53 -0.12 0.26 0.00 0.00 0.00 175.10 175.93 3mks s TRP 448 N 0.44 2.69 -0.34 5.22 0.52 0.44 -0.65 118.94 127.27 3mks s TRP 448 Ca -0.12 -0.18 -0.07 0.00 0.02 0.00 0.00 56.10 55.75 3mks s TRP 448 Cb -0.16 -1.44 0.03 0.00 -1.15 0.00 0.00 33.47 30.75 3mks s TRP 448 CO 0.05 0.39 0.12 0.34 0.02 0.00 0.00 176.95 177.87 3mks s ASP 449 N -2.01 5.36 0.04 2.95 3.68 -0.43 -1.90 116.67 124.36 3mks s ASP 449 Ca 0.19 -1.06 -0.25 0.00 2.13 0.00 0.00 52.55 53.56 3mks s ASP 449 Cb -0.11 -1.90 -0.17 0.00 -1.45 0.00 0.00 42.92 39.29 3mks s ASP 449 CO 0.11 -0.32 1.48 0.40 0.13 0.00 0.00 175.17 176.97 3mks h ILE 450 N 6.09 0.96 -0.10 4.11 2.04 -1.68 -1.05 117.51 127.88 3mks h ILE 450 Ca -0.25 -0.45 0.03 0.00 1.00 0.00 0.00 64.86 65.19 3mks h ILE 450 Cb 1.09 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 38.41 3mks h ILE 450 CO 0.61 0.11 0.39 0.11 0.00 0.00 0.00 178.15 179.37 3mks h LYS 451 N -0.41 0.00 -0.00 2.37 1.57 -1.92 0.44 116.57 118.62 3mks h LYS 451 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3mks h LYS 451 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3mks h LYS 451 CO 0.03 0.00 -0.89 1.63 -0.57 0.00 0.00 179.45 179.65 3mks n LYS 452 N -3.07 0.53 -3.43 3.15 5.02 -1.00 -5.02 118.16 114.35 3mks n LYS 452 Ca 0.00 -0.09 -0.19 0.00 -2.02 0.00 0.00 58.31 56.01 3mks n LYS 452 Cb 0.46 -1.44 0.06 0.00 -0.02 0.00 0.00 35.03 34.10 3mks n LYS 452 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mks n GLY 453 N 1.46 -0.86 3.61 0.72 0.00 0.15 -5.03 105.19 105.25 3mks n GLY 453 Ca 0.04 0.41 -0.02 0.00 0.00 0.00 0.00 46.02 46.45 3mks n GLY 453 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mks n THR 456 N 4.02 1.24 -3.80 0.00 -2.24 0.18 -3.78 114.28 109.90 3mks n THR 456 Ca 0.08 -0.67 -0.13 0.00 -2.27 0.00 0.00 64.05 61.06 3mks n THR 456 Cb 0.48 -0.78 -0.14 0.00 -2.10 0.00 0.00 70.33 67.79 3mks n THR 456 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3mks s HIS 457 N -2.43 -0.10 -0.18 4.78 3.76 -1.11 -3.01 115.29 116.99 3mks s HIS 457 Ca -0.16 0.32 -0.00 0.00 -0.15 0.00 0.00 55.06 55.07 3mks s HIS 457 Cb 0.06 -0.05 0.01 0.00 1.11 0.00 0.00 32.58 33.71 3mks s HIS 457 CO 0.66 -0.10 -0.15 0.08 -0.85 0.00 0.00 174.74 174.38 3mks s VAL 458 N 0.62 2.57 -0.60 -0.90 1.01 -1.03 -1.38 120.40 120.69 3mks s VAL 458 Ca -0.05 -0.78 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 3mks s VAL 458 Cb -0.07 -2.11 0.16 0.00 0.00 0.00 0.00 36.38 34.36 3mks s VAL 458 CO -0.03 0.50 0.45 -0.36 0.00 0.00 0.00 175.10 175.67 3mks s PHE 459 N 1.17 3.49 0.77 5.22 2.99 0.05 0.04 117.98 131.71 3mks s PHE 459 Ca 0.01 -2.41 -0.12 0.00 0.00 0.00 0.00 56.93 54.42 3mks s PHE 459 Cb -0.14 -3.36 0.05 0.00 0.00 0.00 0.00 43.02 39.57 3mks s PHE 459 CO -0.06 -0.91 1.14 -1.21 -0.00 0.00 0.00 175.22 174.18 3mks s GLU 460 N 0.38 2.31 0.00 0.44 2.02 -0.50 -1.96 118.70 121.39 3mks s GLU 460 Ca 0.14 0.28 0.00 0.00 0.02 0.00 0.00 54.97 55.40 3mks s GLU 460 Cb -0.20 -1.98 0.00 0.00 0.10 0.00 0.00 34.13 32.05 3mks s GLU 460 CO -0.04 -1.38 0.00 0.41 0.02 0.00 0.00 175.26 174.27 3mks n GLY 461 N -3.12 1.56 0.00 -1.39 0.00 -1.26 -4.48 105.19 96.49 3mks n GLY 461 Ca 0.07 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.40 3mks n GLY 461 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3mks n HIS 462 N 0.10 0.00 -0.33 1.61 8.25 -1.26 -5.01 115.22 118.58 3mks n HIS 462 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.51 3mks n HIS 462 Cb 0.00 0.00 0.29 0.00 1.12 0.00 0.00 29.99 31.40 3mks n HIS 462 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3mks n ASN 463 N 0.00 4.34 -2.40 0.41 4.13 -1.26 -4.85 115.26 115.63 3mks n ASN 463 Ca 0.00 -2.62 -0.02 0.00 1.68 0.00 0.00 54.58 53.62 3mks n ASN 463 Cb 0.00 -0.61 0.01 0.00 -1.54 0.00 0.00 39.78 37.64 3mks n ASN 463 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 3mks n SER 464 N 0.51 -1.03 -4.48 6.41 2.88 -1.26 -4.88 113.62 111.76 3mks n SER 464 Ca 0.20 -1.53 -0.45 0.00 -1.33 0.00 0.00 58.87 55.76 3mks n SER 464 Cb 0.90 1.67 -0.01 0.00 -0.75 0.00 0.00 64.21 66.02 3mks n SER 464 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 3mks n THR 465 N -0.44 1.88 -2.82 2.46 -1.04 -1.26 -4.55 114.28 108.51 3mks n THR 465 Ca -0.01 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.05 61.07 3mks n THR 465 Cb 0.35 -0.52 -0.03 0.00 -1.82 0.00 0.00 70.33 68.31 3mks n THR 465 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3mks s VAL 466 N -1.17 4.34 -0.59 12.58 1.01 -0.07 -2.08 120.40 134.42 3mks s VAL 466 Ca 0.62 -0.69 0.25 0.00 0.00 0.00 0.00 61.98 62.15 3mks s VAL 466 Cb -0.75 -4.77 0.24 0.00 0.00 0.00 0.00 36.38 31.10 3mks s VAL 466 CO 0.58 -1.56 1.60 -0.09 0.00 0.00 0.00 175.10 175.63 3mks h ARG 467 N 9.42 0.00 -3.08 2.72 2.43 -1.32 -3.34 114.38 121.22 3mks h ARG 467 Ca -0.10 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 3mks h ARG 467 Cb 1.05 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.52 3mks h ARG 467 CO 1.20 0.00 0.17 0.00 -1.51 0.00 0.00 179.97 179.83 3mks s LEU 469 N -2.86 -0.20 0.19 0.00 2.96 -1.26 -0.92 118.68 116.58 3mks s LEU 469 Ca 0.08 0.24 -0.14 0.00 -0.22 0.00 0.00 54.13 54.09 3mks s LEU 469 Cb -0.03 1.46 0.01 0.00 0.50 0.00 0.00 46.19 48.13 3mks s LEU 469 CO -0.01 -0.17 0.44 -0.62 -1.32 0.00 0.00 176.35 174.67 3mks s ASP 470 N -0.91 -0.15 -0.05 3.68 -1.08 -0.44 -4.90 116.67 112.82 3mks s ASP 470 Ca 0.04 -0.64 0.04 0.00 -0.52 0.00 0.00 52.55 51.47 3mks s ASP 470 Cb -0.01 0.53 -0.00 0.00 -1.46 0.00 0.00 42.92 41.98 3mks s ASP 470 CO -0.04 -1.01 -0.18 -0.63 0.52 0.00 0.00 175.17 173.83 3mks s ILE 471 N -3.92 1.50 0.22 4.11 1.01 -1.26 -0.07 121.20 122.79 3mks s ILE 471 Ca 0.13 -0.75 0.03 0.00 0.00 0.00 0.00 60.65 60.06 3mks s ILE 471 Cb 0.00 -1.29 -0.05 0.00 0.01 0.00 0.00 42.46 41.13 3mks s ILE 471 CO -0.01 0.43 0.01 0.68 0.00 0.00 0.00 174.94 176.05 3mks s VAL 472 N 0.08 0.90 0.09 2.92 -7.23 -0.65 -4.91 120.40 111.59 3mks s VAL 472 Ca -0.05 -2.02 0.03 0.00 -1.81 0.00 0.00 61.98 58.14 3mks s VAL 472 Cb -0.12 -2.30 -0.03 0.00 0.56 0.00 0.00 36.38 34.48 3mks s VAL 472 CO 0.03 -0.34 -0.10 -0.70 -0.31 0.00 0.00 175.10 173.68 3mks s GLU 473 N -3.89 0.79 -0.30 4.82 2.12 -1.26 -1.64 118.70 119.35 3mks s GLU 473 Ca 0.28 -1.09 -0.17 0.00 0.36 0.00 0.00 54.97 54.35 3mks s GLU 473 Cb 0.06 -0.50 0.22 0.00 0.26 0.00 0.00 34.13 34.16 3mks s GLU 473 CO 0.08 0.08 1.30 -0.47 -0.54 0.00 0.00 175.26 175.71 3mks s TYR 474 N -2.24 -0.00 -0.84 5.30 5.04 -0.86 -2.55 117.35 121.19 3mks s TYR 474 Ca 0.03 0.01 -0.01 0.00 -2.44 0.00 0.00 57.07 54.65 3mks s TYR 474 Cb -0.04 0.00 0.00 0.00 0.35 0.00 0.00 41.96 42.27 3mks s TYR 474 CO -0.00 -0.00 0.61 1.63 -1.34 0.00 0.00 175.55 176.45 3mks n LYS 475 N 3.27 -1.49 -0.34 4.97 5.02 -1.26 -2.48 118.16 125.85 3mks n LYS 475 Ca -0.15 0.75 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 3mks n LYS 475 Cb 0.56 -2.39 0.00 0.00 -0.02 0.00 0.00 35.03 33.18 3mks n LYS 475 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3mks n ASN 476 N -2.59 0.00 -4.65 4.39 2.85 -1.26 -4.93 115.26 109.08 3mks n ASN 476 Ca -0.31 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 53.85 3mks n ASN 476 Cb 0.69 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.61 3mks n ASN 476 CO 0.00 0.00 0.00 -0.51 -2.11 0.00 0.00 177.26 174.64 3mks s ILE 477 N -0.04 3.91 -0.13 -1.44 1.10 -1.03 -5.14 121.20 118.43 3mks s ILE 477 Ca 0.00 -0.76 -0.07 0.00 -0.51 0.00 0.00 60.65 59.31 3mks s ILE 477 Cb 0.00 -2.75 -0.04 0.00 0.15 0.00 0.00 42.46 39.82 3mks s ILE 477 CO 0.00 0.33 0.12 -0.54 -2.11 0.00 0.00 174.94 172.74 3mks s LYS 478 N -1.67 3.48 0.15 3.50 1.02 -1.26 -2.03 119.74 122.94 3mks s LYS 478 Ca 0.20 -0.17 0.06 0.00 0.02 0.00 0.00 55.97 56.08 3mks s LYS 478 Cb -0.11 -3.17 -0.04 0.00 -0.52 0.00 0.00 37.83 33.98 3mks s LYS 478 CO 0.11 0.72 -0.14 0.71 -0.92 0.00 0.00 175.35 175.83 3mks s TYR 479 N -0.86 1.48 -0.14 3.18 2.02 -0.65 -2.30 117.35 120.08 3mks s TYR 479 Ca 0.14 -0.60 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 3mks s TYR 479 Cb -0.12 -0.74 -0.00 0.00 -0.40 0.00 0.00 41.96 40.70 3mks s TYR 479 CO 0.03 0.20 -0.16 0.42 -1.57 0.00 0.00 175.55 174.48 3mks s ILE 480 N -2.64 2.69 -0.18 2.71 1.01 0.11 -1.64 121.20 123.26 3mks s ILE 480 Ca 0.15 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 59.99 3mks s ILE 480 Cb -0.02 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 3mks s ILE 480 CO 0.04 0.52 -0.03 -0.69 0.00 0.00 0.00 174.94 174.78 3mks s VAL 481 N 0.67 3.76 -0.17 2.92 1.01 0.90 -0.99 120.40 128.49 3mks s VAL 481 Ca -0.08 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.52 3mks s VAL 481 Cb -0.16 -2.67 0.02 0.00 0.00 0.00 0.00 36.38 33.57 3mks s VAL 481 CO 0.02 0.46 -0.19 -0.89 0.00 0.00 0.00 175.10 174.50 3mks s THR 482 N 0.80 1.95 0.02 3.92 2.01 -0.03 -1.33 115.64 122.98 3mks s THR 482 Ca -0.01 -0.87 0.05 0.00 0.31 0.00 0.00 61.69 61.17 3mks s THR 482 Cb -0.14 -1.77 -0.03 0.00 0.01 0.00 0.00 72.50 70.56 3mks s THR 482 CO 0.02 0.52 -0.11 -0.83 -0.69 0.00 0.00 174.62 173.53 3mks s GLY 483 N 1.33 1.68 0.03 4.40 0.00 -0.10 -0.50 107.32 114.15 