#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqi s PHE 273 N 0.00 3.50 0.47 2.03 0.08 -1.26 -4.97 117.98 117.82 2qqi s PHE 273 Ca 0.00 1.10 0.13 0.00 0.12 0.00 0.00 56.93 58.28 2qqi s PHE 273 Cb 0.00 -2.76 1.08 0.00 -0.57 0.00 0.00 43.02 40.77 2qqi s PHE 273 CO 0.00 -0.78 2.08 0.87 -0.10 0.00 0.00 175.22 177.29 2qqi h LYS 274 N -0.32 0.27 -0.87 0.44 1.57 -2.04 -3.40 116.57 112.22 2qqi h LYS 274 Ca -0.45 -0.02 -0.17 0.00 -1.87 0.00 0.00 60.65 58.15 2qqi h LYS 274 Cb 1.22 -0.06 -0.16 0.00 0.08 0.00 0.00 32.23 33.31 2qqi h LYS 274 CO 0.62 0.18 -0.50 0.00 -0.57 0.00 0.00 179.45 179.19 2qqi n MET 276 N 2.75 1.26 -3.13 0.00 1.56 -1.18 -4.44 117.12 113.95 2qqi n MET 276 Ca 0.17 -1.68 -0.35 0.00 -0.27 0.00 0.00 57.70 55.57 2qqi n MET 276 Cb 0.57 0.06 -0.06 0.00 2.15 0.00 0.00 33.22 35.94 2qqi n MET 276 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 2qqi s GLU 277 N 0.03 4.18 0.16 2.12 2.12 0.03 -4.56 118.70 122.79 2qqi s GLU 277 Ca 0.18 0.80 -0.32 0.00 0.36 0.00 0.00 54.97 55.99 2qqi s GLU 277 Cb 0.42 -2.81 -0.11 0.00 0.26 0.00 0.00 34.13 31.90 2qqi s GLU 277 CO -0.10 0.36 1.67 0.00 -0.54 0.00 0.00 175.26 176.65 2qqi s ALA 278 N -1.60 3.83 -1.72 6.30 0.00 -1.26 -1.03 121.76 126.27 2qqi s ALA 278 Ca 0.44 1.44 0.28 0.00 0.00 0.00 0.00 51.96 54.12 2qqi s ALA 278 Cb -0.15 -3.68 0.99 0.00 0.00 0.00 0.00 23.12 20.27 2qqi s ALA 278 CO 0.20 -0.94 1.71 1.28 0.00 0.00 0.00 175.76 178.02 2qqi n LEU 279 N 4.42 0.78 0.00 0.00 4.77 0.51 -4.92 117.00 122.55 2qqi n LEU 279 Ca 0.15 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2qqi n LEU 279 Cb 0.37 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2qqi n LEU 279 CO 0.63 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 2qqi n GLY 280 N 1.31 0.17 0.50 -0.72 0.00 -1.26 -4.40 105.19 100.78 2qqi n GLY 280 Ca 0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 2qqi n GLY 280 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qqi h MET 281 N 0.00 -1.13 -0.41 1.61 2.86 -1.87 -1.79 114.93 114.20 2qqi h MET 281 Ca 0.00 0.08 -0.13 0.00 -2.06 0.00 0.00 59.70 57.59 2qqi h MET 281 Cb 0.00 0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2qqi h MET 281 CO 0.00 -0.75 -0.25 1.49 1.06 0.00 0.00 176.91 178.46 2qqi h GLU 282 N -1.17 0.84 0.00 1.72 4.81 -1.82 -3.22 114.58 115.74 2qqi h GLU 282 Ca -0.11 -0.36 -0.06 0.00 -0.13 0.00 0.00 59.36 58.70 2qqi h GLU 282 Cb 0.93 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2qqi h GLU 282 CO 0.12 1.00 -0.27 0.66 -0.73 0.00 0.00 179.01 179.79 2qqi h SER 283 N 0.73 0.00 0.00 1.04 4.64 -1.92 -3.47 113.55 114.56 2qqi h SER 283 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2qqi h SER 283 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 2qqi h SER 283 CO 0.07 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 176.91 2qqi n GLY 284 N 0.19 0.69 0.26 -0.77 0.00 -0.83 -4.95 105.19 99.79 2qqi n GLY 284 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2qqi n GLY 284 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qqi h GLU 285 N 4.25 0.50 -6.17 1.61 4.81 -1.80 -3.35 114.58 114.43 2qqi h GLU 285 Ca 0.00 -0.12 -0.57 0.00 -0.13 0.00 0.00 59.36 58.54 2qqi h GLU 285 Cb 0.00 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.27 2qqi h GLU 285 CO 0.00 0.57 0.88 0.42 -0.73 0.00 0.00 179.01 180.14 2qqi s ILE 286 N -4.87 4.40 0.43 2.32 1.01 -0.74 -4.99 121.20 118.77 2qqi s ILE 286 Ca -0.07 1.68 -0.21 0.00 0.00 0.00 0.00 60.65 62.04 2qqi s ILE 286 Cb 0.15 -4.15 -0.11 0.00 0.01 0.00 0.00 42.46 38.37 2qqi s ILE 286 CO 0.77 -0.22 0.96 -1.00 0.00 0.00 0.00 174.94 175.45 2qqi s HIS 287 N 3.54 3.31 0.47 3.97 3.76 -1.26 -4.81 115.29 124.26 2qqi s HIS 287 Ca 0.51 1.62 0.18 0.00 -0.15 0.00 0.00 55.06 57.23 2qqi s HIS 287 Cb -0.18 -2.89 1.17 0.00 1.11 0.00 0.00 32.58 31.80 2qqi s HIS 287 CO 0.13 -0.18 1.97 0.66 -0.85 0.00 0.00 174.74 176.48 2qqi h SER 288 N 1.99 0.23 -0.02 1.40 4.64 -1.93 0.50 113.55 120.35 2qqi h SER 288 Ca -0.49 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 60.85 2qqi h SER 288 Cb 1.19 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2qqi h SER 288 CO 0.61 0.13 0.03 0.44 -0.87 0.00 0.00 176.83 177.17 2qqi h ASP 289 N 0.25 0.00 0.31 4.97 3.32 -2.02 -2.12 116.42 121.13 2qqi h ASP 289 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 2qqi h ASP 289 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2qqi h ASP 289 CO -0.06 0.00 -0.17 0.00 -1.72 0.00 0.00 179.24 177.29 2qqi n GLN 290 N -3.57 0.76 -3.79 3.56 3.00 0.16 -4.72 117.38 112.79 2qqi n GLN 290 Ca -0.02 -0.35 -0.36 0.00 -0.01 0.00 0.00 57.00 56.25 2qqi n GLN 290 Cb 0.12 -1.49 -0.13 0.00 0.00 0.00 0.00 30.24 28.73 2qqi n GLN 290 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2qqi s ILE 291 N -2.48 4.01 0.17 5.09 1.01 -0.80 -0.75 121.20 127.45 2qqi s ILE 291 Ca 0.27 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.54 2qqi s ILE 291 Cb 0.20 -2.92 -0.05 0.00 0.01 0.00 