3mks s GLY 483 Ca 0.05 -1.09 0.02 0.00 0.00 0.00 0.00 44.72 43.70 3mks s GLY 483 CO -0.12 -0.97 -0.07 -0.45 0.00 0.00 0.00 173.10 171.49 3mks s SER 484 N -1.43 0.79 0.00 1.64 0.15 -1.23 -0.95 113.70 112.67 3mks s SER 484 Ca 0.16 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.37 3mks s SER 484 Cb -0.11 0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 3mks s SER 484 CO 0.07 -0.14 0.12 0.54 1.20 0.00 0.00 173.24 175.03 3mks n ARG 485 N 1.82 0.00 -0.23 5.44 1.74 -0.88 -1.42 116.66 123.13 3mks n ARG 485 Ca -0.20 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 56.96 3mks n ARG 485 Cb 0.55 -1.14 0.20 0.00 -1.02 0.00 0.00 32.46 31.06 3mks n ARG 485 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3mks n ASP 486 N -0.59 3.23 0.00 0.55 5.68 -1.26 -4.46 116.55 119.70 3mks n ASP 486 Ca 0.00 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.33 3mks n ASP 486 Cb 0.00 -0.30 0.00 0.00 -1.14 0.00 0.00 41.12 39.68 3mks n ASP 486 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3mks n ASN 487 N 0.96 0.00 -4.60 -1.12 5.03 -1.01 -4.96 115.26 109.57 3mks n ASN 487 Ca 0.16 0.00 -0.27 0.00 0.87 0.00 0.00 54.58 55.34 3mks n ASN 487 Cb 0.49 0.00 -0.11 0.00 -1.02 0.00 0.00 39.78 39.15 3mks n ASN 487 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 3mks s THR 488 N -2.36 2.13 0.24 3.41 -4.23 -1.26 -3.61 115.64 109.96 3mks s THR 488 Ca 0.00 -2.07 0.11 0.00 -1.18 0.00 0.00 61.69 58.55 3mks s THR 488 Cb 0.00 -2.86 -0.05 0.00 1.34 0.00 0.00 72.50 70.94 3mks s THR 488 CO 0.00 -0.09 -0.15 -0.76 -0.54 0.00 0.00 174.62 173.09 3mks s LEU 489 N -3.68 2.76 -0.03 4.79 1.43 -1.06 -3.47 118.68 119.42 3mks s LEU 489 Ca 0.34 -0.83 0.06 0.00 -1.03 0.00 0.00 54.13 52.68 3mks s LEU 489 Cb 0.06 -1.35 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 3mks s LEU 489 CO 0.18 0.06 -0.21 -1.00 0.23 0.00 0.00 176.35 175.61 3mks s HIS 490 N -2.13 2.48 -0.19 0.29 3.76 0.34 -0.32 115.29 119.52 3mks s HIS 490 Ca 0.27 -0.33 -0.02 0.00 -0.15 0.00 0.00 55.06 54.84 3mks s HIS 490 Cb -0.07 -1.55 -0.00 0.00 1.11 0.00 0.00 32.58 32.07 3mks s HIS 490 CO 0.15 0.06 -0.11 0.08 -0.85 0.00 0.00 174.74 174.07 3mks s VAL 491 N -0.67 2.91 0.35 -0.90 1.01 0.05 -0.85 120.40 122.30 3mks s VAL 491 Ca 0.11 -0.66 0.07 0.00 0.00 0.00 0.00 61.98 61.49 3mks s VAL 491 Cb -0.10 -2.28 -0.07 0.00 0.00 0.00 0.00 36.38 33.93 3mks s VAL 491 CO -0.00 0.48 -0.03 0.26 0.00 0.00 0.00 175.10 175.81 3mks s TRP 492 N 1.17 2.26 -0.16 5.22 0.52 -0.16 0.06 118.94 127.85 3mks s TRP 492 Ca 0.02 -0.67 -0.05 0.00 0.02 0.00 0.00 56.10 55.42 3mks s TRP 492 Cb -0.14 -1.42 -0.03 0.00 -1.15 0.00 0.00 33.47 30.72 3mks s TRP 492 CO -0.04 0.38 -0.00 -1.59 0.02 0.00 0.00 176.95 175.72 3mks s LYS 493 N -3.71 3.75 0.09 4.98 -2.85 0.23 0.06 119.74 122.28 3mks s LYS 493 Ca 0.33 -0.45 -0.31 0.00 -1.00 0.00 0.00 55.97 54.54 3mks s LYS 493 Cb 0.06 -3.01 -0.09 0.00 -2.06 0.00 0.00 37.83 32.73 3mks s LYS 493 CO 0.16 0.28 1.63 -1.17 0.10 0.00 0.00 175.35 176.34 3mks s LEU 494 N 0.30 4.36 -0.12 2.77 2.96 -0.97 -4.83 118.68 123.15 3mks s LEU 494 Ca -0.01 2.50 -0.29 0.00 -0.22 0.00 0.00 54.13 56.11 3mks s LEU 494 Cb -0.13 -3.57 -0.06 0.00 0.50 0.00 0.00 46.19 42.93 3mks s LEU 494 CO 0.02 -0.87 1.91 -2.84 -1.32 0.00 0.00 176.35 173.25 3mks s PRO 495 N 2.35 3.76 0.00 0.98 0.02 -1.26 -4.81 135.00 136.04 3mks s PRO 495 Ca 0.73 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.89 3mks s PRO 495 Cb -0.40 -4.17 0.00 0.00 0.02 0.00 0.00 34.50 29.95 3mks s PRO 495 CO 0.32 -1.36 0.00 1.63 -0.33 0.00 0.00 177.00 177.26 3mks n LYS 496 N 7.88 0.00 0.00 5.54 5.02 -1.26 -5.17 118.16 130.16 3mks n LYS 496 Ca 0.22 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 3mks n LYS 496 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 3mks n LYS 496 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3mks n ASP 508 N 0.00 0.00 0.06 4.39 4.64 -1.26 -5.24 116.55 119.14 3mks n ASP 508 Ca 0.00 0.00 -0.04 0.00 -1.38 0.00 0.00 54.79 53.37 3mks n ASP 508 Cb 0.00 0.00 -0.09 0.00 -1.04 0.00 0.00 41.12 39.99 3mks n ASP 508 CO 0.00 0.00 0.00 1.88 -0.82 0.00 0.00 177.20 178.26 3mks h TYR 509 N 0.00 0.00 -0.85 -0.67 0.99 -1.93 -3.37 116.97 111.14 3mks h TYR 509 Ca 0.00 0.00 -0.45 0.00 2.00 0.00 0.00 58.73 60.28 3mks h TYR 509 Cb 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 36.73 37.66 3mks h TYR 509 CO 0.00 0.84 1.19 -2.14 -0.00 0.00 0.00 178.16 178.06 3mks s PRO 510 N -2.77 3.07 -0.86 4.88 0.02 -1.25 -4.12 135.00 133.97 3mks s PRO 510 Ca 0.00 -0.86 -0.19 0.00 0.02 0.00 0.00 61.00 59.97 3mks s PRO 510 Cb 0.09 -5.24 0.12 0.00 0.02 0.00 0.00 34.50 29.49 3mks s PRO 510 CO 0.80 -2.91 1.06 -1.17 -0.33 0.00 0.00 177.00 174.46 3mks s LEU 511 N 7.74 5.04 0.02 -5.54 0.20 -1.16 -4.95 118.68 120.03 3mks s LEU 511 Ca 0.59 -1.87 -0.09 0.00 0.69 0.00 0.00 54.13 53.46 3mks s LEU 511 Cb -0.03 -2.39 -0.05 0.00 -0.43 0.00 0.00 46.19 43.30 3mks s LEU 511 CO -0.02 -1.10 0.32 -0.69 -0.29 0.00 0.00 176.35 174.57 3mks s VAL 512 N 2.79 5.22 -0.32 1.68 1.01 -1.26 -2.45 120.40 127.06 3mks s VAL 512 Ca 0.29 0.34 0.01 0.00 0.00 0.00 0.00 61.98 62.62 3mks s VAL 512 Cb -0.08 -3.60 0.10 0.00 0.00 0.00 0.00 36.38 32.80 3mks s VAL 512 CO -0.06 0.38 0.08 -0.36 0.00 0.00 0.00 175.10 175.14 3mks s PHE 513 N -1.29 2.61 -0.00 5.22 0.40 0.11 -4.90 117.98 120.13 3mks s PHE 513 Ca 0.28 -2.30 0.26 0.00 -0.60 0.00 0.00 56.93 54.57 3mks s PHE 513 Cb -0.14 -2.25 0.86 0.00 0.51 0.00 0.00 43.02 42.00 3mks s PHE 513 CO 0.16 -0.91 1.79 0.45 0.70 0.00 0.00 175.22 177.41 3mks h HIS 514 N 7.87 0.00 -3.79 0.36 3.86 -1.90 -1.32 115.15 120.23 3mks h HIS 514 Ca -0.09 0.00 -0.68 0.00 -1.16 0.00 0.00 60.37 58.44 3mks h HIS 514 Cb 1.02 0.00 -0.35 0.00 1.06 0.00 0.00 27.41 29.14 3mks h HIS 514 CO 0.40 0.15 -0.73 0.99 0.86 0.00 0.00 177.93 179.61 3mks s THR 515 N -3.51 2.64 0.21 2.45 2.01 -1.26 -4.59 115.64 113.58 3mks s THR 515 Ca 0.02 -1.59 -0.06 0.00 0.31 0.00 0.00 61.69 60.38 3mks s THR 515 Cb 0.09 -2.58 0.04 0.00 0.01 0.00 0.00 72.50 70.06 3mks s THR 515 CO 0.63 -0.15 1.63 -0.65 -0.69 0.00 0.00 174.62 175.39 3mks h PRO 516 N 7.89 0.85 0.00 4.92 0.11 -1.85 0.87 132.00 144.79 3mks h PRO 516 Ca -0.19 -0.32 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3mks h PRO 516 Cb 1.05 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3mks h PRO 516 CO 0.51 0.96 0.00 0.93 -0.21 0.00 0.00 178.00 180.19 3mks h GLU 517 N 0.75 0.00 -0.16 1.05 4.39 -1.95 -3.07 114.58 115.59 3mks h GLU 517 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 3mks h GLU 517 Cb 0.69 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 3mks h GLU 517 CO 0.05 0.00 0.00 0.39 -1.16 0.00 0.00 179.01 178.29 3mks n GLU 518 N -2.53 2.48 -3.37 2.33 1.02 -0.88 -4.92 120.64 114.76 3mks n GLU 518 Ca 0.02 -1.66 -0.39 0.00 -0.02 0.00 0.00 57.16 55.11 3mks n GLU 518 Cb 0.29 -1.14 -0.09 0.00 -0.02 0.00 0.00 31.44 30.49 3mks n GLU 518 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3mks s ASN 519 N -0.93 6.30 0.25 1.62 3.04 0.25 -4.94 114.94 120.54 3mks s ASN 519 Ca 0.12 0.35 -0.04 0.00 0.04 0.00 0.00 52.86 53.33 3mks s ASN 519 Cb 0.06 -2.22 0.40 0.00 -1.54 0.00 0.00 41.25 37.95 3mks s ASN 519 CO 0.08 -0.18 1.84 -0.65 -3.04 0.00 0.00 177.10 175.16 3mks h PRO 520 N 8.02 0.93 0.00 0.43 0.11 -1.90 -3.01 132.00 136.58 3mks h PRO 520 Ca -0.32 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3mks h PRO 520 Cb 1.16 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3mks h PRO 520 CO 0.66 0.62 0.00 0.66 -0.21 0.00 0.00 178.00 179.73 3mks n TYR 521 N -4.63 0.00 -3.13 0.65 4.01 -1.26 -4.75 117.16 108.04 3mks n TYR 521 Ca 0.14 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.48 3mks n TYR 521 Cb 0.23 -0.11 -0.06 0.00 -0.31 0.00 0.00 39.34 39.09 3mks n TYR 521 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 3mks s PHE 522 N -2.22 3.36 0.00 -0.72 5.36 -1.14 0.75 117.98 123.38 3mks s PHE 522 Ca 0.36 0.90 0.00 0.00 -0.96 0.00 0.00 56.93 57.23 3mks s PHE 522 Cb 0.19 -2.79 0.00 0.00 -0.34 0.00 0.00 43.02 40.08 3mks s PHE 522 CO 0.36 -0.18 0.00 0.28 -1.46 0.00 0.00 175.22 174.22 3mks n VAL 523 N 4.73 0.00 -3.06 3.12 0.31 0.11 -4.94 118.33 118.60 3mks n VAL 523 Ca -0.02 0.44 0.00 0.00 -0.01 0.00 0.00 64.34 64.76 3mks n VAL 523 Cb 0.50 -1.37 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 3mks n VAL 523 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3mks n GLY 524 N 1.91 2.47 3.49 2.92 0.00 -1.13 -5.00 105.19 109.84 3mks n GLY 524 Ca 0.00 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 3mks n GLY 524 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mks s VAL 525 N -2.80 3.13 -0.53 1.61 1.01 -1.26 -0.77 120.40 120.78 3mks s VAL 525 Ca 0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.28 3mks s VAL 525 Cb 0.00 -2.23 0.14 0.00 0.00 0.00 0.00 36.38 34.29 3mks s VAL 525 CO 0.00 0.59 0.31 -0.76 0.00 0.00 0.00 175.10 175.24 3mks s LEU 526 N -0.72 4.91 -0.02 3.92 1.02 0.57 -4.98 118.68 123.39 3mks s LEU 526 Ca 0.11 -2.70 -0.16 0.00 0.02 0.00 0.00 54.13 51.40 3mks s LEU 526 Cb -0.11 -1.76 -0.05 0.00 0.02 0.00 0.00 46.19 44.29 3mks s LEU 526 CO 0.01 -0.36 0.45 -0.13 0.02 0.00 0.00 176.35 176.34 3mks s ARG 527 N 0.16 4.09 0.00 1.70 0.52 -1.26 -2.56 118.95 121.60 3mks s ARG 527 Ca 0.15 0.47 0.00 0.00 -0.52 0.00 0.00 55.73 55.83 3mks s ARG 527 Cb -0.22 -3.29 0.00 0.00 0.52 0.00 0.00 34.95 31.96 3mks s ARG 527 CO -0.03 0.53 0.00 0.41 0.02 0.00 0.00 175.30 176.23 3mks n GLY 528 N 2.23 -2.42 3.55 -3.53 0.00 -1.26 -5.03 105.19 98.73 3mks n GLY 528 Ca -0.11 0.81 -0.51 0.00 0.00 0.00 0.00 46.02 46.20 3mks n GLY 528 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3mks n HIS 529 N -0.42 1.02 1.67 1.61 8.25 -1.24 -4.87 115.22 121.23 3mks n HIS 529 Ca 0.00 0.78 0.14 0.00 -0.26 0.00 0.00 57.72 58.38 3mks n HIS 529 Cb 0.00 -2.22 0.64 0.00 1.12 0.00 0.00 29.99 29.54 3mks n HIS 529 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3mks n MET 530 N 1.74 1.41 -3.87 -0.41 0.00 -1.26 -4.64 117.12 110.09 3mks n MET 530 Ca 0.17 -0.59 -0.17 0.00 0.00 0.00 0.00 57.70 57.10 3mks n MET 530 Cb 0.21 -1.46 -0.06 0.00 0.00 0.00 0.00 33.22 31.90 3mks n MET 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3mks n ALA 531 N -0.26 0.56 -1.58 3.04 0.00 -1.26 -4.94 120.51 116.06 3mks n ALA 531 Ca 0.20 -1.62 -0.44 0.00 0.00 0.00 0.00 53.44 51.58 3mks n ALA 531 Cb 0.25 1.25 -0.01 0.00 0.00 0.00 0.00 19.45 20.94 3mks n ALA 531 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3mks n SER 532 N -1.84 1.08 -4.51 0.00 2.88 -1.26 -3.68 113.62 106.29 3mks n SER 532 Ca 0.03 1.12 -0.43 0.00 -1.33 0.00 0.00 58.87 58.27 3mks n SER 532 Cb 0.50 -1.28 -0.08 0.00 -0.75 0.00 0.00 64.21 62.59 3mks n SER 532 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3mks s VAL 533 N -1.14 4.99 -0.19 2.46 1.01 -0.51 -1.30 120.40 125.72 3mks s VAL 533 Ca 0.60 -0.10 0.21 0.00 0.00 0.00 0.00 61.98 62.69 3mks s VAL 533 Cb -0.66 -4.08 -0.07 0.00 0.00 0.00 0.00 36.38 31.56 3mks s VAL 533 CO 0.59 -0.45 0.92 -1.14 0.00 0.00 0.00 175.10 175.02 3mks n ARG 534 N 5.85 0.62 -3.60 2.72 3.00 -0.90 -3.97 116.66 120.37 3mks n ARG 534 Ca -0.05 0.12 -0.14 0.00 -0.00 0.00 0.00 57.85 57.79 3mks n ARG 534 Cb 0.48 -1.79 -0.07 0.00 0.00 0.00 0.00 32.46 31.08 3mks n ARG 534 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 3mks s THR 535 N -3.24 0.00 -0.11 5.15 -1.32 -1.19 -4.72 115.64 110.21 3mks s THR 535 Ca -0.02 0.00 -0.14 0.00 -1.21 0.00 0.00 61.69 60.32 3mks s THR 535 Cb 0.10 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 70.12 3mks s THR 535 CO 0.81 0.00 0.36 -0.69 -2.21 0.00 0.00 174.62 172.89 3mks s VAL 536 N -0.23 0.01 -0.19 5.08 1.01 -1.26 -1.32 120.40 123.50 3mks s VAL 536 Ca -0.02 -0.12 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 3mks s VAL 536 Cb -0.03 -0.56 0.07 0.00 0.00 0.00 0.00 36.38 35.86 3mks s VAL 536 CO 0.02 -0.07 0.45 -0.55 0.00 0.00 0.00 175.10 174.95 3mks s SER 537 N -0.23 -0.54 0.13 3.32 0.15 -0.81 -4.81 113.70 110.92 3mks s SER 537 Ca -0.04 1.00 -0.18 0.00 0.70 0.00 0.00 55.95 57.43 3mks s SER 537 Cb -0.03 0.98 0.05 0.00 -1.71 0.00 0.00 66.02 65.30 3mks s SER 537 CO 0.02 -0.21 0.46 -0.83 1.20 0.00 0.00 173.24 173.88 3mks s GLY 538 N 1.67 -0.37 0.16 9.45 0.00 -1.26 -1.03 107.32 115.94 3mks s GLY 538 Ca -0.08 0.11 -0.03 0.00 0.00 0.00 0.00 44.72 44.72 3mks s GLY 538 CO -0.14 -0.17 0.14 -1.58 0.00 0.00 0.00 173.10 171.35 3mks s HIS 539 N -3.78 0.83 0.00 1.90 2.46 -0.84 -4.79 115.29 111.07 3mks s HIS 539 Ca 0.02 -1.16 0.00 0.00 0.47 0.00 0.00 55.06 54.39 3mks s HIS 539 Cb 0.01 -0.39 0.00 0.00 -0.13 0.00 0.00 32.58 32.07 3mks s HIS 539 CO -0.12 -0.61 0.00 0.41 -2.47 0.00 0.00 174.74 171.95 3mks n GLY 540 N -0.17 3.59 0.90 1.59 0.00 -1.06 -2.23 105.19 107.81 3mks n GLY 540 Ca -0.04 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.00 3mks n GLY 540 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3mks n ASN 541 N 4.89 2.87 -4.62 1.61 6.94 -1.26 -4.15 115.26 121.54 3mks n ASN 541 Ca 0.00 -1.94 -0.36 0.00 -0.02 0.00 0.00 54.58 52.26 3mks n ASN 541 Cb 0.00 0.03 -0.10 0.00 -2.36 0.00 0.00 39.78 37.35 3mks n ASN 541 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3mks s ILE 542 N -1.96 5.12 0.03 1.53 -1.09 -0.95 -1.33 121.20 122.55 3mks s ILE 542 Ca 0.26 0.09 0.06 0.00 -2.23 0.00 0.00 60.65 58.84 3mks s ILE 542 Cb 0.19 -3.38 -0.02 0.00 -1.58 0.00 0.00 42.46 37.67 3mks s ILE 542 CO 0.31 0.36 -0.18 -0.69 -1.23 0.00 0.00 174.94 173.50 3mks s VAL 543 N 1.07 1.42 -0.06 2.92 1.01 -0.88 -1.99 120.40 123.89 3mks s VAL 543 Ca 0.06 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 61.01 3mks s VAL 543 Cb -0.14 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.01 3mks s VAL 543 CO 0.04 0.16 -0.12 -0.69 0.00 0.00 0.00 175.10 174.49 3mks s VAL 544 N -0.76 1.13 0.06 2.92 1.01 -0.19 0.44 120.40 125.01 3mks s VAL 544 Ca 0.05 -0.49 0.10 0.00 0.00 0.00 0.00 61.98 61.64 3mks s VAL 544 Cb -0.08 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 3mks s VAL 544 CO 0.01 0.35 -0.26 -0.94 0.00 0.00 0.00 175.10 174.26 3mks s SER 545 N 0.58 3.24 -0.07 3.32 1.04 -0.26 -1.92 113.70 119.63 3mks s SER 545 Ca -0.13 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.73 3mks s SER 545 Cb -0.15 -0.29 -0.00 0.00 0.10 0.00 0.00 66.02 65.68 3mks s SER 545 CO 0.03 0.24 -0.20 -0.83 0.98 0.00 0.00 173.24 173.47 3mks s GLY 546 N -1.41 1.10 0.23 7.32 0.00 -0.44 -1.46 107.32 112.66 3mks s GLY 546 Ca 0.12 -0.79 0.11 0.00 0.00 0.00 0.00 44.72 44.16 3mks s GLY 546 CO 0.03 -0.30 -0.19 -0.45 0.00 0.00 0.00 173.10 172.19 3mks s SER 547 N 0.23 3.69 0.43 1.64 0.15 -0.11 -2.12 113.70 117.61 3mks s SER 547 Ca -0.11 -0.86 0.22 0.00 0.70 0.00 0.00 55.95 55.90 3mks s SER 547 Cb -0.15 -0.38 1.19 0.00 -1.71 0.00 0.00 66.02 64.97 3mks s SER 547 CO 0.05 0.08 1.63 1.88 1.20 0.00 0.00 173.24 178.08 3mks h TYR 548 N 2.76 0.00 0.00 3.44 0.05 -1.40 -1.90 116.97 119.92 3mks h TYR 548 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.34 3mks h TYR 548 Cb 1.23 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.97 3mks h TYR 548 CO 0.72 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 177.43 3mks n ASP 549 N -2.39 0.03 0.00 3.88 5.75 -1.26 -4.31 116.55 118.25 3mks n ASP 549 Ca -0.01 -1.77 0.00 0.00 -0.01 0.00 0.00 54.79 52.99 3mks n ASP 549 Cb 0.24 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 3mks n ASP 549 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3mks n ASN 550 N -0.48 0.00 -4.67 -1.12 3.02 -0.78 -4.99 115.26 106.24 3mks n ASN 550 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.29 3mks n ASN 550 Cb 0.01 -0.62 -0.01 0.00 -0.61 0.00 0.00 39.78 38.55 3mks n ASN 550 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3mks n THR 551 N -2.00 0.00 -3.94 3.41 -2.24 -1.26 -4.16 114.28 104.09 3mks n THR 551 Ca 0.00 -2.11 -0.10 0.00 -2.27 0.00 0.00 64.05 59.57 3mks n THR 551 Cb 0.00 0.04 -0.11 0.00 -2.10 0.00 0.00 70.33 68.16 3mks n THR 551 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3mks s LEU 552 N 0.00 2.06 0.02 3.22 1.02 -1.01 -0.93 118.68 123.05 3mks s LEU 552 Ca 0.25 -0.36 0.08 0.00 0.02 0.00 0.00 54.13 54.12 3mks s LEU 552 Cb -0.02 0.21 -0.02 0.00 0.02 0.00 0.00 46.19 46.38 3mks s LEU 552 CO 0.16 -0.27 -0.25 -0.63 0.02 0.00 0.00 176.35 175.37 3mks s ILE 553 N -1.22 2.04 -0.24 -0.59 1.09 -0.53 -1.16 121.20 120.58 3mks s ILE 553 Ca -0.13 -1.25 -0.09 0.00 -1.10 0.00 0.00 60.65 58.08 3mks s ILE 553 Cb -0.08 -1.72 -0.04 0.00 -1.06 0.00 0.00 42.46 39.56 3mks s ILE 553 CO -0.00 0.43 0.10 -0.69 -0.10 0.00 0.00 174.94 174.68 3mks s VAL 554 N -0.72 4.79 0.15 2.92 1.01 -0.97 -1.10 120.40 126.48 3mks s VAL 554 Ca 0.11 -0.02 0.08 0.00 0.00 0.00 0.00 61.98 62.15 3mks s VAL 554 Cb -0.10 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 3mks s VAL 554 CO 0.01 0.35 -0.06 0.26 0.00 0.00 0.00 175.10 175.66 3mks s TRP 555 N 1.22 2.75 -0.45 5.22 0.52 0.17 0.45 118.94 128.83 3mks s TRP 555 Ca 0.06 -0.17 0.03 0.00 0.02 0.00 0.00 56.10 56.04 3mks s TRP 555 Cb -0.14 -1.37 0.12 0.00 -1.15 0.00 0.00 33.47 30.92 3mks s TRP 555 CO 0.04 0.49 0.18 0.34 0.02 0.00 0.00 176.95 178.03 3mks s ASP 556 N -2.65 4.65 0.45 2.95 -1.08 -0.31 -2.08 116.67 118.59 3mks s ASP 556 Ca 0.25 -2.58 0.31 0.00 -0.52 0.00 0.00 52.55 50.00 3mks s ASP 556 Cb -0.10 -1.67 1.55 0.00 -1.46 0.00 0.00 42.92 41.24 3mks s ASP 556 CO 0.16 -0.33 1.93 0.58 0.52 0.00 0.00 175.17 178.03 3mks h VAL 557 N 6.00 0.00 0.04 1.11 2.07 -1.51 0.38 116.25 124.34 3mks h VAL 557 Ca -0.06 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 3mks h VAL 557 Cb 0.96 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3mks h VAL 557 CO 0.62 0.00 -0.02 0.00 0.02 0.00 0.00 177.57 178.19 3mks h ALA 558 N 2.05 -0.05 -0.56 1.67 0.00 -1.95 -3.25 119.26 117.17 3mks h ALA 558 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3mks h ALA 558 Cb 0.14 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3mks h ALA 558 CO 0.00 -0.44 0.00 1.04 0.00 0.00 0.00 179.25 179.85 3mks n GLN 559 N -5.03 2.62 -4.13 0.00 6.02 -0.12 -4.97 117.38 111.77 3mks n GLN 559 Ca -0.08 -2.44 -0.32 0.00 -0.01 0.00 0.00 57.00 54.15 3mks n GLN 559 Cb 0.13 -1.51 -0.05 0.00 1.02 