0.00 42.46 39.70 2qqi s ILE 291 CO 0.49 0.28 -0.00 0.42 0.00 0.00 0.00 174.94 176.12 2qqi s THR 292 N 1.55 0.73 0.12 2.92 -4.23 -0.92 -4.74 115.64 111.08 2qqi s THR 292 Ca 0.05 -1.99 -0.03 0.00 -1.18 0.00 0.00 61.69 58.55 2qqi s THR 292 Cb -0.16 -2.12 -0.03 0.00 1.34 0.00 0.00 72.50 71.54 2qqi s THR 292 CO 0.02 -0.48 0.08 0.00 -0.54 0.00 0.00 174.62 173.70 2qqi s ALA 293 N -3.62 0.61 0.23 3.99 0.00 -1.26 -0.77 121.76 120.94 2qqi s ALA 293 Ca 0.24 -1.29 -0.08 0.00 0.00 0.00 0.00 51.96 50.82 2qqi s ALA 293 Cb 0.06 0.75 0.21 0.00 0.00 0.00 0.00 23.12 24.13 2qqi s ALA 293 CO 0.04 -0.49 1.90 0.66 0.00 0.00 0.00 175.76 177.87 2qqi h SER 294 N 2.86 1.02 -5.09 0.00 4.64 -1.61 -3.47 113.55 111.90 2qqi h SER 294 Ca -0.34 -0.03 0.10 0.00 -0.47 0.00 0.00 61.79 61.05 2qqi h SER 294 Cb 1.19 -0.25 -0.08 0.00 -0.31 0.00 0.00 62.40 62.95 2qqi h SER 294 CO 0.58 0.74 0.35 -0.94 -0.87 0.00 0.00 176.83 176.69 2qqi s SER 295 N -6.01 -0.28 0.03 4.97 1.04 -1.26 -5.02 113.70 107.17 2qqi s SER 295 Ca -0.13 -0.39 0.02 0.00 0.48 0.00 0.00 55.95 55.93 2qqi s SER 295 Cb 0.16 0.58 -0.02 0.00 0.10 0.00 0.00 66.02 66.85 2qqi s SER 295 CO 0.80 -1.05 -0.06 0.00 0.98 0.00 0.00 173.24 173.90 2qqi s GLN 296 N -3.57 0.45 0.15 4.02 -2.07 -1.26 -4.19 119.66 113.19 2qqi s GLN 296 Ca 0.10 -0.63 -0.12 0.00 -1.82 0.00 0.00 55.36 52.88 2qqi s GLN 296 Cb -0.03 -0.22 0.01 0.00 -1.09 0.00 0.00 33.01 31.68 2qqi s GLN 296 CO 0.01 0.04 1.59 -0.92 -1.32 0.00 0.00 175.29 174.69 2qqi h TYR 297 N 4.78 0.94 -2.38 9.60 3.20 -0.73 -3.34 116.97 129.04 2qqi h TYR 297 Ca -0.34 -0.17 0.19 0.00 3.14 0.00 0.00 58.73 61.55 2qqi h TYR 297 Cb 1.20 -0.24 -0.06 0.00 1.54 0.00 0.00 36.73 39.18 2qqi h TYR 297 CO 0.61 0.89 0.59 -1.54 -1.64 0.00 0.00 178.16 177.07 2qqi s SER 298 N -6.37 -0.05 0.47 -2.11 1.04 -1.26 -4.90 113.70 100.51 2qqi s SER 298 Ca -0.12 -0.54 0.22 0.00 0.48 0.00 0.00 55.95 55.99 2qqi s SER 298 Cb 0.11 0.46 1.15 0.00 0.10 0.00 0.00 66.02 67.84 2qqi s SER 298 CO 0.82 -0.89 1.97 0.71 0.98 0.00 0.00 173.24 176.83 2qqi h THR 299 N 2.00 0.79 0.00 2.02 1.35 -1.99 -1.21 112.91 115.86 2qqi h THR 299 Ca -0.27 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 2qqi h THR 299 Cb 1.22 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2qqi h THR 299 CO 0.32 0.20 0.00 0.59 -0.25 0.00 0.00 175.52 176.38 2qqi n ASN 300 N -3.77 0.00 -2.40 5.36 3.02 -1.26 -3.12 115.26 113.08 2qqi n ASN 300 Ca -0.02 -0.24 -0.08 0.00 -0.03 0.00 0.00 54.58 54.21 2qqi n ASN 300 Cb 0.31 -0.23 0.04 0.00 -0.61 0.00 0.00 39.78 39.30 2qqi n ASN 300 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2qqi n TRP 301 N -1.23 1.66 -1.53 3.10 7.02 -0.47 -4.57 117.44 121.42 2qqi n TRP 301 Ca 0.14 -2.05 -0.30 0.00 -1.02 0.00 0.00 57.50 54.26 2qqi n TRP 301 Cb 0.18 -0.26 0.08 0.00 -2.42 0.00 0.00 31.31 28.89 2qqi n TRP 301 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2qqi s SER 302 N -3.62 4.62 0.37 -0.99 1.04 -1.15 -1.77 113.70 112.20 2qqi s SER 302 Ca 0.36 1.39 0.10 0.00 0.48 0.00 0.00 55.95 58.28 2qqi s SER 302 Cb 0.36 -2.15 0.87 0.00 0.10 0.00 0.00 66.02 65.20 2qqi s SER 302 CO -0.02 -1.90 1.87 0.00 0.98 0.00 0.00 173.24 174.17 2qqi h ALA 303 N -1.04 1.89 0.00 5.32 0.00 -1.90 -1.01 119.26 122.52 2qqi h ALA 303 Ca -0.46 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2qqi h ALA 303 Cb 1.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2qqi h ALA 303 CO 0.58 -0.14 0.00 -0.85 0.00 0.00 0.00 179.25 178.85 2qqi n GLU 304 N -4.55 0.18 -0.01 0.00 0.28 -1.26 -1.66 120.64 113.61 2qqi n GLU 304 Ca 0.17 0.39 0.06 0.00 -0.16 0.00 0.00 57.16 57.63 2qqi n GLU 304 Cb 0.50 -1.84 0.33 0.00 1.43 0.00 0.00 31.44 31.87 2qqi n GLU 304 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2qqi n ARG 305 N -2.18 1.08 0.00 3.44 1.74 -0.38 -3.68 116.66 116.68 2qqi n ARG 305 Ca 0.02 -0.12 0.15 0.00 -0.77 0.00 0.00 57.85 57.14 2qqi n ARG 305 Cb 0.24 -1.20 0.83 0.00 -1.02 0.00 0.00 32.46 31.31 2qqi n ARG 305 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2qqi n SER 306 N -0.57 0.20 -4.75 0.55 3.41 -0.67 -3.43 113.62 108.37 2qqi n SER 306 Ca 0.09 -0.82 -0.41 0.00 -0.26 0.00 0.00 58.87 57.47 2qqi n SER 306 Cb 0.07 -0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 2qqi n SER 306 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2qqi s ARG 307 N -2.18 4.16 0.23 4.33 0.52 -1.24 0.64 118.95 125.42 2qqi s ARG 307 Ca 0.41 2.51 -0.31 0.00 -0.52 0.00 0.00 55.73 57.81 2qqi s ARG 307 Cb 0.21 -3.04 -0.14 0.00 0.52 0.00 0.00 34.95 32.50 2qqi s ARG 307 CO 0.40 -0.57 1.19 -0.11 0.02 0.00 0.00 175.30 176.23 2qqi n LEU 308 N 2.09 2.12 -0.87 2.53 7.94 -0.66 -1.30 117.00 128.86 2qqi n LEU 308 Ca 0.07 1.16 -0.11 0.00 -1.11 0.00 0.00 56.01 56.01 2qqi n LEU 308 Cb 0.38 -1.31 -0.05 0.00 0.53 0.00 0.00 43.42 42.98 2qqi n LEU 308 CO 0.63 -1.07 -0.11 0.59 -1.11 0.00 0.00 177.39 176.32 2qqi n ASN 309 N 1.78 -5.00 -4.72 1.96 3.02 -1.26 -4.52 115.26 106.52 2qqi n ASN 