0.00 0.00 30.24 29.83 3mks n GLN 559 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3mks n MET 560 N 1.44 -1.48 -4.48 -1.09 2.81 0.12 -4.92 117.12 109.53 3mks n MET 560 Ca 0.21 0.20 -0.23 0.00 -1.81 0.00 0.00 57.70 56.07 3mks n MET 560 Cb 0.59 -3.69 -0.16 0.00 -0.71 0.00 0.00 33.22 29.25 3mks n MET 560 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 3mks s LYS 561 N -7.08 1.41 0.15 0.03 2.20 -1.01 -4.97 119.74 110.47 3mks s LYS 561 Ca 0.12 -0.34 -0.30 0.00 -0.36 0.00 0.00 55.97 55.09 3mks s LYS 561 Cb -0.06 -1.21 -0.08 0.00 -1.51 0.00 0.00 37.83 34.97 3mks s LYS 561 CO 0.96 0.03 1.24 0.00 -0.36 0.00 0.00 175.35 177.21 3mks n LEU 563 N 3.04 1.31 -3.92 0.00 4.77 0.17 -4.96 117.00 117.42 3mks n LEU 563 Ca 0.07 0.22 -0.10 0.00 -0.03 0.00 0.00 56.01 56.17 3mks n LEU 563 Cb 0.44 -0.54 -0.11 0.00 -2.33 0.00 0.00 43.42 40.89 3mks n LEU 563 CO 0.56 0.29 -0.27 -0.31 -1.33 0.00 0.00 177.39 176.34 3mks s TYR 564 N -2.36 0.13 -0.51 -1.77 2.02 -1.19 -4.96 117.35 108.71 3mks s TYR 564 Ca -0.25 -0.27 -0.11 0.00 -0.37 0.00 0.00 57.07 56.07 3mks s TYR 564 Cb 0.09 -0.10 0.13 0.00 -0.40 0.00 0.00 41.96 41.68 3mks s TYR 564 CO 0.31 -0.22 0.41 0.42 -1.57 0.00 0.00 175.55 174.91 3mks s ILE 565 N -1.27 4.54 -0.72 2.71 1.09 -1.26 -2.30 121.20 123.99 3mks s ILE 565 Ca -0.14 -1.78 -0.27 0.00 -1.10 0.00 0.00 60.65 57.36 3mks s ILE 565 Cb -0.08 -3.96 0.02 0.00 -1.06 0.00 0.00 42.46 37.38 3mks s ILE 565 CO 0.00 -0.82 1.39 -0.76 -0.10 0.00 0.00 174.94 174.65 3mks s LEU 566 N 1.32 3.18 -0.07 2.97 1.43 -0.31 -4.94 118.68 122.26 3mks s LEU 566 Ca 0.06 -0.30 0.03 0.00 -1.03 0.00 0.00 54.13 52.89 3mks s LEU 566 Cb -0.26 -2.55 0.01 0.00 0.03 0.00 0.00 46.19 43.41 3mks s LEU 566 CO -0.00 -1.94 -0.17 -0.55 0.23 0.00 0.00 176.35 173.92 3mks s SER 567 N 4.57 2.27 0.00 2.29 0.15 -1.26 -2.41 113.70 119.31 3mks s SER 567 Ca 0.41 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.67 3mks s SER 567 Cb -0.09 -0.97 0.00 0.00 -1.71 0.00 0.00 66.02 63.25 3mks s SER 567 CO 0.16 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.31 3mks n GLY 568 N 3.60 0.17 3.59 9.45 0.00 -1.26 -5.08 105.19 115.66 3mks n GLY 568 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 3mks n GLY 568 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3mks n HIS 569 N 0.00 0.17 -2.03 1.61 8.25 -1.26 -4.99 115.22 116.97 3mks n HIS 569 Ca 0.00 0.29 0.03 0.00 -0.26 0.00 0.00 57.72 57.78 3mks n HIS 569 Cb 0.00 -1.92 0.12 0.00 1.12 0.00 0.00 29.99 29.31 3mks n HIS 569 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3mks n THR 570 N -4.27 1.39 0.00 1.59 -2.24 -1.26 -4.92 114.28 104.57 3mks n THR 570 Ca 0.10 -2.50 0.00 0.00 -2.27 0.00 0.00 64.05 59.38 3mks n THR 570 Cb 0.53 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 3mks n THR 570 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3mks n ASP 571 N -0.48 0.00 -4.53 3.42 8.00 -1.26 -4.67 116.55 117.02 3mks n ASP 571 Ca 0.16 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.23 3mks n ASP 571 Cb 0.88 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.99 3mks n ASP 571 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3mks n ARG 572 N -0.04 0.97 -3.33 -1.24 1.74 -1.26 -4.17 116.66 109.33 3mks n ARG 572 Ca 0.00 0.35 -0.39 0.00 -0.77 0.00 0.00 57.85 57.04 3mks n ARG 572 Cb 0.00 -1.74 -0.08 0.00 -1.02 0.00 0.00 32.46 29.62 3mks n ARG 572 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3mks s ILE 573 N -1.28 5.14 -1.06 0.55 1.01 -0.82 0.61 121.20 125.35 3mks s ILE 573 Ca 0.62 0.70 0.19 0.00 0.00 0.00 0.00 60.65 62.17 3mks s ILE 573 Cb -0.63 -3.75 -0.17 0.00 0.01 0.00 0.00 42.46 37.92 3mks s ILE 573 CO 0.58 0.14 0.84 -1.22 0.00 0.00 0.00 174.94 175.28 3mks n TYR 574 N 5.31 0.00 -3.57 3.97 4.01 -0.57 -4.35 117.16 121.97 3mks n TYR 574 Ca -0.07 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.60 3mks n TYR 574 Cb 0.50 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.50 3mks n TYR 574 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3mks s SER 575 N -2.68 -0.28 -0.20 7.72 0.15 -1.23 -4.71 113.70 112.47 3mks s SER 575 Ca 0.09 0.17 -0.27 0.00 0.70 0.00 0.00 55.95 56.64 3mks s SER 575 Cb 0.15 0.26 0.09 0.00 -1.71 0.00 0.00 66.02 64.80 3mks s SER 575 CO 0.72 -0.36 0.80 0.28 1.20 0.00 0.00 173.24 175.88 3mks s THR 576 N -1.91 0.00 -0.06 6.45 -1.32 -1.26 -2.78 115.64 114.76 3mks s THR 576 Ca 0.04 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.54 3mks s THR 576 Cb -0.01 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 69.99 3mks s THR 576 CO -0.04 0.00 -0.12 -0.63 -2.21 0.00 0.00 174.62 171.63 3mks s ILE 577 N -0.25 1.09 -0.36 5.08 1.01 -0.47 -4.55 121.20 122.74 3mks s ILE 577 Ca -0.03 -0.47 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 3mks s ILE 577 Cb -0.03 -0.99 0.01 0.00 0.01 0.00 0.00 42.46 41.45 3mks s ILE 577 CO 0.02 0.34 0.81 -0.47 0.00 0.00 0.00 174.94 175.65 3mks s TYR 578 N 0.58 3.11 -0.86 3.97 5.04 -1.26 -1.39 117.35 126.55 3mks s TYR 578 Ca -0.13 0.62 -0.17 0.00 -2.44 0.00 0.00 57.07 54.95 3mks s TYR 578 Cb -0.15 -3.44 0.16 0.00 0.35 0.00 0.00 41.96 38.88 3mks s TYR 578 CO 0.03 -0.74 0.96 0.34 -1.34 0.00 0.00 175.55 174.80 3mks s ASP 579 N 1.83 6.62 0.02 4.32 -1.08 0.31 -4.89 116.67 123.80 3mks s ASP 579 Ca 0.33 -2.18 -0.25 0.00 -0.52 0.00 0.00 52.55 49.93 3mks s ASP 579 Cb -0.13 -2.33 -0.18 0.00 -1.46 0.00 0.00 42.92 38.82 3mks s ASP 579 CO 0.17 -0.91 1.43 1.12 0.52 0.00 0.00 175.17 177.50 3mks h HIS 580 N 8.52 -0.03 -0.78 -5.34 2.07 -1.94 1.00 115.15 118.65 3mks h HIS 580 Ca 0.09 -0.00 0.25 0.00 -2.85 0.00 0.00 60.37 57.85 3mks h HIS 580 Cb 1.04 0.01 -0.14 0.00 2.57 0.00 0.00 27.41 30.88 3mks h HIS 580 CO 1.09 0.27 0.14 -1.91 -3.07 0.00 0.00 177.93 174.44 3mks n GLU 581 N -4.96 -0.06 -0.10 5.12 2.13 -1.26 -1.08 120.64 120.43 3mks n GLU 581 Ca -0.08 1.14 0.04 0.00 0.66 0.00 0.00 57.16 58.92 3mks n GLU 581 Cb 0.17 -1.87 0.10 0.00 0.27 0.00 0.00 31.44 30.11 3mks n GLU 581 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3mks n ARG 582 N -4.99 2.31 -3.64 5.31 1.74 -1.16 -5.01 116.66 111.21 3mks n ARG 582 Ca 0.22 -1.72 -0.30 0.00 -0.77 0.00 0.00 57.85 55.28 3mks n ARG 582 Cb 0.72 -1.19 0.04 0.00 -1.02 0.00 0.00 32.46 31.01 3mks n ARG 582 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3mks n LYS 583 N 0.31 -1.26 -4.10 5.56 4.01 0.13 -4.87 118.16 117.95 3mks n LYS 583 Ca 0.08 0.52 -0.10 0.00 -0.51 0.00 0.00 58.31 58.30 3mks n LYS 583 Cb 0.35 -4.18 -0.09 0.00 -0.51 0.00 0.00 35.03 30.60 3mks n LYS 583 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 3mks s ARG 584 N -5.76 1.05 0.02 1.97 0.52 0.00 -1.24 118.95 115.50 3mks s ARG 584 Ca 0.44 -1.39 0.03 0.00 -0.52 0.00 0.00 55.73 54.29 3mks s ARG 584 Cb -0.15 0.29 -0.01 0.00 0.52 0.00 0.00 34.95 35.59 3mks s ARG 584 CO 0.85 -0.34 -0.10 0.00 0.02 0.00 0.00 175.30 175.74 3mks s ILE 586 N -0.63 1.70 -0.01 0.00 1.01 -0.49 -0.87 121.20 121.92 3mks s ILE 586 Ca -0.00 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.78 3mks s ILE 586 Cb -0.06 -1.44 -0.00 0.00 0.01 0.00 0.00 42.46 40.97 3mks s ILE 586 CO 0.00 0.48 -0.07 -0.94 0.00 0.00 0.00 174.94 174.42 3mks s SER 587 N -0.22 0.87 -0.14 3.58 1.04 -0.31 -1.37 113.70 117.14 3mks s SER 587 Ca 0.01 -0.13 0.01 0.00 0.48 0.00 0.00 55.95 56.32 3mks s SER 587 Cb -0.11 -0.16 0.02 0.00 0.10 0.00 0.00 66.02 65.87 3mks s SER 587 CO 0.01 0.07 -0.17 0.00 0.98 0.00 0.00 173.24 174.13 3mks s ALA 588 N 0.02 2.01 0.28 5.32 0.00 -1.12 -1.14 121.76 127.13 3mks s ALA 588 Ca 0.00 -0.97 0.08 0.00 0.00 0.00 0.00 51.96 51.07 3mks s ALA 588 Cb -0.05 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 3mks s ALA 588 CO -0.00 -0.23 0.13 0.45 0.00 0.00 0.00 175.76 176.11 3mks s SER 589 N 1.18 4.99 0.28 0.00 0.15 -1.15 -1.51 113.70 117.64 3mks s SER 589 Ca -0.00 -0.52 0.26 0.00 0.70 0.00 0.00 55.95 56.39 3mks s SER 589 Cb -0.14 -1.03 0.86 0.00 -1.71 0.00 0.00 66.02 64.00 3mks s SER 589 CO -0.07 -0.11 1.76 -0.03 1.20 0.00 0.00 173.24 175.98 3mks h MET 590 N 1.61 0.00 0.00 5.44 4.05 -0.04 -2.38 114.93 123.61 3mks h MET 590 Ca -0.46 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.96 3mks h MET 590 Cb 1.25 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.05 3mks h MET 590 CO 0.61 0.00 0.00 0.38 0.23 0.00 0.00 176.91 178.13 3mks h ASP 591 N 0.00 0.00 0.00 1.39 2.03 -1.77 -3.41 116.42 114.66 3mks h ASP 591 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3mks h ASP 591 Cb 0.63 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.13 3mks h ASP 591 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 179.24 179.28 3mks n THR 592 N -2.72 0.00 -2.36 1.15 5.66 -1.14 -4.97 114.28 109.91 3mks n THR 592 Ca 0.00 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.77 3mks n THR 592 Cb 0.22 0.00 0.14 0.00 -1.55 0.00 0.00 70.33 69.14 3mks n THR 592 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3mks n THR 593 N -1.35 0.00 -4.55 1.09 -2.24 -1.26 -4.34 114.28 101.63 3mks n THR 593 Ca 0.00 -1.32 -0.24 0.00 -2.27 0.00 0.00 64.05 60.22 3mks n THR 593 Cb 0.00 -1.12 -0.14 0.00 -2.10 0.00 0.00 70.33 