309 Ca 0.12 0.28 -0.42 0.00 -0.03 0.00 0.00 54.58 54.53 2qqi n ASN 309 Cb 0.29 -3.49 -0.02 0.00 -0.61 0.00 0.00 39.78 35.94 2qqi n ASN 309 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qqi n TYR 310 N -2.46 2.73 0.46 3.10 9.36 -0.42 -4.87 117.16 125.06 2qqi n TYR 310 Ca -0.11 0.17 0.13 0.00 3.32 0.00 0.00 57.90 61.40 2qqi n TYR 310 Cb 0.48 -2.62 0.37 0.00 -0.63 0.00 0.00 39.34 36.93 2qqi n TYR 310 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 2qqi h PRO 311 N 5.73 0.00 -3.93 2.98 0.13 -1.92 -3.43 132.00 131.56 2qqi h PRO 311 Ca -0.45 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.13 2qqi h PRO 311 Cb 1.22 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.96 2qqi h PRO 311 CO 0.87 0.00 -0.78 -2.00 -0.23 0.00 0.00 178.00 175.87 2qqi s GLU 312 N -3.20 1.12 4.04 0.86 2.12 -1.26 -5.03 118.70 117.35 2qqi s GLU 312 Ca 0.08 -0.63 0.00 0.00 0.36 0.00 0.00 54.97 54.78 2qqi s GLU 312 Cb 0.10 -2.24 0.00 0.00 0.26 0.00 0.00 34.13 32.24 2qqi s GLU 312 CO 0.59 -0.59 0.00 0.09 -0.54 0.00 0.00 175.26 174.81 2qqi n ASN 313 N 4.89 0.00 -1.26 -1.70 3.02 -1.25 -4.98 115.26 113.98 2qqi n ASN 313 Ca -0.10 0.00 -0.00 0.00 -0.03 0.00 0.00 54.58 54.44 2qqi n ASN 313 Cb 0.46 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 2qqi n ASN 313 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qqi n GLY 314 N 0.00 1.23 3.71 7.41 0.00 -1.26 -4.73 105.19 111.55 2qqi n GLY 314 Ca 0.00 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 2qqi n GLY 314 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2qqi s TRP 315 N -5.59 3.64 -0.03 1.61 -0.00 -0.84 -4.19 118.94 113.54 2qqi s TRP 315 Ca 0.03 1.66 0.02 0.00 -0.00 0.00 0.00 56.10 57.80 2qqi s TRP 315 Cb -0.00 -3.15 0.01 0.00 -0.00 0.00 0.00 33.47 30.32 2qqi s TRP 315 CO 0.01 -0.16 -0.07 0.99 -0.00 0.00 0.00 176.95 177.73 2qqi s THR 316 N 0.92 0.63 1.02 5.86 2.01 -0.73 -1.33 115.64 124.03 2qqi s THR 316 Ca 0.52 -0.24 -0.15 0.00 0.31 0.00 0.00 61.69 62.13 2qqi s THR 316 Cb -0.22 -0.60 0.20 0.00 0.01 0.00 0.00 72.50 71.88 2qqi s THR 316 CO 0.28 0.22 1.16 -2.16 -0.69 0.00 0.00 174.62 173.43 2qqi s PRO 317 N 0.48 0.28 0.52 4.92 0.04 -1.26 -0.40 135.00 139.58 2qqi s PRO 317 Ca -0.07 0.09 0.31 0.00 0.04 0.00 0.00 61.00 61.37 2qqi s PRO 317 Cb -0.11 -1.76 1.11 0.00 0.04 0.00 0.00 34.50 33.79 2qqi s PRO 317 CO 0.00 -2.74 1.89 0.78 0.04 0.00 0.00 177.00 176.97 2qqi h GLY 318 N -1.89 0.00 -4.41 0.56 0.00 -1.73 -3.20 103.07 92.40 2qqi h GLY 318 Ca -0.48 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 46.62 2qqi h GLY 318 CO 0.49 0.00 -0.71 -0.54 0.00 0.00 0.00 176.54 175.78 2qqi s GLU 319 N -3.56 0.52 -0.91 4.80 0.41 -1.26 -4.87 118.70 113.83 2qqi s GLU 319 Ca 0.03 -0.85 -0.18 0.00 -0.41 0.00 0.00 54.97 53.55 2qqi s GLU 319 Cb 0.08 -0.12 0.14 0.00 -1.78 0.00 0.00 34.13 32.45 2qqi s GLU 319 CO 0.58 -0.00 1.09 -0.51 -0.49 0.00 0.00 175.26 175.92 2qqi s ASP 320 N -1.90 6.62 0.02 -0.19 1.01 -1.26 -4.91 116.67 116.06 2qqi s ASP 320 Ca -0.07 -2.06 -0.03 0.00 0.71 0.00 0.00 52.55 51.11 2qqi s ASP 320 Cb -0.06 -2.38 -0.01 0.00 1.01 0.00 0.00 42.92 41.47 2qqi s ASP 320 CO -0.02 -1.04 0.03 -0.55 0.21 0.00 0.00 175.17 173.80 2qqi s SER 321 N 3.53 0.19 0.00 0.27 0.15 -1.26 -5.02 113.70 111.56 2qqi s SER 321 Ca 0.31 -0.46 0.19 0.00 0.70 0.00 0.00 55.95 56.69 2qqi s SER 321 Cb -0.06 0.15 0.84 0.00 -1.71 0.00 0.00 66.02 65.24 2qqi s SER 321 CO -0.09 -0.36 1.59 0.00 1.20 0.00 0.00 173.24 175.58 2qqi n TYR 322 N 1.38 0.00 1.71 3.44 4.11 -1.26 -1.63 117.16 124.90 2qqi n TYR 322 Ca -0.23 0.00 0.15 0.00 -0.00 0.00 0.00 57.90 57.82 2qqi n TYR 322 Cb 0.56 -0.43 0.71 0.00 -0.00 0.00 0.00 39.34 40.18 2qqi n TYR 322 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2qqi n ARG 323 N -1.43 1.34 -2.65 -3.48 1.74 -1.26 -4.68 116.66 106.24 2qqi n ARG 323 Ca 0.06 -0.53 -0.24 0.00 -0.77 0.00 0.00 57.85 56.37 2qqi n ARG 323 Cb 0.19 -1.49 0.03 0.00 -1.02 0.00 0.00 32.46 30.17 2qqi n ARG 323 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2qqi s GLU 324 N -2.02 2.87 0.00 5.56 0.41 -0.65 -5.01 118.70 119.87 2qqi s GLU 324 Ca 0.42 -0.32 -0.28 0.00 -0.41 0.00 0.00 54.97 54.37 2qqi s GLU 324 Cb 0.21 -2.41 0.10 0.00 -1.78 0.00 0.00 34.13 30.25 2qqi s GLU 324 CO 0.36 -0.57 0.84 1.67 -0.49 0.00 0.00 175.26 177.07 2qqi s TRP 325 N -2.80 -0.40 0.02 1.61 1.48 -1.26 -4.01 118.94 113.58 2qqi s TRP 325 Ca 0.53 0.34 0.03 0.00 -1.06 0.00 0.00 56.10 55.94 2qqi s TRP 325 Cb -0.10 0.52 -0.02 0.00 -1.16 0.00 0.00 33.47 32.71 2qqi s TRP 325 CO 0.41 -0.58 -0.09 -1.50 -4.06 0.00 0.00 176.95 171.13 2qqi s ILE 326 N -2.87 0.73 0.11 0.66 1.10 -0.75 -1.37 121.20 118.81 2qqi s ILE 326 Ca 0.02 -0.75 -0.11 0.00 -0.51 0.00 0.00 60.65 59.30 2qqi s ILE 326 Cb -0.01 -0.68 0.01 0.00 0.15 0.00 0.00 42.46 41.93 2qqi s ILE 326 CO -0.07 -0.05 0.27 0.00 -2.11 0.00 0.00 174.94 172.97 2qqi s GLN 327 N -0.90 0.96 -0.02 3.50 -2.07 0.05 -0.18 119.66 121.00 2qqi s GLN 327 Ca -0.01 -0.93 0.03 0.00 -1.82 0.00 0.00 55.36 52.62 2qqi s GLN 327 Cb -0.06 0.38 -0.00 0.00 -1.09 0.00 0.00 33.01 32.24 2qqi s GLN 327 CO 0.00 -0.34 -0.10 0.54 -1.32 0.00 0.00 175.29 174.08 2qqi s VAL 328 N -3.86 0.82 -0.47 3.63 0.11 -0.31 -2.16 120.40 118.16 2qqi s VAL 328 Ca 0.07 -0.41 -0.19 0.00 -2.93 0.00 0.00 61.98 58.52 2qqi s VAL 328 Cb 0.04 -0.72 0.04 0.00 -1.53 0.00 0.00 36.38 34.21 2qqi s VAL 328 CO -0.09 0.25 0.59 -0.62 -3.33 0.00 0.00 175.10 171.90 2qqi s ASP 329 N 0.03 6.25 0.17 3.54 2.15 0.07 -1.44 116.67 127.44 2qqi s ASP 329 Ca -0.01 -0.67 0.20 0.00 0.43 0.00 0.00 52.55 52.50 2qqi s ASP 329 Cb -0.07 -2.29 0.84 0.00 -0.30 0.00 0.00 42.92 41.10 2qqi s ASP 329 CO 0.00 -0.79 1.60 0.18 -0.17 0.00 0.00 175.17 175.99 2qqi n LEU 330 N 6.08 0.42 0.00 -1.34 4.77 0.11 -4.83 117.00 122.21 2qqi n LEU 330 Ca -0.05 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 2qqi n LEU 330 Cb 0.47 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2qqi n LEU 330 CO 0.52 -0.49 0.00 0.61 -1.33 0.00 0.00 177.39 176.70 2qqi n GLY 331 N -0.16 2.96 3.57 -0.72 0.00 -1.26 -4.95 105.19 104.63 2qqi n GLY 331 Ca 0.02 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 2qqi n GLY 331 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qqi s LEU 332 N 0.00 0.30 0.21 0.99 1.43 -1.26 -5.13 118.68 115.21 2qqi s LEU 332 Ca 0.00 -0.81 -0.30 0.00 -1.03 0.00 0.00 54.13 51.99 2qqi s LEU 332 Cb 0.00 1.85 -0.09 0.00 0.03 0.00 0.00 46.19 47.98 2qqi s LEU 332 CO 0.00 -1.11 1.39 -0.76 0.23 0.00 0.00 176.35 176.10 2qqi s LEU 333 N -2.97 4.40 0.26 1.79 1.43 -1.26 -4.35 118.68 117.98 2qqi s LEU 333 Ca 0.18 2.52 0.03 0.00 -1.03 0.00 0.00 54.13 55.83 2qqi s LEU 333 Cb -0.01 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.55 2qqi s LEU 333 CO 0.05 -0.63 0.04 -0.13 0.23 0.00 0.00 176.35 175.91 2qqi s ARG 334 N 0.01 1.44 0.00 1.70 1.81 -0.13 -4.67 118.95 119.12 2qqi s ARG 334 Ca 0.60 -1.76 -0.26 0.00 -1.72 0.00 0.00 55.73 52.58 2qqi s ARG 334 Cb -0.39 -0.57 -0.04 0.00 -0.45 0.00 0.00 34.95 33.50 2qqi s ARG 334 CO 0.39 -0.18 0.83 -0.06 -0.68 0.00 0.00 175.30 175.59 2qqi s PHE 335 N -3.49 3.67 -0.13 -0.53 0.08 -0.39 -1.50 117.98 115.69 2qqi s PHE 335 Ca 0.33 1.50 0.02 0.00 0.12 0.00 0.00 56.93 58.91 2qqi s PHE 335 Cb 0.07 -2.93 0.00 0.00 -0.57 0.00 0.00 43.02 39.60 2qqi s PHE 335 CO 0.12 0.13 -0.20 0.08 -0.10 0.00 0.00 175.22 175.25 2qqi s VAL 336 N 0.52 2.32 0.00 -0.44 1.01 0.05 -1.44 120.40 122.41 2qqi s VAL 336 Ca 0.43 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2qqi s VAL 336 Cb -0.20 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.25 2qqi s VAL 336 CO 0.24 0.54 0.00 0.35 0.00 0.00 0.00 175.10 176.23 2qqi n THR 337 N 3.82 0.00 -3.49 3.92 -2.24 0.14 -1.55 114.28 114.88 2qqi n THR 337 Ca -0.19 -0.36 -0.09 0.00 -2.27 0.00 0.00 64.05 61.14 2qqi n THR 337 Cb 0.52 0.87 -0.02 0.00 -2.10 0.00 0.00 70.33 69.60 2qqi n THR 337 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qqi s ALA 338 N -1.20 -1.77 0.16 6.98 0.00 -1.13 -1.36 121.76 123.43 2qqi s ALA 338 Ca 0.00 0.90 0.07 0.00 0.00 0.00 0.00 51.96 52.93 2qqi s ALA 338 Cb 0.00 0.51 -0.04 0.00 0.00 0.00 0.00 23.12 23.59 2qqi s ALA 338 CO 0.00 -0.71 -0.15 0.14 0.00 0.00 0.00 175.76 175.04 2qqi s VAL 339 N -3.25 1.56 0.01 0.00 -7.23 -0.48 -0.63 120.40 110.38 2qqi s VAL 339 Ca 0.04 -1.92 0.04 0.00 -1.81 0.00 0.00 61.98 58.33 2qqi s VAL 339 Cb -0.01 -1.77 -0.01 0.00 0.56 0.00 0.00 36.38 35.14 2qqi s VAL 339 CO -0.10 -0.45 -0.12 -0.83 -0.31 0.00 0.00 175.10 173.29 2qqi s GLY 340 N -2.78 0.62 0.10 2.32 0.00 -0.10 0.22 107.32 107.70 2qqi s GLY 340 Ca 0.15 -0.62 0.03 0.00 0.00 0.00 0.00 44.72 44.28 2qqi s GLY 340 CO 0.05 -0.57 -0.08 -0.51 0.00 0.00 0.00 173.10 171.99 2qqi s THR 341 N -0.55 0.79 0.14 0.90 -4.23 -0.08 -0.93 115.64 111.68 2qqi s THR 341 Ca 0.02 -1.76 0.01 0.00 -1.18 0.00 0.00 61.69 58.78 2qqi s THR 341 Cb -0.06 -1.48 -0.04 0.00 1.34 0.00 0.00 72.50 72.26 2qqi s THR 341 CO 0.00 -0.71 -0.00 -1.10 -0.54 0.00 0.00 174.62 172.27 2qqi s GLN 342 N -3.26 0.97 0.00 3.99 -0.21 0.71 -1.30 119.66 120.55 2qqi s GLN 342 Ca 0.08 -1.45 0.00 0.00 0.02 0.00 0.00 55.36 54.01 2qqi s GLN 342 Cb 0.01 -0.09 0.00 0.00 1.00 0.00 0.00 33.01 33.93 2qqi s GLN 342 CO -0.02 -0.14 0.00 0.41 -2.12 0.00 0.00 175.29 173.42 2qqi n GLY 343 N -0.14 1.29 3.43 3.09 0.00 -1.20 -1.28 105.19 110.37 2qqi n GLY 343 Ca -0.08 -1.74 -0.16 0.00 0.00 0.00 0.00 46.02 44.04 2qqi n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqi s ALA 344 N -3.35 -1.45 -0.17 4.61 0.00 -0.21 -4.22 121.76 116.96 2qqi s ALA 344 Ca 0.00 0.94 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 2qqi s ALA 344 Cb 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.18 2qqi s ALA 344 CO 0.00 -0.37 0.12 0.42 0.00 0.00 0.00 175.76 175.92 2qqi s ILE 345 N -1.49 5.29 0.06 0.00 1.01 -1.26 -1.15 121.20 123.66 2qqi s ILE 345 Ca -0.10 0.14 -0.31 0.00 0.00 0.00 0.00 60.65 60.38 2qqi s ILE 345 Cb -0.01 -3.38 -0.08 0.00 0.01 0.00 0.00 42.46 39.00 2qqi s ILE 345 CO 0.06 0.49 1.58 -0.55 0.00 0.00 0.00 174.94 176.52 2qqi s SER 346 N -0.01 6.67 0.36 3.58 0.15 -0.19 -3.87 113.70 120.38 2qqi s SER 346 Ca 0.09 2.39 0.06 0.00 0.70 0.00 0.00 55.95 59.19 2qqi s SER 346 Cb -0.11 -2.56 0.67 0.00 -1.71 0.00 0.00 66.02 62.30 2qqi s SER 346 CO -0.00 -0.84 1.90 0.50 1.20 0.00 0.00 173.24 176.00 2qqi h LYS 347 N 8.10 0.44 0.02 5.44 3.64 -1.95 0.12 116.57 132.37 2qqi h LYS 347 Ca -0.41 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2qqi h LYS 347 Cb 1.20 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2qqi h LYS 347 CO 0.92 0.49 -0.01 0.93 -2.27 0.00 0.00 179.45 179.51 2qqi h GLU 348 N 0.43 -0.03 0.00 1.90 4.39 -1.99 -3.40 114.58 115.89 2qqi h GLU 348 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 2qqi h GLU 348 Cb 0.32 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 2qqi h GLU 348 CO 0.01 0.55 -1.04 0.25 -1.16 0.00 0.00 179.01 177.62 2qqi n THR 349 N -4.82 0.00 -0.99 1.13 -2.24 -1.21 -4.99 114.28 101.16 2qqi n THR 349 Ca -0.09 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2qqi n THR 349 Cb 0.30 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2qqi n THR 349 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qqi n LYS 350 N -1.59 -1.04 -2.05 -0.78 4.01 0.40 -5.00 118.16 112.11 2qqi n LYS 350 Ca -0.00 0.26 -0.36 0.00 -0.51 0.00 0.00 58.31 57.70 2qqi n LYS 350 Cb 0.24 -4.06 0.03 0.00 -0.51 0.00 0.00 35.03 30.72 2qqi n LYS 350 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2qqi s LYS 351 N -1.06 3.07 -0.24 1.97 1.02 -1.26 -4.66 119.74 118.58 2qqi s LYS 351 Ca 0.00 1.82 -0.06 0.00 0.02 0.00 0.00 55.97 57.75 2qqi s LYS 351 Cb 0.00 -1.98 -0.02 0.00 -0.52 0.00 0.00 37.83 35.31 2qqi s LYS 351 CO 0.00 -1.12 0.03 0.15 -0.92 0.00 0.00 175.35 173.49 2qqi s LYS 352 N -3.27 3.53 -0.01 1.68 1.02 -1.26 -1.02 119.74 120.41 2qqi s LYS 352 Ca 0.76 -0.55 0.07 0.00 0.02 0.00 0.00 55.97 56.27 2qqi s LYS 352 Cb -0.30 -3.22 -0.02 0.00 -0.52 0.00 0.00 37.83 33.77 2qqi s LYS 352 CO 0.33 -0.21 -0.22 0.71 -0.92 0.00 0.00 175.35 175.04 2qqi s TYR 353 N 1.56 2.44 -0.02 3.18 2.02 -0.30 -4.63 117.35 121.61 2qqi s TYR 353 Ca 0.06 -0.35 -0.29 0.00 -0.37 0.00 0.00 57.07 56.13 2qqi s TYR 353 Cb -0.15 -1.50 0.09 0.00 -0.40 0.00 0.00 41.96 39.99 2qqi s TYR 353 CO 0.01 0.08 0.77 1.52 -1.57 0.00 0.00 175.55 176.36 2qqi s TYR 354 N -0.72 -0.52 -0.20 2.71 1.13 -1.12 -1.05 117.35 117.59 2qqi s TYR 354 Ca 0.11 0.70 -0.17 0.00 -1.41 0.00 0.00 57.07 56.31 2qqi s TYR 354 Cb -0.10 0.47 -0.04 0.00 -1.10 0.00 0.00 41.96 41.19 2qqi s TYR 354 CO 0.01 -0.59 0.44 0.08 -2.51 0.00 0.00 175.55 172.98 2qqi s VAL 355 N -2.02 5.17 -0.06 -3.49 1.01 -1.25 -0.59 120.40 119.17 2qqi s VAL 355 Ca -0.04 0.80 -0.03 0.00 0.00 0.00 0.00 61.98 62.71 2qqi s VAL 355 Cb -0.00 -3.77 -0.27 0.00 0.00 0.00 0.00 36.38 32.34 2qqi s VAL 355 CO 0.00 0.23 0.61 0.11 0.00 0.00 0.00 175.10 176.05 2qqi h LYS 356 N 7.38 0.24 -3.67 2.72 1.57 -1.01 -0.16 116.57 123.64 2qqi h LYS 356 Ca -0.35 -0.41 -0.13 0.00 -1.87 0.00 0.00 60.65 57.89 2qqi h LYS 356 Cb 1.16 0.15 -0.19 0.00 0.08 0.00 0.00 32.23 33.43 2qqi h LYS 356 CO 0.73 1.08 -0.50 0.95 -0.57 0.00 0.00 179.45 181.14 2qqi s THR 357 N -2.59 0.11 0.14 -0.16 -4.23 -1.12 -0.08 115.64 107.71 2qqi s THR 357 Ca -0.14 -0.91 -0.19 0.00 -1.18 0.00 0.00 61.69 59.26 2qqi s THR 357 Cb 0.07 -0.71 0.05 0.00 1.34 0.00 0.00 72.50 73.25 2qqi s THR 357 CO 0.82 -0.50 0.49 -0.72 -0.54 0.00 0.00 174.62 174.17 2qqi s TYR 358 N -2.12 -0.36 0.24 3.99 -0.85 -0.95 -0.62 117.35 116.68 2qqi s TYR 358 Ca -0.09 0.10 0.05 0.00 -0.52 0.00 0.00 57.07 56.61 2qqi s TYR 358 Cb -0.04 0.39 -0.03 0.00 0.38 0.00 0.00 41.96 42.66 2qqi s TYR 358 CO -0.02 -0.76 0.34 0.15 -1.52 0.00 0.00 175.55 173.74 2qqi s LYS 359 N -3.72 3.39 -0.09 -3.49 1.02 -0.63 -0.18 119.74 116.04 2qqi s LYS 359 Ca 0.02 -0.78 0.02 0.00 0.02 0.00 0.00 55.97 55.25 2qqi s LYS 359 Cb 0.01 -2.86 0.01 0.00 -0.52 0.00 0.00 37.83 34.47 2qqi s LYS 359 CO -0.12 0.43 -0.16 0.42 -0.92 0.00 0.00 175.35 175.00 2qqi s ILE 360 N -1.98 1.49 -0.06 2.17 1.01 -1.26 -0.92 121.20 121.64 2qqi s ILE 360 Ca 0.34 -0.66 -0.02 0.00 0.00 0.00 0.00 60.65 60.31 2qqi s ILE 360 Cb -0.09 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 2qqi s ILE 360 CO 0.29 0.44 0.05 -1.81 0.00 0.00 0.00 174.94 173.90 2qqi s ASP 361 N 0.77 5.53 0.10 3.58 1.11 -0.19 -1.06 116.67 126.52 2qqi s ASP 361 Ca -0.11 0.19 0.08 0.00 0.18 0.00 0.00 52.55 52.88 2qqi s ASP 361 Cb -0.16 -1.60 -0.03 0.00 1.07 0.00 0.00 42.92 42.20 2qqi s ASP 361 CO 0.02 0.35 -0.21 0.68 1.18 0.00 0.00 175.17 177.19 2qqi s VAL 362 N -1.01 1.69 -0.13 -1.27 -7.23 0.14 -0.87 120.40 111.71 2qqi s VAL 362 Ca 0.17 -1.53 -0.10 0.00 -1.81 0.00 0.00 61.98 58.70 2qqi s VAL 362 Cb -0.12 -1.54 0.04 0.00 0.56 0.00 0.00 36.38 35.33 2qqi s VAL 362 CO 0.06 -0.07 0.34 -0.55 -0.31 0.00 0.00 175.10 174.58 2qqi s SER 