66.98 3mks n THR 593 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3mks s ILE 594 N -3.20 1.52 -0.05 2.28 1.01 -1.17 -2.93 121.20 118.66 3mks s ILE 594 Ca 0.66 -1.15 0.01 0.00 0.00 0.00 0.00 60.65 60.17 3mks s ILE 594 Cb -0.03 -1.33 0.02 0.00 0.01 0.00 0.00 42.46 41.13 3mks s ILE 594 CO 0.45 0.14 -0.06 -0.13 0.00 0.00 0.00 174.94 175.33 3mks s ARG 595 N -1.18 1.06 -0.20 2.79 0.52 -0.29 -0.26 118.95 121.38 3mks s ARG 595 Ca 0.06 -0.19 -0.08 0.00 -0.52 0.00 0.00 55.73 55.00 3mks s ARG 595 Cb -0.09 -0.99 -0.04 0.00 0.52 0.00 0.00 34.95 34.35 3mks s ARG 595 CO 0.02 -0.06 0.09 0.42 0.02 0.00 0.00 175.30 175.80 3mks s ILE 596 N 0.86 4.99 0.02 1.52 -1.09 0.09 -1.17 121.20 126.42 3mks s ILE 596 Ca -0.12 0.04 0.07 0.00 -2.23 0.00 0.00 60.65 58.41 3mks s ILE 596 Cb -0.15 -3.27 -0.02 0.00 -1.58 0.00 0.00 42.46 37.44 3mks s ILE 596 CO 0.01 0.43 -0.21 0.26 -1.23 0.00 0.00 174.94 174.20 3mks s TRP 597 N 0.57 1.85 -0.35 3.97 0.52 -0.05 -1.18 118.94 124.27 3mks s TRP 597 Ca 0.05 -0.36 -0.29 0.00 0.02 0.00 0.00 56.10 55.52 3mks s TRP 597 Cb -0.12 -1.14 0.00 0.00 -1.15 0.00 0.00 33.47 31.06 3mks s TRP 597 CO 0.01 0.04 1.38 0.34 0.02 0.00 0.00 176.95 178.74 3mks s ASP 598 N -0.88 6.48 0.00 2.95 -1.08 -0.60 -1.24 116.67 122.30 3mks s ASP 598 Ca 0.08 1.06 0.24 0.00 -0.52 0.00 0.00 52.55 53.40 3mks s ASP 598 Cb -0.08 -2.54 1.34 0.00 -1.46 0.00 0.00 42.92 40.17 3mks s ASP 598 CO 0.01 -1.27 1.87 0.18 0.52 0.00 0.00 175.17 176.48 3mks n LEU 599 N 8.29 0.20 -4.22 -1.34 4.77 -0.38 -0.65 117.00 123.68 3mks n LEU 599 Ca 0.16 -0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.64 3mks n LEU 599 Cb 0.47 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 3mks n LEU 599 CO 0.67 0.04 0.22 -0.70 -1.33 0.00 0.00 177.39 176.28 3mks s GLU 600 N -1.98 3.05 0.00 3.23 2.12 -1.26 -4.47 118.70 119.38 3mks s GLU 600 Ca 0.35 -2.41 0.00 0.00 0.36 0.00 0.00 54.97 53.28 3mks s GLU 600 Cb 0.17 -4.09 0.00 0.00 0.26 0.00 0.00 34.13 30.47 3mks s GLU 600 CO 0.27 -1.23 0.00 0.27 -0.54 0.00 0.00 175.26 174.03 3mks n ASN 605 N 3.89 0.00 -2.64 -1.70 0.23 -1.26 -4.89 115.26 108.88 3mks n ASN 605 Ca 0.08 0.00 -0.16 0.00 -0.53 0.00 0.00 54.58 53.97 3mks n ASN 605 Cb 0.42 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.18 3mks n ASN 605 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3mks n GLY 606 N -1.52 -0.08 3.59 4.83 0.00 0.18 -5.06 105.19 107.13 3mks n GLY 606 Ca 0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 3mks n GLY 606 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3mks s GLU 607 N -5.87 1.97 0.16 1.61 4.04 -1.23 -4.93 118.70 114.45 3mks s GLU 607 Ca 0.39 -1.82 -0.31 0.00 0.04 0.00 0.00 54.97 53.26 3mks s GLU 607 Cb -0.17 -1.84 -0.10 0.00 0.02 0.00 0.00 34.13 32.04 3mks s GLU 607 CO 0.50 0.14 1.53 -1.17 -1.84 0.00 0.00 175.26 174.43 3mks s LEU 608 N -3.67 4.37 -0.13 1.83 2.96 -1.26 -1.55 118.68 121.22 3mks s LEU 608 Ca 0.34 2.56 -0.14 0.00 -0.22 0.00 0.00 54.13 56.67 3mks s LEU 608 Cb 0.01 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.06 3mks s LEU 608 CO 0.18 -0.79 -0.27 0.23 -1.32 0.00 0.00 176.35 174.38 3mks n MET 625 N 3.96 0.41 -4.29 1.98 2.81 -0.33 -4.90 117.12 116.77 3mks n MET 625 Ca 0.13 0.16 -0.18 0.00 -1.81 0.00 0.00 57.70 56.00 3mks n MET 625 Cb 0.39 -1.21 -0.13 0.00 -0.71 0.00 0.00 33.22 31.56 3mks n MET 625 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 3mks s TYR 626 N -2.51 1.06 -0.22 2.03 2.02 -1.15 -5.01 117.35 113.57 3mks s TYR 626 Ca -0.22 -0.35 -0.07 0.00 -0.37 0.00 0.00 57.07 56.06 3mks s TYR 626 Cb 0.03 -0.63 -0.03 0.00 -0.40 0.00 0.00 41.96 40.93 3mks s TYR 626 CO 0.33 0.01 0.04 0.99 -1.57 0.00 0.00 175.55 175.36 3mks s THR 627 N -0.86 4.29 0.02 -0.71 2.01 -1.26 -0.73 115.64 118.40 3mks s THR 627 Ca -0.00 -0.19 -0.18 0.00 0.31 0.00 0.00 61.69 61.63 3mks s THR 627 Cb -0.08 -2.97 -0.06 0.00 0.01 0.00 0.00 72.50 69.41 3mks s THR 627 CO 0.01 0.39 0.51 -0.76 -0.69 0.00 0.00 174.62 174.09 3mks s LEU 628 N 1.14 4.47 -0.10 4.42 1.43 0.64 -4.93 118.68 125.75 3mks s LEU 628 Ca 0.04 1.11 0.01 0.00 -1.03 0.00 0.00 54.13 54.26 3mks s LEU 628 Cb -0.14 -2.78 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 3mks s LEU 628 CO 0.03 0.24 -0.13 -1.58 0.23 0.00 0.00 176.35 175.14 3mks s GLN 629 N -0.79 3.06 0.00 1.70 2.00 -1.26 -3.03 119.66 121.34 3mks s GLN 629 Ca 0.27 -0.67 0.00 0.00 -2.00 0.00 0.00 55.36 52.96 3mks s GLN 629 Cb -0.18 -2.56 0.00 0.00 0.80 0.00 0.00 33.01 31.07 3mks s GLN 629 CO 0.16 0.39 0.00 0.41 -0.50 0.00 0.00 175.29 175.75 3mks n GLY 630 N 3.01 0.00 3.08 2.59 0.00 -1.26 -5.09 105.19 107.52 3mks n GLY 630 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 3mks n GLY 630 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3mks s HIS 631 N 0.00 2.61 -0.35 1.61 3.76 -1.26 -4.95 115.29 116.71 3mks s HIS 631 Ca 0.00 -1.56 0.02 0.00 -0.15 0.00 0.00 55.06 53.37 3mks s HIS 631 Cb 0.00 -1.81 0.45 0.00 1.11 0.00 0.00 32.58 32.33 3mks s HIS 631 CO 0.00 -0.77 1.72 0.25 -0.85 0.00 0.00 174.74 175.09 3mks n THR 632 N 4.66 2.68 -3.53 1.30 -2.24 -1.26 -4.65 114.28 111.24 3mks n THR 632 Ca -0.19 -1.52 -0.11 0.00 -2.27 0.00 0.00 64.05 59.96 3mks n THR 632 Cb 0.49 -0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 67.95 3mks n THR 632 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mks s ALA 633 N -2.42 -1.84 -0.42 6.98 0.00 -1.26 -4.93 121.76 117.88 3mks s ALA 633 Ca 0.42 1.24 -0.40 0.00 0.00 0.00 0.00 51.96 53.21 3mks s ALA 633 Cb 0.35 -0.04 -0.16 0.00 0.00 0.00 0.00 23.12 23.27 3mks s ALA 633 CO 0.06 -0.50 2.11 1.47 0.00 0.00 0.00 175.76 178.90 3mks n LEU 634 N 0.31 1.47 -4.61 0.00 -0.00 -1.26 -4.58 117.00 108.34 3mks n LEU 634 Ca -0.12 0.62 -0.43 0.00 -0.00 0.00 0.00 56.01 56.09 3mks n LEU 634 Cb 0.60 -1.07 -0.03 0.00 -0.00 0.00 0.00 43.42 42.92 3mks n LEU 634 CO 0.15 -0.73 1.46 -0.69 -0.00 0.00 0.00 177.39 177.58 3mks s VAL 635 N 6.22 3.57 -0.17 1.47 1.01 -0.91 -2.91 120.40 128.68 3mks s VAL 635 Ca 1.13 0.60 -0.15 0.00 0.00 0.00 0.00 61.98 63.56 3mks s VAL 635 Cb -1.20 -3.71 -0.11 0.00 0.00 0.00 0.00 36.38 31.36 3mks s VAL 635 CO 0.60 -0.41 0.06 1.23 0.00 0.00 0.00 175.10 176.57 3mks h GLY 636 N 12.99 0.00 -5.08 4.51 0.00 -1.61 -3.36 103.07 110.52 3mks h GLY 636 Ca -0.33 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.37 3mks h GLY 636 CO 1.03 0.00 -0.41 1.08 0.00 0.00 0.00 176.54 178.23 3mks s LEU 637 N -8.09 4.37 -0.05 3.11 1.02 -1.21 -4.58 118.68 113.26 3mks s LEU 637 Ca -0.20 0.51 0.04 0.00 0.02 0.00 0.00 54.13 54.49 3mks s LEU 637 Cb 0.03 -2.63 0.00 0.00 0.02 0.00 0.00 46.19 43.61 3mks s LEU 637 CO 0.40 0.26 -0.15 -0.76 0.02 0.00 0.00 176.35 176.12 3mks s LEU 638 N -1.77 1.84 0.04 1.79 1.43 -1.26 -2.81 118.68 117.94 3mks s LEU 638 Ca 0.27 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 53.07 3mks s LEU 638 Cb -0.13 -0.88 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 3mks s LEU 638 CO 0.16 0.11 -0.07 -0.13 0.23 0.00 0.00 176.35 176.66 3mks s ARG 639 N 0.20 0.48 -0.23 1.70 1.81 -0.65 -4.98 118.95 117.29 3mks s ARG 639 Ca -0.06 -0.69 -0.00 0.00 -1.72 0.00 0.00 55.73 53.25 3mks s ARG 639 Cb -0.12 -0.23 0.06 0.00 -0.45 0.00 0.00 34.95 34.21 3mks s ARG 639 CO 0.02 0.04 -0.03 -1.17 -0.68 0.00 0.00 175.30 173.48 3mks s LEU 640 N -1.46 2.20 0.62 2.53 0.20 -1.26 -0.89 118.68 120.62 3mks s LEU 640 Ca -0.10 -1.09 0.05 0.00 0.69 0.00 0.00 54.13 53.67 3mks s LEU 640 Cb -0.09 -1.02 0.09 0.00 -0.43 0.00 0.00 46.19 44.74 3mks s LEU 640 CO 0.00 -0.26 0.85 -0.94 -0.29 0.00 0.00 176.35 175.71 3mks s SER 641 N 1.52 4.86 0.39 3.68 1.04 0.23 -4.99 113.70 120.43 3mks s SER 641 Ca -0.04 -0.55 0.21 0.00 0.48 0.00 0.00 55.95 56.04 3mks s SER 641 Cb -0.18 -0.00 1.20 0.00 0.10 0.00 0.00 66.02 67.13 3mks s SER 641 CO -0.07 -1.48 1.68 -0.78 0.98 0.00 0.00 173.24 173.57 3mks h ASP 642 N -0.07 0.41 0.00 7.02 3.58 -1.97 -2.91 116.42 122.48 3mks h ASP 642 Ca -0.34 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.25 3mks h ASP 642 Cb 1.28 0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.42 3mks h ASP 642 CO 0.42 -0.08 -1.10 0.29 -2.88 0.00 0.00 179.24 175.89 3mks n LYS 643 N -4.80 0.81 -4.66 0.28 5.02 -1.26 -4.81 118.16 108.72 3mks n LYS 643 Ca 0.31 -0.04 -0.23 0.00 -2.02 0.00 0.00 58.31 56.34 3mks n LYS 643 Cb 1.09 -1.07 -0.15 0.00 -0.02 0.00 0.00 35.03 34.88 3mks n LYS 643 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3mks s PHE 644 N -2.22 1.31 -0.39 2.13 0.40 -1.10 -1.65 117.98 116.45 3mks s PHE 644 Ca -0.01 -0.27 -0.19 0.00 -0.60 0.00 0.00 56.93 55.86 3mks s PHE 644 Cb 0.03 -0.85 0.01 0.00 0.51 0.00 0.00 43.02 42.72 3mks s PHE 644 CO 0.20 -0.04 0.56 -1.17 0.70 0.00 0.00 175.22 175.47 3mks s LEU 645 N -0.27 4.48 -0.14 -0.37 2.96 0.38 -0.60 118.68 125.12 3mks s LEU 645 Ca 0.04 -0.23 -0.03 0.00 -0.22 0.00 0.00 54.13 53.69 3mks s LEU 645 Cb -0.06 -2.63 -0.03 0.00 0.50 0.00 0.00 46.19 43.97 3mks s LEU 645 CO -0.00 -0.62 -0.03 -0.69 -1.32 0.00 0.00 176.35 173.69 3mks s VAL 646 N 2.54 3.97 0.20 1.68 1.01 -0.07 -0.43 120.40 129.31 3mks s VAL 646 Ca 0.20 -0.34 0.07 0.00 0.00 0.00 0.00 61.98 61.90 3mks s VAL 646 Cb -0.15 -2.