363 N -1.90 -0.38 0.50 4.85 0.15 -0.83 -0.86 113.70 115.22 2qqi s SER 363 Ca 0.06 0.71 0.29 0.00 0.70 0.00 0.00 55.95 57.71 2qqi s SER 363 Cb -0.10 0.67 1.15 0.00 -1.71 0.00 0.00 66.02 66.03 2qqi s SER 363 CO 0.04 -0.14 1.91 0.77 1.20 0.00 0.00 173.24 177.02 2qqi h SER 364 N 6.23 0.00 0.00 5.45 4.64 -1.83 -1.06 113.55 126.98 2qqi h SER 364 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2qqi h SER 364 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2qqi h SER 364 CO 0.31 0.11 -0.01 -0.46 -0.87 0.00 0.00 176.83 175.91 2qqi n ASN 365 N -3.25 0.04 0.00 4.97 0.23 -1.26 -4.62 115.26 111.37 2qqi n ASN 365 Ca 0.00 -0.08 0.00 0.00 -0.53 0.00 0.00 54.58 53.97 2qqi n ASN 365 Cb 0.36 0.17 0.00 0.00 -2.08 0.00 0.00 39.78 38.23 2qqi n ASN 365 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2qqi n GLY 366 N 0.18 0.80 0.47 4.83 0.00 -1.26 -4.84 105.19 105.36 2qqi n GLY 366 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2qqi n GLY 366 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qqi n GLU 367 N -2.24 0.17 -3.44 1.61 1.02 -1.26 -4.97 120.64 111.53 2qqi n GLU 367 Ca 0.00 0.06 -0.42 0.00 -0.02 0.00 0.00 57.16 56.78 2qqi n GLU 367 Cb 0.00 -0.93 -0.10 0.00 -0.02 0.00 0.00 31.44 30.40 2qqi n GLU 367 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2qqi s ASP 368 N -5.30 6.13 -0.12 1.62 1.01 -1.26 -5.07 116.67 113.68 2qqi s ASP 368 Ca -0.10 -0.56 -0.02 0.00 0.71 0.00 0.00 52.55 52.57 2qqi s ASP 368 Cb 0.04 -2.17 -0.03 0.00 1.01 0.00 0.00 42.92 41.76 2qqi s ASP 368 CO 0.15 -0.39 -0.04 0.26 0.21 0.00 0.00 175.17 175.37 2qqi s TRP 369 N 1.86 3.04 -0.12 4.23 0.52 -1.26 -4.38 118.94 122.82 2qqi s TRP 369 Ca 0.08 -0.10 0.02 0.00 0.02 0.00 0.00 56.10 56.13 2qqi s TRP 369 Cb -0.18 -1.86 0.01 0.00 -1.15 0.00 0.00 33.47 30.30 2qqi s TRP 369 CO 0.11 0.18 -0.20 0.42 0.02 0.00 0.00 176.95 177.48 2qqi s ILE 370 N -0.22 1.85 0.12 2.03 -1.09 -0.04 -4.92 121.20 118.93 2qqi s ILE 370 Ca 0.04 -0.86 -0.30 0.00 -2.23 0.00 0.00 60.65 57.30 2qqi s ILE 370 Cb -0.13 -1.65 -0.06 0.00 -1.58 0.00 0.00 42.46 39.05 2qqi s ILE 370 CO 0.02 0.51 0.96 -0.89 -1.23 0.00 0.00 174.94 174.32 2qqi s THR 371 N 0.78 4.45 0.12 2.92 2.01 -1.26 -0.69 115.64 123.97 2qqi s THR 371 Ca -0.09 2.06 -0.31 0.00 0.31 0.00 0.00 61.69 63.66 2qqi s THR 371 Cb -0.16 -4.32 -0.09 0.00 0.01 0.00 0.00 72.50 67.95 2qqi s THR 371 CO 0.00 0.33 1.52 -0.63 -0.69 0.00 0.00 174.62 175.16 2qqi s ILE 372 N -0.10 2.99 0.12 1.82 1.01 -0.22 -4.95 121.20 121.87 2qqi s ILE 372 Ca 0.47 0.64 0.03 0.00 0.00 0.00 0.00 60.65 61.79 2qqi s ILE 372 Cb -0.24 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 2qqi s ILE 372 CO 0.30 0.03 -0.08 -0.54 0.00 0.00 0.00 174.94 174.66 2qqi s LYS 373 N 1.57 0.94 -0.27 2.79 1.02 -1.26 -0.47 119.74 124.06 2qqi s LYS 373 Ca 0.69 -1.39 0.03 0.00 0.02 0.00 0.00 55.97 55.32 2qqi s LYS 373 Cb -0.40 -0.38 0.06 0.00 -0.52 0.00 0.00 37.83 36.60 2qqi s LYS 373 CO 0.31 0.02 -0.09 -2.00 -0.92 0.00 0.00 175.35 172.66 2qqi s GLU 374 N -3.80 2.18 7.53 1.68 2.56 0.06 -4.81 118.70 124.09 2qqi s GLU 374 Ca 0.14 -1.39 0.00 0.00 0.00 0.00 0.00 54.97 53.72 2qqi s GLU 374 Cb 0.04 -2.92 0.00 0.00 2.00 0.00 0.00 34.13 33.25 2qqi s GLU 374 CO -0.02 -0.60 0.00 0.41 -0.56 0.00 0.00 175.26 174.49 2qqi n GLY 375 N 4.42 2.82 1.26 -1.50 0.00 -1.26 -2.48 105.19 108.45 2qqi n GLY 375 Ca -0.13 -0.23 0.09 0.00 0.00 0.00 0.00 46.02 45.76 2qqi n GLY 375 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qqi n ASN 376 N 6.98 4.03 -4.30 1.61 3.02 -1.26 -4.92 115.26 120.42 2qqi n ASN 376 Ca 0.00 -2.23 -0.35 0.00 -0.03 0.00 0.00 54.58 51.97 2qqi n ASN 376 Cb 0.00 -0.47 -0.14 0.00 -0.61 0.00 0.00 39.78 38.56 2qqi n ASN 376 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2qqi s LYS 377 N -1.42 3.33 0.23 3.52 2.20 -1.03 -5.07 119.74 121.49 2qqi s LYS 377 Ca 0.44 -0.66 -0.31 0.00 -0.36 0.00 0.00 55.97 55.09 2qqi s LYS 377 Cb 0.26 -3.00 -0.15 0.00 -1.51 0.00 0.00 37.83 33.43 2qqi s LYS 377 CO 0.25 -0.22 1.14 -2.30 -0.36 0.00 0.00 175.35 173.87 2qqi n PRO 378 N 4.79 1.40 -2.56 4.03 -0.02 -1.26 -0.76 135.00 140.62 2qqi n PRO 378 Ca -0.18 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.37 2qqi n PRO 378 Cb 0.51 -1.97 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 2qqi n PRO 378 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2qqi s VAL 379 N -0.53 4.45 -0.76 -1.45 1.01 0.38 -4.78 120.40 118.72 2qqi s VAL 379 Ca 0.66 1.76 -0.17 0.00 0.00 0.00 0.00 61.98 64.23 2qqi s VAL 379 Cb -0.75 -4.13 0.15 0.00 0.00 0.00 0.00 36.38 31.66 2qqi s VAL 379 CO 0.55 0.08 0.82 -0.76 0.00 0.00 0.00 175.10 175.79 2qqi s LEU 380 N 1.50 5.86 0.32 3.92 1.43 -1.26 -4.40 118.68 126.05 2qqi s LEU 380 Ca 0.54 -2.07 -0.29 0.00 -1.03 0.00 0.00 54.13 51.29 2qqi s LEU 380 Cb -0.24 -2.29 -0.10 0.00 0.03 0.00 0.00 46.19 43.59 2qqi s LEU 380 CO 0.25 -0.89 1.32 -0.36 0.23 0.00 0.00 176.35 176.90 2qqi s PHE 381 N 1.70 3.06 -0.24 0.29 0.08 0.75 -4.80 117.98 118.81 2qqi s PHE 381 Ca 0.18 1.37 -0.27 0.00 0.12 0.00 0.00 56.93 58.34 2qqi s PHE 381 Cb -0.15 -3.69 0.00 0.00 -0.57 0.00 0.00 43.02 38.62 2qqi s PHE 381 CO -0.03 -1.92 0.92 -0.65 -0.10 0.00 0.00 175.22 173.44 2qqi s GLN 382 N -1.57 4.21 0.00 0.44 -1.52 -1.26 -2.25 119.66 117.71 2qqi s GLN 382 Ca 0.50 1.12 0.00 0.00 -1.95 0.00 0.00 55.36 55.04 2qqi s GLN 382 Cb -0.40 -3.64 0.00 0.00 -0.22 0.00 0.00 33.01 28.75 2qqi s GLN 382 CO 0.51 -0.57 0.00 0.41 -0.25 0.00 0.00 175.29 175.39 2qqi n GLY 383 N 3.57 1.45 3.91 3.09 0.00 0.89 -4.83 105.19 113.27 2qqi n GLY 383 Ca 0.08 -0.46 -0.27 0.00 0.00 0.00 0.00 46.02 45.38 2qqi n GLY 383 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qqi s ASN 384 N -0.44 6.37 0.00 1.61 -0.87 -0.07 -4.88 114.94 116.65 2qqi s ASN 384 Ca 0.00 0.69 0.00 0.00 -1.57 0.00 0.00 52.86 51.98 2qqi s ASN 384 Cb 0.00 -2.14 0.00 0.00 -0.02 0.00 0.00 41.25 39.09 2qqi s ASN 384 CO 0.00 -0.30 0.76 0.35 -2.57 0.00 0.00 177.10 175.35 2qqi n THR 385 N -1.42 0.57 -3.75 1.60 -2.24 -1.26 -4.13 114.28 103.65 2qqi n THR 385 Ca -0.02 -0.72 -0.04 0.00 -2.27 0.00 0.00 64.05 61.00 2qqi n THR 385 Cb 0.55 0.76 -0.01 0.00 -2.10 0.00 0.00 70.33 69.52 2qqi n THR 385 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2qqi s ASN 386 N -0.57 -0.20 0.00 3.42 2.20 -1.26 -5.09 114.94 113.44 2qqi s ASN 386 Ca 0.00 -0.40 0.27 0.00 -0.94 0.00 0.00 52.86 51.79 2qqi s ASN 386 Cb 0.00 0.51 0.84 0.00 -2.00 0.00 0.00 41.25 40.60 2qqi s ASN 386 CO 0.00 -0.93 1.62 -0.81 -2.94 0.00 0.00 177.10 174.03 2qqi n PRO 387 N -0.45 1.19 -0.05 3.55 -0.04 -1.26 -4.19 135.00 133.75 2qqi n PRO 387 Ca -0.06 -0.71 -0.06 0.00 -0.04 0.00 0.00 63.50 62.62 2qqi n PRO 387 Cb 0.61 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 32.51 2qqi n PRO 387 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2qqi n THR 388 N -0.28 0.68 -2.45 0.52 -2.24 -1.26 -3.06 114.28 106.19 2qqi n THR 388 Ca 0.15 -0.37 -0.33 0.00 -2.27 0.00 0.00 64.05 61.23 2qqi n THR 388 Cb 0.36 -0.80 -0.04 0.00 -2.10 0.00 0.00 70.33 67.75 2qqi n THR 388 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2qqi s ASP 389 N -4.49 6.55 -0.05 3.42 1.01 -1.26 -4.92 116.67 116.93 2qqi s ASP 389 Ca -0.08 1.66 -0.21 0.00 0.71 0.00 0.00 52.55 54.63 2qqi s ASP 389 Cb 0.03 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.39 2qqi s ASP 389 CO 0.37 -0.63 0.60 -0.69 0.21 0.00 0.00 175.17 175.02 2qqi s VAL 390 N -2.45 5.02 -0.16 -1.27 1.01 -1.26 -4.39 120.40 116.89 2qqi s VAL 390 Ca 0.61 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.82 2qqi s VAL 390 Cb -0.11 -3.93 -0.00 0.00 0.00 0.00 0.00 36.38 32.34 2qqi s VAL 390 CO 0.27 0.35 -0.15 -0.69 0.00 0.00 0.00 175.10 174.88 2qqi s VAL 391 N 0.27 2.67 0.07 2.92 1.01 -0.42 -4.94 120.40 121.98 2qqi s VAL 391 Ca 0.32 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.48 2qqi s VAL 391 Cb -0.17 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2qqi s VAL 391 CO 0.16 0.51 0.31 0.68 0.00 0.00 0.00 175.10 176.76 2qqi s VAL 392 N 0.87 5.25 -0.36 2.92 -7.23 -1.26 -0.91 120.40 119.69 2qqi s VAL 392 Ca -0.04 0.04 0.04 0.00 -1.81 0.00 0.00 61.98 60.21 2qqi s VAL 392 Cb -0.15 -3.60 0.10 0.00 0.56 0.00 0.00 36.38 33.29 2qqi s VAL 392 CO -0.01 0.20 0.07 0.00 -0.31 0.00 0.00 175.10 175.05 2qqi s ALA 393 N -1.47 2.90 -0.03 1.32 0.00 0.13 -4.98 121.76 119.62 2qqi s ALA 393 Ca 0.34 -2.58 -0.19 0.00 0.00 0.00 0.00 51.96 49.53 2qqi s ALA 393 Cb -0.13 -1.98 -0.05 0.00 0.00 0.00 0.00 23.12 20.96 2qqi s ALA 393 CO 0.21 -1.72 0.54 0.08 0.00 0.00 0.00 175.76 174.87 2qqi s VAL 394 N 0.81 4.98 0.41 0.00 1.01 -1.26 -1.38 120.40 124.97 2qqi s VAL 394 Ca 0.12 1.12 -0.18 0.00 0.00 0.00 0.00 61.98 63.03 2qqi s VAL 394 Cb -0.20 -3.87 -0.10 0.00 0.00 0.00 0.00 36.38 32.21 2qqi s VAL 394 CO -0.08 0.42 0.88 -0.36 0.00 0.00 0.00 175.10 175.97 2qqi s PHE 395 N -0.16 3.35 0.43 5.22 0.08 -0.47 -4.98 117.98 121.46 2qqi s PHE 395 Ca 0.29 1.45 0.23 0.00 0.12 0.00 0.00 56.93 59.02 2qqi s PHE 395 Cb -0.17 -2.73 1.30 0.00 -0.57 0.00 0.00 43.02 40.85 2qqi s PHE 395 CO 0.15 -0.08 2.04 -1.00 -0.10 0.00 0.00 175.22 176.23 2qqi h PRO 396 N 1.86 0.00 -3.54 0.24 0.13 -1.98 -3.44 132.00 125.26 2qqi h PRO 396 Ca -0.48 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 2qqi h PRO 396 Cb 1.18 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.10 2qqi h PRO 396 CO 0.62 0.15 -0.50 0.15 -0.23 0.00 0.00 178.00 178.19 2qqi s LYS 397 N -4.33 0.47 0.62 0.86 1.02 -1.26 -5.15 119.74 111.97 2qqi s LYS 397 Ca -0.03 -0.42 -0.18 0.00 0.02 0.00 0.00 55.97 55.37 2qqi s LYS 397 Cb 0.14 0.20 -0.02 0.00 -0.52 0.00 0.00 37.83 37.62 2qqi s LYS 397 CO 0.62 -0.11 1.19 -2.14 -0.92 0.00 0.00 175.35 173.99 2qqi s PRO 398 N -1.39 2.83 0.17 -1.68 0.02 -1.26 -4.89 135.00 128.79 2qqi s PRO 398 Ca -0.15 1.76 0.09 0.00 0.02 0.00 0.00 61.00 62.73 2qqi s PRO 398 Cb -0.08 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 2qqi s PRO 398 