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 3mks s VAL 646 CO 0.16 0.51 -0.12 -0.94 0.00 0.00 0.00 175.10 174.71 3mks s SER 647 N 0.14 2.41 -0.10 3.32 1.04 -0.11 -1.64 113.70 118.76 3mks s SER 647 Ca -0.01 -1.04 -0.04 0.00 0.48 0.00 0.00 55.95 55.34 3mks s SER 647 Cb -0.14 -0.11 0.05 0.00 0.10 0.00 0.00 66.02 65.93 3mks s SER 647 CO 0.03 -0.23 0.21 0.00 0.98 0.00 0.00 173.24 174.22 3mks s ALA 648 N -3.07 -0.37 0.31 5.32 0.00 -1.12 -0.62 121.76 122.20 3mks s ALA 648 Ca 0.22 0.77 0.06 0.00 0.00 0.00 0.00 51.96 53.01 3mks s ALA 648 Cb 0.01 -0.85 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 3mks s ALA 648 CO 0.06 -0.53 0.44 0.00 0.00 0.00 0.00 175.76 175.73 3mks s ALA 649 N 2.15 4.12 -2.00 0.00 0.00 -0.37 -1.64 121.76 124.02 3mks s ALA 649 Ca 0.00 -1.37 0.30 0.00 0.00 0.00 0.00 51.96 50.89 3mks s ALA 649 Cb -0.12 -1.71 1.77 0.00 0.00 0.00 0.00 23.12 23.06 3mks s ALA 649 CO -0.07 0.05 2.11 0.00 0.00 0.00 0.00 175.76 177.85 3mks n ALA 650 N -1.58 2.61 1.76 0.00 0.00 -1.14 -2.88 120.51 119.29 3mks n ALA 650 Ca -0.03 -0.19 0.11 0.00 0.00 0.00 0.00 53.44 53.33 3mks n ALA 650 Cb 0.58 -1.48 0.65 0.00 0.00 0.00 0.00 19.45 19.20 3mks n ALA 650 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3mks n ASP 651 N -1.00 0.00 0.00 0.00 5.75 -1.26 -3.75 116.55 116.29 3mks n ASP 651 Ca 0.22 -1.08 0.00 0.00 -0.01 0.00 0.00 54.79 53.92 3mks n ASP 651 Cb 0.10 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 3mks n ASP 651 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3mks n GLY 652 N 0.68 0.67 3.84 6.12 0.00 -1.14 -4.60 105.19 110.76 3mks n GLY 652 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 3mks n GLY 652 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3mks s SER 653 N -2.73 6.89 -0.06 1.61 0.15 -1.23 -2.25 113.70 116.08 3mks s SER 653 Ca 0.00 1.24 0.01 0.00 0.70 0.00 0.00 55.95 57.90 3mks s SER 653 Cb 0.00 -2.35 0.02 0.00 -1.71 0.00 0.00 66.02 61.98 3mks s SER 653 CO 0.00 -0.00 -0.06 -0.63 1.20 0.00 0.00 173.24 173.75 3mks s ILE 654 N -1.62 0.70 0.08 6.45 1.01 0.33 -1.24 121.20 126.91 3mks s ILE 654 Ca 0.44 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.96 3mks s ILE 654 Cb -0.14 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.59 3mks s ILE 654 CO 0.20 0.27 -0.17 -0.13 0.00 0.00 0.00 174.94 175.10 3mks s ARG 655 N 1.01 0.97 -0.04 2.79 0.52 0.20 0.04 118.95 124.44 3mks s ARG 655 Ca -0.09 -1.04 0.04 0.00 -0.52 0.00 0.00 55.73 54.12 3mks s ARG 655 Cb -0.14 -1.09 -0.00 0.00 0.52 0.00 0.00 34.95 34.23 3mks s ARG 655 CO -0.00 0.25 -0.17 0.20 0.02 0.00 0.00 175.30 175.60 3mks s GLY 656 N -1.77 0.89 0.09 -3.53 0.00 0.96 -0.93 107.32 103.03 3mks s GLY 656 Ca 0.02 -0.68 0.06 0.00 0.00 0.00 0.00 44.72 44.12 3mks s GLY 656 CO 0.03 -0.37 -0.16 -0.98 0.00 0.00 0.00 173.10 171.62 3mks s TRP 657 N -0.01 1.41 0.27 1.90 0.52 0.43 -0.29 118.94 123.17 3mks s TRP 657 Ca -0.02 -0.48 -0.31 0.00 0.02 0.00 0.00 56.10 55.31 3mks s TRP 657 Cb -0.11 -0.77 -0.12 0.00 -1.15 0.00 0.00 33.47 31.32 3mks s TRP 657 CO 0.02 0.12 1.58 -3.47 0.02 0.00 0.00 176.95 175.22 3mks n ASP 658 N 1.00 3.67 0.03 2.95 2.03 -0.25 -0.47 116.55 125.51 3mks n ASP 658 Ca -0.19 1.13 0.10 0.00 0.52 0.00 0.00 54.79 56.35 3mks n ASP 658 Cb 0.55 -1.56 0.42 0.00 -0.72 0.00 0.00 41.12 39.81 3mks n ASP 658 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3mks n ALA 659 N 2.43 1.87 -0.03 -1.67 0.00 -0.66 -0.11 120.51 122.33 3mks n ALA 659 Ca 0.10 -0.03 -0.05 0.00 0.00 0.00 0.00 53.44 53.46 3mks n ALA 659 Cb 0.35 -1.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.45 3mks n ALA 659 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3mks n ASN 660 N -1.70 1.45 -0.00 0.00 2.85 -1.26 -4.81 115.26 111.78 3mks n ASN 660 Ca 0.04 0.23 0.10 0.00 -0.11 0.00 0.00 54.58 54.84 3mks n ASN 660 Cb 0.24 -0.55 -0.14 0.00 1.24 0.00 0.00 39.78 40.57 3mks n ASN 660 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 3mks n ASP 661 N -3.91 0.63 -0.57 1.20 5.75 -1.25 -5.02 116.55 113.38 3mks n ASP 661 Ca -0.08 -0.57 -0.07 0.00 -0.01 0.00 0.00 54.79 54.06 3mks n ASP 661 Cb 0.28 1.40 -0.02 0.00 -1.03 0.00 0.00 41.12 41.75 3mks n ASP 661 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 3mks n TYR 662 N -1.80 -0.07 -2.48 2.11 4.02 0.84 -4.94 117.16 114.83 3mks n TYR 662 Ca 0.01 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 3mks n TYR 662 Cb 0.42 -1.56 -0.04 0.00 -0.02 0.00 0.00 39.34 38.14 3mks n TYR 662 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3mks s SER 663 N -2.88 6.75 -0.24 7.72 1.04 -1.26 -4.46 113.70 120.38 3mks s SER 663 Ca 0.00 2.13 -0.38 0.00 0.48 0.00 0.00 55.95 58.18 3mks s SER 663 Cb 0.00 -2.60 -0.14 0.00 0.10 0.00 0.00 66.02 63.38 3mks s SER 663 CO 0.00 -0.50 1.81 0.54 0.98 0.00 0.00 173.24 176.07 3mks n ARG 664 N 0.09 1.43 -0.02 4.02 1.74 -1.26 -1.09 116.66 121.57 3mks n ARG 664 Ca 0.04 0.52 0.01 0.00 -0.77 0.00 0.00 57.85 57.65 3mks n ARG 664 Cb 0.48 -2.27 -0.06 0.00 -1.02 0.00 0.00 32.46 29.59 3mks n ARG 664 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3mks n LYS 665 N 5.91 1.29 -3.62 5.56 4.76 0.60 -4.88 118.16 127.78 3mks n LYS 665 Ca 0.26 -0.04 -0.04 0.00 -2.87 0.00 0.00 58.31 55.62 3mks n LYS 665 Cb 0.18 -1.19 -0.04 0.00 -1.84 0.00 0.00 35.03 32.14 3mks n LYS 665 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 3mks s PHE 666 N -2.40 -0.13 0.00 2.13 -0.12 -0.96 -4.95 117.98 111.56 3mks s PHE 666 Ca -0.03 0.22 -0.00 0.00 -0.05 0.00 0.00 56.93 57.07 3mks s PHE 666 Cb 0.04 0.48 -0.00 0.00 -0.63 0.00 0.00 43.02 42.91 3mks s PHE 666 CO 0.32 -0.12 -0.00 -1.54 -0.05 0.00 0.00 175.22 173.82 3mks s SER 667 N -1.03 0.04 -0.01 1.98 1.04 -1.26 -0.03 113.70 114.43 3mks s SER 667 Ca 0.06 -0.08 0.03 0.00 0.48 0.00 0.00 55.95 56.45 3mks s SER 667 Cb -0.01 0.02 -0.01 0.00 0.10 0.00 0.00 66.02 66.12 3mks s SER 667 CO -0.05 -0.05 -0.11 -0.31 0.98 0.00 0.00 173.24 173.69 3mks s TYR 668 N -0.24 1.05 -0.17 5.02 1.51 0.11 -4.96 117.35 119.67 3mks s TYR 668 Ca -0.03 -0.22 -0.00 0.00 -1.01 0.00 0.00 57.07 55.82 3mks s TYR 668 Cb -0.02 -0.69 0.00 0.00 -0.11 0.00 0.00 41.96 41.14 3mks s TYR 668 CO -0.00 -0.04 -0.15 -1.01 -1.11 0.00 0.00 175.55 173.24 3mks s HIS 669 N -0.16 2.80 0.05 2.71 3.76 -1.26 -0.51 115.29 122.68 3mks s HIS 669 Ca 0.02 -1.12 -0.31 0.00 -0.15 0.00 0.00 55.06 53.50 3mks s HIS 669 Cb -0.06 -1.92 -0.10 0.00 1.11 0.00 0.00 32.58 31.62 3mks s HIS 669 CO -0.00 -0.53 1.93 0.72 -0.85 0.00 0.00 174.74 176.01 3mks n HIS 670 N 4.23 2.52 -0.44 1.40 8.25 -0.96 -4.87 115.22 125.36 3mks n HIS 670 Ca -0.19 -0.28 0.36 0.00 -0.26 0.00 0.00 57.72 57.35 3mks n HIS 670 Cb 0.51 -2.77 0.65 0.00 1.12 0.00 0.00 29.99 29.50 3mks n HIS 670 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3mks h THR 671 N 5.36 0.19 -0.14 1.59 2.02 -1.98 0.53 112.91 120.48 3mks h THR 671 Ca -0.49 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.65 3mks h THR 671 Cb 1.24 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 3mks h THR 671 CO 0.94 0.02 0.00 -0.46 0.37 0.00 0.00 175.52 176.39 3mks n ASN 672 N -4.58 1.54 -2.25 4.18 0.23 -1.26 -4.93 115.26 108.18 3mks n ASN 672 Ca 0.35 -1.67 -0.18 0.00 -0.53 0.00 0.00 54.58 52.56 3mks n ASN 672 Cb 1.38 -0.09 -0.02 0.00 -2.08 0.00 0.00 39.78 38.97 3mks n ASN 672 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3mks n LEU 673 N 0.23 -1.59 -4.94 -4.53 4.77 0.19 -4.96 117.00 106.16 3mks n LEU 673 Ca 0.16 0.13 -0.24 0.00 -0.03 0.00 0.00 56.01 56.04 3mks n LEU 673 Cb 0.31 -2.63 0.01 0.00 -2.33 0.00 0.00 43.42 38.78 3mks n LEU 673 CO 0.13 -0.32 0.29 -0.94 -1.33 0.00 0.00 177.39 175.22 3mks s SER 674 N -2.13 5.95 0.19 -1.43 1.04 -1.26 -4.41 113.70 111.65 3mks s SER 674 Ca 0.00 0.39 -0.32 0.00 0.48 0.00 0.00 55.95 56.51 3mks s SER 674 Cb 0.00 -1.70 -0.11 0.00 0.10 0.00 0.00 66.02 64.31 3mks s SER 674 CO 0.00 -0.63 1.69 0.00 0.98 0.00 0.00 173.24 175.28 3mks s ALA 675 N -2.55 3.88 -0.23 5.32 0.00 -1.25 -3.61 121.76 123.34 3mks s ALA 675 Ca 0.47 1.52 -0.29 0.00 0.00 0.00 0.00 51.96 53.65 3mks s ALA 675 Cb -0.10 -3.68 -0.02 0.00 0.00 0.00 0.00 23.12 19.32 3mks s ALA 675 CO 0.38 -0.91 1.57 0.42 0.00 0.00 0.00 175.76 177.23 3mks s ILE 676 N 1.29 3.76 -0.14 0.00 -1.09 -1.25 -4.38 121.20 119.40 3mks s ILE 676 Ca 0.74 0.86 0.19 0.00 -2.23 0.00 0.00 60.65 60.22 3mks s ILE 676 Cb -0.48 -3.77 -0.17 0.00 -1.58 0.00 0.00 42.46 36.47 3mks s ILE 676 CO 0.32 -0.31 0.69 0.41 -1.23 0.00 0.00 174.94 174.83 3mks n THR 677 N 6.33 0.82 -3.56 2.92 -1.04 -0.21 -4.84 114.28 114.69 3mks n THR 677 Ca 0.18 -0.64 -0.10 0.00 -2.04 0.00 0.00 64.05 61.45 3mks n THR 677 Cb 0.45 -0.45 -0.05 0.00 -1.82 0.00 0.00 70.33 68.47 3mks n THR 677 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3mks s THR 678 N -3.10 0.00 0.15 12.58 -1.32 -1.11 -4.78 115.64 118.07 3mks s THR 678 Ca -0.04 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.26 3mks s THR 678 Cb 0.10 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.12 3mks s THR 678 CO 0.83 0.00 0.46 0.72 -2.21 0.00 0.00 174.62 174.43 3mks s PHE 679 N -1.46 -0.20 0.01 9.09 -0.12 -1.26 -0.32 117.98 123.71 3mks s PHE 679 Ca -0.01 -0.11 -0.01 0.00 -0.05 0.00 0.00 56.93 56.76 3mks s PHE 679 Cb -0.01 0.33 -0.01 0.00 -0.63 0.00 0.00 43.02 42.71 3mks s PHE 679 CO 0.00 -0.79 -0.00 -0.47 -0.05 0.00 0.00 175.22 173.91 3mks s TYR 680 N -3.82 0.12 0.04 3.49 5.04 0.14 -4.82 117.35 117.53 3mks s TYR 680 Ca 0.05 -0.25 -0.00 0.00 -2.44 0.00 0.00 57.07 54.43 3mks s TYR 680 Cb 0.01 -0.09 -0.03 0.00 0.35 0.00 0.00 41.96 42.20 3mks s TYR 680 CO -0.09 -0.11 -0.03 0.14 -1.34 0.00 0.00 175.55 174.12 3mks s VAL 681 N -0.78 0.20 0.32 3.14 -7.23 -1.26 -0.48 120.40 114.31 3mks s VAL 681 Ca -0.09 -1.29 0.04 0.00 -1.81 0.00 0.00 61.98 58.83 3mks s VAL 681 Cb -0.05 -0.80 -0.01 0.00 0.56 0.00 0.00 36.38 36.08 3mks s VAL 681 CO -0.00 -0.69 0.13 -1.54 -0.31 0.00 0.00 175.10 172.68 3mks n SER 682 N 0.98 1.00 0.33 4.85 3.41 -0.48 -4.84 113.62 118.87 3mks n SER 682 Ca -0.20 -2.74 0.22 0.00 -0.26 0.00 0.00 58.87 55.89 3mks n SER 682 Cb 0.57 0.88 1.17 0.00 -0.26 0.00 0.00 64.21 66.57 3mks n SER 682 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3mks h ASP 683 N 1.34 0.00 0.00 4.04 3.32 -1.96 -3.22 116.42 119.93 3mks h ASP 683 Ca -0.25 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.64 3mks h ASP 683 Cb 0.97 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.49 3mks h ASP 683 CO 0.39 0.00 -1.75 0.59 -1.72 0.00 0.00 179.24 176.76 3mks n ASN 684 N -3.03 2.11 -3.99 6.45 3.02 -1.26 -4.68 115.26 113.88 3mks n ASN 684 Ca -0.03 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.40 3mks n ASN 684 Cb 0.09 0.99 -0.12 0.00 -0.61 0.00 0.00 39.78 40.13 3mks n ASN 684 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3mks s ILE 685 N -2.44 0.33 -0.08 2.41 -1.09 -1.22 -1.78 121.20 117.33 3mks s ILE 685 Ca -0.05 -0.67 0.02 0.00 -2.23 0.00 0.00 60.65 57.72 3mks s ILE 685 Cb 0.05 -0.37 0.01 0.00 -1.58 0.00 0.00 42.46 40.56 3mks s ILE 685 CO 0.49 -0.23 -0.15 -0.22 -1.23 0.00 0.00 174.94 173.60 3mks s LEU 686 N -0.96 1.74 -0.12 2.97 2.96 -0.13 -1.38 118.68 123.77 3mks s LEU 686 Ca -0.07 -0.38 0.01 0.00 -0.22 0.00 0.00 54.13 53.47 3mks s LEU 686 Cb -0.07 -1.00 0.02 0.00 0.50 0.00 0.00 46.19 45.64 3mks s LEU 686 CO -0.00 0.05 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.27 3mks s VAL 687 N 0.68 1.35 0.03 1.68 1.01 0.37 0.12 120.40 125.64 3mks s VAL 687 Ca -0.14 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.34 3mks s VAL 687 Cb -0.16 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.92 3mks s VAL 687 CO 0.04 0.42 -0.07 -0.94 0.00 0.00 0.00 175.10 174.54 3mks s SER 688 N 1.28 0.79 0.04 3.32 1.04 -0.37 0.24 113.70 120.04 3mks s SER 688 Ca -0.01 -0.48 0.04 0.00 0.48 0.00 0.00 55.95 55.98 3mks s SER 688 Cb -0.14 0.02 -0.02 0.00 0.10 0.00 0.00 66.02 65.98 3mks s SER 688 CO -0.05 -0.17 -0.11 -0.83 0.98 0.00 0.00 173.24 173.06 3mks s GLY 689 N -1.36 0.65 0.32 7.32 0.00 0.56 -1.84 107.32 112.97 3mks s GLY 689 Ca -0.08 -0.77 -0.08 0.00 0.00 0.00 0.00 44.72 43.79 3mks s GLY 689 CO 0.00 -0.78 0.51 -1.35 0.00 0.00 0.00 173.10 171.49 3mks s SER 690 N -1.27 0.44 -0.13 1.64 1.04 -0.38 -1.05 113.70 113.99 3mks s SER 690 Ca -0.03 -1.26 -0.36 0.00 0.48 0.00 0.00 55.95 54.78 3mks s SER 690 Cb -0.08 0.66 -0.13 0.00 0.10 0.00 0.00 66.02 66.56 3mks s SER 690 CO 0.01 -1.29 1.78 1.21 0.98 0.00 0.00 173.24 175.93 3mks n GLU 691 N -0.49 1.77 -0.80 4.02 2.13 -1.26 -0.60 120.64 125.40 3mks n GLU 691 Ca -0.01 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.46 3mks n GLU 691 Cb 0.62 -2.42 0.00 0.00 0.27 0.00 0.00 31.44 29.90 3mks n GLU 691 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3mks n ASN 692 N 5.75 -0.60 -3.90 4.31 5.03 -0.73 -4.97 115.26 120.15 3mks n ASN 692 Ca 0.23 0.00 -0.20 0.00 0.87 0.00 0.00 54.58 55.48 3mks n ASN 692 Cb 0.23 -1.23 -0.16 0.00 -1.02 0.00 0.00 39.78 37.60 3mks n ASN 692 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 3mks s GLN 693 N -0.51 0.86 -0.11 3.52 -0.21 0.23 -4.93 119.66 118.51 3mks s GLN 693 Ca 0.00 -0.12 -0.02 0.00 0.02 0.00 0.00 55.36 55.24 3mks s GLN 693 Cb 0.00 -0.85 0.04 0.00 1.00 0.00 0.00 33.01 33.20 3mks s GLN 693 CO 0.00 -0.07 0.03 0.12 -2.12 0.00 0.00 175.29 173.25 3mks s PHE 694 N 0.89 0.60 -0.02 0.91 5.36 -1.26 -1.25 117.98 123.21 3mks s PHE 694 Ca -0.12 -0.28 0.05 0.00 -0.96 0.00 0.00 56.93 55.63 3mks s PHE 694 Cb -0.14 -0.79 -0.01 0.00 -0.34 0.00 0.00 43.02 41.73 3mks s PHE 694 CO 0.00 -0.39 -0.18 -0.80 -1.46 0.00 0.00 175.22 172.39 3mks s ASN 695 N 2.00 2.13 -0.16 6.13 0.02 -0.76 -4.21 114.94 120.08 3mks s ASN 695 Ca 0.03 -0.33 -0.00 0.00 -1.02 0.00 0.00 52.86 51.54 3mks s ASN 695 Cb -0.14 -0.32 -0.00 0.00 0.02 0.00 0.00 41.25 40.81 3mks s ASN 695 CO -0.06 0.21 -0.14 -0.63 0.02 0.00 0.00 177.10 176.50 3mks s ILE 696 N -0.32 2.77 -0.05 0.60 1.01 -0.87 -1.24 121.20 123.11 3mks s ILE 696 Ca 0.05 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 60.02 3mks s ILE 696 Cb -0.08 -2.19 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 3mks s ILE 696 CO -0.00 0.50 -0.20 -0.31 0.00 0.00 0.00 174.94 174.94 3mks s TYR 697 N 0.91 2.55 -0.37 3.97 2.02 0.32 -1.13 117.35 125.62 3mks s TYR 697 Ca -0.03 -0.36 -0.24 0.00 -0.37 0.00 0.00 57.07 56.07 3mks s TYR 697 Cb -0.15 -1.60 0.01 0.00 -0.40 0.00 0.00 41.96 39.82 3mks s TYR 697 CO -0.01 0.03 0.84 1.21 -1.57 0.00 0.00 175.55 176.05 3mks s ASN 698 N -0.54 6.60 0.20 2.29 3.84 -0.91 -0.95 114.94 125.47 3mks s ASN 698 Ca 0.07 0.44 0.03 0.00 0.21 0.00 0.00 52.86 53.62 3mks s ASN 698 Cb -0.11 -2.42 0.13 0.00 -0.55 0.00 0.00 41.25 38.30 3mks s ASN 698 CO 0.01 -0.78 1.48 -0.07 -2.79 0.00 0.00 177.10 174.94 3mks h LEU 699 N 9.87 0.28 0.11 3.21 4.07 -1.65 0.25 115.31 131.45 3mks h LEU 699 Ca -0.24 -0.19 0.01 0.00 0.08 0.00 0.00 57.88 57.54 3mks h LEU 699 Cb 1.09 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.73 3mks h LEU 699 CO 0.94 0.91 -0.14 0.03 -1.08 0.00 0.00 178.44 179.10 3mks h ARG 700 N 0.16 -0.28 0.00 1.13 3.08 -1.83 -3.28 114.38 113.36 3mks h ARG 700 Ca -0.02 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3mks h ARG 700 Cb 1.28 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.40 3mks h ARG 700 CO 0.11 -0.19 -0.47 0.66 -1.07 0.00 0.00 179.97 179.02 3mks h SER 701 N -0.29 0.00 -3.67 7.04 4.64 -1.96 -3.48 113.55 115.83 3mks h SER 701 Ca 0.01 -0.02 -0.34 0.00 -0.47 0.00 0.00 61.79 60.97 3mks h SER 701 Cb 0.29 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.43 3mks h SER 701 CO -0.06 0.01 -0.50 0.61 -0.87 0.00 0.00 176.83 176.02 3mks n GLY 702 N 1.17 -0.33 3.41 -0.77 0.00 0.89 -5.01 105.19 104.55 3mks n GLY 702 Ca 0.02 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 3mks n GLY 702 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mks s LYS 703 N -5.44 1.49 0.02 1.61 1.02 -1.17 -4.95 119.74 112.32 3mks s LYS 703 Ca 0.23 -1.52 -0.30 0.00 0.02 0.00 0.00 55.97 54.39 3mks s LYS 703 Cb -0.10 -1.77 -0.04 0.00 -0.52 0.00 0.00 37.83 35.40 3mks s LYS 703 CO 0.28 0.38 1.01 -1.17 -0.92 0.00 0.00 175.35 174.93 3mks s LEU 704 N -2.72 4.38 -0.19 3.17 2.96 -1.26 -2.15 118.68 122.87 3mks s LEU 704 Ca 0.21 1.72 -0.15 0.00 -0.22 0.00 0.00 54.13 55.69 3mks s LEU 704 Cb -0.07 -3.57 -0.09 0.00 0.50 0.00 0.00 46.19 42.95 3mks s LEU 704 CO 0.10 -0.28 -0.13 0.52 -1.32 0.00 0.00 176.35 175.24 3mks n VAL 705 N 3.83 1.48 -4.21 1.68 0.31 -0.28 -4.93 118.33 116.21 3mks n VAL 705 Ca 0.06 0.05 -0.18 0.00 -0.01 0.00 0.00 64.34 64.27 3mks n VAL 705 Cb 0.50 -2.22 -0.12 0.00 -0.91 0.00 0.00 33.84 31.09 3mks n VAL 705 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 3mks s HIS 706 N -2.43 1.06 -0.14 3.52 3.76 -1.23 -4.67 115.29 115.15 3mks s HIS 706 Ca -0.25 -0.40 0.05 0.00 -0.15 0.00 0.00 55.06 54.31 3mks s HIS 706 Cb 0.05 -0.62 -0.06 0.00 1.11 0.00 0.00 32.58 33.07 3mks s HIS 706 CO 0.40 0.02 0.17 0.00 -0.85 0.00 0.00 174.74 174.47 3mks n ALA 707 N 1.66 2.46 -0.51 -1.40 0.00 -1.26 -2.06 120.51 119.39 3mks n ALA 707 Ca -0.20 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.12 3mks n ALA 707 Cb 0.55 -0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.83 3mks n ALA 707 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3mks n ASN 708 N -1.31 0.74 -0.35 0.00 4.13 -1.26 -4.28 115.26 112.94 3mks n ASN 708 Ca 0.00 -1.26 0.12 0.00 1.68 0.00 0.00 54.58 55.13 3mks n ASN 708 Cb 0.09 0.00 0.31 0.00 -1.54 0.00 0.00 39.78 38.64 3mks n ASN 708 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 3mks h ILE 709 N 1.05 0.71 -0.51 2.41 2.04 -1.88 -0.40 117.51 120.94 3mks h ILE 709 Ca 0.00 -0.26 -0.19 0.00 1.00 0.00 0.00 64.86 65.41 3mks h ILE 709 Cb 0.52 -0.11 -0.11 0.00 -0.74 0.00 0.00 36.82 36.38 3mks h ILE 709 CO 0.00 0.14 0.12 0.18 0.00 0.00 0.00 178.15 178.59 3mks n LEU 710 N -4.77 4.88 -0.05 1.44 4.32 -1.26 -4.82 117.00 116.73 3mks n LEU 710 Ca 0.23 -3.43 0.05 0.00 -0.02 0.00 0.00 56.01 52.83 3mks n LEU 710 Cb 0.55 -0.67 0.09 0.00 -1.62 0.00 0.00 43.42 41.77 3mks n LEU 710 CO 0.21 0.98 0.16 1.17 -1.22 0.00 0.00 177.39 178.69 3mks n LYS 711 N -0.75 -0.01 0.00 3.23 4.81 -0.16 -1.02 118.16 124.26 3mks n LYS 711 Ca 0.36 0.21 0.14 0.00 -0.87 0.00 0.00 58.31 58.15 3mks n LYS 711 Cb 1.17 -0.38 0.54 0.00 0.02 0.00 0.00 35.03 36.38 3mks n LYS 711 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 3mks n ASP 712 N -3.40 1.15 -4.78 3.14 5.75 -1.26 -4.86 116.55 112.29 3mks n ASP 712 Ca 0.06 -1.22 -0.37 0.00 -0.01 0.00 0.00 54.79 53.25 3mks n ASP 712 Cb 0.19 0.02 -0.05 0.00 -1.03 0.00 0.00 41.12 40.26 3mks n ASP 712 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3mks s ALA 713 N -2.16 3.14 -0.14 2.12 0.00 -0.18 -4.82 121.76 119.72 3mks s ALA 713 Ca 0.35 0.68 0.19 0.00 0.00 0.00 0.00 51.96 53.18 3mks s ALA 713 Cb 0.21 -3.26 -0.15 0.00 0.00 0.00 0.00 23.12 19.91 3mks s ALA 713 CO 0.39 -0.12 0.73 -0.25 0.00 0.00 0.00 175.76 176.51 3mks n ASP 714 N 0.17 0.60 -3.79 0.00 8.00 0.70 -4.27 116.55 117.96 3mks n ASP 714 Ca 0.04 0.25 -0.13 0.00 0.71 0.00 0.00 54.79 55.66 3mks n ASP 714 Cb 0.49 0.69 -0.11 0.00 -0.02 0.00 0.00 41.12 42.16 3mks n ASP 714 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3mks s GLN 715 N -3.11 0.30 -0.37 -1.24 -1.52 -1.17 -1.77 119.66 110.79 3mks s GLN 715 Ca -0.04 0.27 -0.06 0.00 -1.95 0.00 0.00 55.36 53.57 3mks s GLN 715 Cb 0.10 0.14 0.07 0.00 -0.22 0.00 0.00 33.01 33.10 3mks s GLN 715 CO 0.83 -0.04 0.16 0.42 -0.25 0.00 0.00 175.29 176.41 3mks s ILE 716 N -0.02 3.76 -0.04 1.08 -1.09 -1.26 -0.31 121.20 123.31 3mks s ILE 716 Ca -0.01 -1.40 0.12 0.00 -2.23 0.00 0.00 60.65 57.12 3mks s ILE 716 Cb -0.02 -3.26 -0.07 0.00 -1.58 0.00 0.00 42.46 37.52 3mks s ILE 716 CO 0.01 -0.37 1.30 -0.50 -1.23 0.00 0.00 174.94 174.15 3mks h TRP 717 N 8.23 0.00 -1.52 3.97 -0.00 -0.90 -3.39 115.95 122.34 3mks h TRP 717 Ca -0.21 0.00 0.11 0.00 -0.00 0.00 0.00 58.89 58.79 3mks h TRP 717 Cb 1.07 0.00 -0.27 0.00 -0.00 0.00 0.00 29.16 29.96 3mks h TRP 717 CO 0.60 0.72 0.43 0.45 -0.00 0.00 0.00 178.44 180.64 3mks s SER 718 N -6.49 -0.46 0.01 -3.49 0.15 -1.10 -4.69 113.70 97.63 3mks s SER 718 Ca 0.02 0.77 0.02 0.00 0.70 0.00 0.00 55.95 57.47 3mks s SER 718 Cb 0.09 1.07 -0.01 0.00 -1.71 0.00 0.00 66.02 65.46 3mks s SER 718 CO 0.78 -0.13 -0.07 0.54 1.20 0.00 0.00 173.24 175.56 3mks s VAL 719 N 1.00 0.56 -0.26 4.45 0.11 -1.26 -0.95 120.40 124.05 3mks s VAL 719 Ca -0.05 -0.52 -0.24 0.00 -2.93 0.00 0.00 61.98 58.23 3mks s VAL 719 Cb -0.04 -0.51 0.07 0.00 -1.53 0.00 0.00 36.38 34.37 3mks s VAL 719 CO -0.13 0.00 0.70 0.21 -3.33 0.00 0.00 175.10 172.56 3mks s ASN 720 N -0.57 -0.74 0.02 3.54 3.84 -0.67 -4.44 114.94 115.92 3mks s ASN 720 Ca -0.01 1.42 -0.03 0.00 0.21 0.00 0.00 52.86 54.45 3mks s ASN 720 Cb -0.05 1.44 -0.02 0.00 -0.55 0.00 0.00 41.25 42.07 3mks s ASN 720 CO 0.00 -0.24 0.03 0.72 -2.79 0.00 0.00 177.10 174.82 3mks s PHE 721 N 0.40 0.23 -0.18 0.43 -0.12 -1.26 -0.81 117.98 116.67 3mks s PHE 721 Ca -0.00 -0.51 -0.09 0.00 -0.05 0.00 0.00 56.93 56.28 3mks s PHE 721 Cb -0.05 -0.17 0.07 0.00 -0.63 0.00 0.00 43.02 42.23 3mks s PHE 721 CO 0.01 -0.27 0.41 0.21 -0.05 0.00 0.00 175.22 175.53 3mks s LYS 722 N -1.97 0.38 6.52 1.99 2.36 -0.52 -5.02 119.74 123.47 3mks s LYS 722 Ca -0.11 0.84 0.00 0.00 -2.55 0.00 0.00 55.97 54.16 3mks s LYS 722 Cb -0.06 0.05 0.00 0.00 -1.05 0.00 0.00 37.83 36.77 3mks s LYS 722 CO -0.02 -0.18 0.00 0.41 1.55 0.00 0.00 175.35 177.11 3mks n GLY 723 N 4.51 3.59 0.82 5.54 0.00 -1.26 -0.97 105.19 117.42 3mks n GLY 723 Ca -0.20 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.88 3mks n GLY 723 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3mks n LYS 724 N 14.00 2.13 -4.06 1.61 -0.00 -1.26 -4.80 118.16 125.78 3mks n LYS 724 Ca 0.00 -1.43 -0.33 0.00 -0.00 0.00 0.00 58.31 56.55 3mks n LYS 724 Cb 0.00 -1.43 -0.15 0.00 -0.00 0.00 0.00 35.03 33.45 3mks n LYS 724 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 3mks s THR 725 N -1.58 2.34 -0.15 0.58 2.01 -0.14 -0.49 115.64 118.20 3mks s THR 725 Ca 0.26 -1.07 -0.05 0.00 0.31 0.00 0.00 61.69 61.14 3mks s THR 725 Cb 0.15 -2.11 -0.03 0.00 0.01 0.00 0.00 72.50 70.51 3mks s THR 725 CO 0.15 0.35 0.01 -0.22 -0.69 0.00 0.00 174.62 174.22 3mks s LEU 726 N 1.27 3.54 -0.02 4.42 2.96 0.31 -1.44 118.68 129.71 3mks s LEU 726 Ca 0.01 0.00 0.05 0.00 -0.22 0.00 0.00 54.13 53.98 3mks s LEU 726 Cb -0.15 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.67 3mks s LEU 726 CO -0.09 0.21 -0.17 0.68 -1.32 0.00 0.00 176.35 175.65 3mks s VAL 727 N 0.14 1.40 -0.01 1.68 -7.23 0.01 0.41 120.40 116.80 3mks s VAL 727 Ca 0.02 -0.74 0.00 0.00 -1.81 0.00 0.00 61.98 59.45 3mks s VAL 727 Cb -0.13 -1.18 0.01 0.00 0.56 0.00 0.00 36.38 35.64 3mks s VAL 727 CO 0.02 0.40 0.00 0.00 -0.31 0.00 0.00 175.10 175.21 3mks s ALA 728 N -0.27 0.13 -0.24 1.32 0.00 0.69 -1.67 121.76 121.72 3mks s ALA 728 Ca 0.03 0.08 -0.21 0.00 0.00 0.00 0.00 51.96 51.86 3mks s ALA 728 Cb -0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 3mks s ALA 728 CO 0.00 -0.02 0.68 0.00 0.00 0.00 0.00 175.76 176.42 3mks s ALA 729 N 0.42 3.61 0.24 0.00 0.00 -0.12 -0.32 121.76 125.60 3mks s ALA 729 Ca -0.04 -0.33 0.02 0.00 0.00 0.00 0.00 51.96 51.61 3mks s ALA 729 Cb -0.06 -3.09 -0.05 0.00 0.00 0.00 0.00 23.12 19.92 3mks s ALA 729 CO -0.01 -0.80 0.05 0.14 0.00 0.00 0.00 175.76 175.14 3mks s VAL 730 N 2.51 0.74 -0.06 0.00 -7.23 -0.88 -0.18 120.40 115.31 3mks s VAL 730 Ca 0.29 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.50 3mks s VAL 730 Cb -0.15 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.28 3mks s VAL 730 CO 0.08 -0.16 -0.21 -0.70 -0.31 0.00 0.00 175.10 173.80 3mks s GLU 731 N -3.96 2.55 -0.11 4.82 2.12 0.57 -1.90 118.70 122.78 3mks s GLU 731 Ca 0.33 -0.82 -0.01 0.00 0.36 0.00 0.00 54.97 54.82 3mks s GLU 731 Cb 0.07 -2.26 0.03 0.00 0.26 0.00 0.00 34.13 32.24 3mks s GLU 731 CO 0.11 0.47 -0.02 0.15 -0.54 0.00 0.00 175.26 175.43 3mks s LYS 732 N -0.36 0.97 -1.32 4.30 1.02 0.15 -0.21 119.74 124.29 3mks s LYS 732 Ca 0.03 -0.15 -0.19 0.00 0.02 0.00 0.00 55.97 55.68 3mks s LYS 732 Cb -0.12 -1.45 0.02 0.00 -0.52 0.00 0.00 37.83 35.76 3mks s LYS 732 CO 0.02 -0.36 0.48 -0.25 -0.92 0.00 0.00 175.35 174.32 3mks n ASP 733 N 5.04 -2.41 0.00 2.83 10.43 -1.26 -1.37 116.55 129.81 3mks n ASP 733 Ca -0.09 -1.21 0.00 0.00 2.57 0.00 0.00 54.79 56.06 3mks n ASP 733 Cb 0.49 -2.11 0.00 0.00 1.84 0.00 0.00 41.12 41.34 3mks n ASP 733 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3mks n GLY 734 N -2.15 1.22 3.22 0.44 0.00 -1.26 -4.99 105.19 101.68 3mks n GLY 734 Ca -0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 3mks n GLY 734 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3mks s GLN 735 N -0.35 0.96 0.05 1.61 -0.21 -0.47 -4.19 119.66 117.07 3mks s GLN 735 Ca 0.00 -1.05 0.02 0.00 0.02 0.00 0.00 55.36 54.35 3mks s GLN 735 Cb 0.00 -1.08 -0.04 0.00 1.00 0.00 0.00 33.01 32.89 3mks s GLN 735 CO 0.00 0.25 0.08 -1.54 -2.12 0.00 0.00 175.29 171.96 3mks s SER 736 N -1.82 5.57 0.04 5.90 1.04 -1.26 -0.67 113.70 122.51 3mks s SER 736 Ca 0.02 0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.49 3mks s SER 736 Cb -0.10 -1.53 -0.03 0.00 0.10 0.00 0.00 66.02 64.46 3mks s SER 736 CO 0.03 0.20 -0.05 -0.36 0.98 0.00 0.00 173.24 174.05 3mks s PHE 737 N -1.33 0.52 -0.19 5.02 0.08 -0.80 -1.55 117.98 119.73 3mks s PHE 737 Ca 0.27 -0.68 -0.09 0.00 0.12 0.00 0.00 56.93 56.55 3mks s PHE 737 Cb -0.12 -0.34 -0.05 0.00 -0.57 0.00 0.00 43.02 41.94 3mks s PHE 737 CO 0.20 -0.19 0.10 -1.17 -0.10 0.00 0.00 175.22 174.06 3mks s LEU 738 N -2.01 4.07 -0.16 -0.37 2.96 0.33 -2.07 118.68 121.42 3mks s LEU 738 Ca -0.06 0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 54.01 3mks s LEU 738 Cb -0.04 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.59 3mks s LEU 738 CO -0.03 0.19 -0.08 -1.61 -1.32 0.00 0.00 176.35 173.50 3mks s GLU 739 N 0.31 3.49 -0.05 1.98 0.41 0.57 0.13 118.70 125.54 3mks s GLU 739 Ca 0.06 -0.61 0.05 0.00 -0.41 0.00 0.00 54.97 54.06 3mks s GLU 739 Cb -0.12 -2.82 -0.01 0.00 -1.78 0.00 0.00 34.13 29.41 3mks s GLU 739 CO -0.01 0.13 -0.20 -1.50 -0.49 0.00 0.00 175.26 173.19 3mks s ILE 740 N 0.61 1.68 -0.05 -1.63 1.10 0.68 -0.22 121.20 123.36 3mks s ILE 740 Ca -0.05 -0.85 0.05 0.00 -0.51 0.00 0.00 60.65 59.29 3mks s ILE 740 Cb -0.15 -1.43 -0.01 0.00 0.15 0.00 0.00 42.46 41.02 3mks s ILE 740 CO 0.03 0.48 -0.22 -0.76 -2.11 0.00 0.00 174.94 172.35 3mks s LEU 741 N -0.02 2.01 -0.21 8.50 1.43 0.17 -1.47 118.68 129.09 3mks s LEU 741 Ca -0.04 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 3mks s LEU 741 Cb -0.13 -1.21 0.03 0.00 0.03 0.00 0.00 46.19 44.92 3mks s LEU 741 CO 0.03 0.20 -0.17 -0.62 0.23 0.00 0.00 176.35 176.03 3mks s ASP 742 N -0.06 3.58 -0.14 2.29 -1.08 -0.55 -0.53 116.67 120.18 3mks s ASP 742 Ca -0.04 -0.88 0.17 0.00 -0.52 0.00 0.00 52.55 51.28 3mks s ASP 742 Cb -0.13 -1.51 0.71 0.00 -1.46 0.00 0.00 42.92 40.53 3mks s ASP 742 CO 0.03 -0.06 1.62 0.49 0.52 0.00 0.00 175.17 177.77 3mks n PHE 743 N 4.57 1.51 1.87 -5.34 3.01 0.35 -2.06 117.46 121.37 3mks n PHE 743 Ca -0.19 -0.65 0.15 0.00 1.01 0.00 0.00 57.45 57.77 3mks n PHE 743 Cb 0.48 -0.29 0.89 0.00 -0.01 0.00 0.00 39.48 40.54 3mks n PHE 743 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64