CO 0.01 -1.30 -0.14 -0.51 -0.33 0.00 0.00 177.00 174.73 2qqi s LEU 399 N -4.33 2.82 -0.23 -5.54 1.43 -0.60 -4.97 118.68 107.28 2qqi s LEU 399 Ca 0.76 -0.62 -0.08 0.00 -1.03 0.00 0.00 54.13 53.16 2qqi s LEU 399 Cb -0.29 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2qqi s LEU 399 CO 0.36 0.12 0.09 -0.63 0.23 0.00 0.00 176.35 176.52 2qqi s ILE 400 N -1.57 4.69 0.21 -0.59 1.01 -1.26 -0.77 121.20 122.92 2qqi s ILE 400 Ca 0.23 -0.05 -0.22 0.00 0.00 0.00 0.00 60.65 60.60 2qqi s ILE 400 Cb -0.09 -3.17 0.04 0.00 0.01 0.00 0.00 42.46 39.25 2qqi s ILE 400 CO 0.13 0.37 0.71 0.28 0.00 0.00 0.00 174.94 176.43 2qqi s THR 401 N 1.14 0.00 -0.15 2.92 -1.32 -0.56 -4.27 115.64 113.39 2qqi s THR 401 Ca 0.05 -0.58 0.02 0.00 -1.21 0.00 0.00 61.69 59.97 2qqi s THR 401 Cb -0.14 -1.61 -0.11 0.00 -1.51 0.00 0.00 72.50 69.13 2qqi s THR 401 CO 0.04 0.00 -0.11 -1.14 -2.21 0.00 0.00 174.62 171.19 2qqi n ARG 402 N -0.42 0.60 -5.10 7.08 0.63 -0.95 -0.95 116.66 117.55 2qqi n ARG 402 Ca -0.09 0.08 -0.32 0.00 -0.92 0.00 0.00 57.85 56.60 2qqi n ARG 402 Cb 0.61 -1.31 -0.15 0.00 0.45 0.00 0.00 32.46 32.06 2qqi n ARG 402 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2qqi s PHE 403 N -2.30 2.55 -0.15 -0.14 0.40 -0.44 0.04 117.98 117.93 2qqi s PHE 403 Ca -0.19 -0.52 0.01 0.00 -0.60 0.00 0.00 56.93 55.63 2qqi s PHE 403 Cb 0.05 -1.63 0.02 0.00 0.51 0.00 0.00 43.02 41.97 2qqi s PHE 403 CO 0.37 -0.09 -0.18 0.08 0.70 0.00 0.00 175.22 176.10 2qqi s VAL 404 N -0.29 1.86 -0.13 -0.44 1.01 -0.52 -1.97 120.40 119.92 2qqi s VAL 404 Ca 0.01 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.19 2qqi s VAL 404 Cb -0.13 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.57 2qqi s VAL 404 CO 0.03 0.51 -0.21 -0.60 0.00 0.00 0.00 175.10 174.82 2qqi s ARG 405 N 1.20 2.88 -0.16 2.72 3.52 -0.05 -1.17 118.95 127.88 2qqi s ARG 405 Ca 0.01 -0.81 -0.06 0.00 -0.13 0.00 0.00 55.73 54.74 2qqi s ARG 405 Cb -0.14 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.91 2qqi s ARG 405 CO -0.08 0.02 0.04 0.42 -0.81 0.00 0.00 175.30 174.88 2qqi s ILE 406 N 0.74 4.58 -0.40 4.11 1.01 0.74 -1.02 121.20 130.96 2qqi s ILE 406 Ca -0.10 -0.11 0.03 0.00 0.00 0.00 0.00 60.65 60.47 2qqi s ILE 406 Cb -0.16 -3.04 0.11 0.00 0.01 0.00 0.00 42.46 39.39 2qqi s ILE 406 CO 0.00 0.49 0.13 -0.54 0.00 0.00 0.00 174.94 175.03 2qqi s LYS 407 N 0.18 1.48 0.23 2.79 1.02 -0.10 -1.81 119.74 123.53 2qqi s LYS 407 Ca 0.03 -1.98 -0.31 0.00 0.02 0.00 0.00 55.97 53.73 2qqi s LYS 407 Cb -0.13 -2.97 -0.14 0.00 -0.52 0.00 0.00 37.83 34.08 2qqi s LYS 407 CO 0.01 -1.02 1.35 -2.30 -0.92 0.00 0.00 175.35 172.47 2qqi n PRO 408 N 3.95 1.85 -0.05 -1.68 -0.02 -1.26 -1.60 135.00 136.19 2qqi n PRO 408 Ca 0.04 0.66 -0.09 0.00 -2.02 0.00 0.00 63.50 62.09 2qqi n PRO 408 Cb 0.38 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.54 2qqi n PRO 408 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qqi n ALA 409 N 1.74 1.93 -2.44 3.55 0.00 0.21 -4.30 120.51 121.20 2qqi n ALA 409 Ca 0.12 -0.44 -0.08 0.00 0.00 0.00 0.00 53.44 53.04 2qqi n ALA 409 Cb 0.30 0.29 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 2qqi n ALA 409 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qqi s THR 410 N -2.21 0.17 0.21 0.00 -4.23 -0.90 -4.85 115.64 103.84 2qqi s THR 410 Ca -0.14 -1.41 -0.22 0.00 -1.18 0.00 0.00 61.69 58.74 2qqi s THR 410 Cb 0.04 -1.17 0.05 0.00 1.34 0.00 0.00 72.50 72.76 2qqi s THR 410 CO 0.23 -0.78 0.64 -1.66 -0.54 0.00 0.00 174.62 172.51 2qqi s TRP 411 N -3.25 -0.38 -0.16 3.99 -2.14 -1.26 -0.60 118.94 115.14 2qqi s TRP 411 Ca 0.01 0.06 -0.03 0.00 2.66 0.00 0.00 56.10 58.80 2qqi s TRP 411 Cb 0.03 0.61 -0.02 0.00 -3.10 0.00 0.00 33.47 30.99 2qqi s TRP 411 CO -0.08 -1.01 -0.06 -2.00 -2.66 0.00 0.00 176.95 171.14 2qqi s GLU 412 N -3.82 3.53 0.00 3.25 2.56 0.24 -4.73 118.70 119.73 2qqi s GLU 412 Ca 0.05 -0.59 0.00 0.00 0.00 0.00 0.00 54.97 54.44 2qqi s GLU 412 Cb -0.03 -2.86 0.00 0.00 2.00 0.00 0.00 34.13 33.24 2qqi s GLU 412 CO -0.05 0.13 0.00 2.41 -0.56 0.00 0.00 175.26 177.20 2qqi n THR 413 N 3.82 0.00 0.00 -1.70 -1.04 -1.26 -2.80 114.28 111.29 2qqi n THR 413 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 2qqi n THR 413 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 2qqi n THR 413 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qqi n GLY 414 N 0.00 0.66 3.67 3.41 0.00 -1.26 -5.08 105.19 106.60 2qqi n GLY 414 Ca 0.00 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 2qqi n GLY 414 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqi s ILE 415 N -2.00 4.68 -0.04 -0.61 1.01 -1.26 -3.52 121.20 119.45 2qqi s ILE 415 Ca 0.00 1.98 -0.05 0.00 0.00 0.00 0.00 60.65 62.58 2qqi s ILE 415 Cb 0.00 -4.28 0.01 0.00 0.01 0.00 0.00 42.46 38.20 2qqi s ILE 415 CO 0.00 -0.08 0.14 -0.55 0.00 0.00 0.00 174.94 174.45 2qqi s SER 416 N 1.21 -0.12 -0.00 3.58 0.15 -1.26 -4.44 113.70 112.82 2qqi s SER 416 Ca 0.47 0.20 -0.04 0.00 0.70 0.00 0.00 55.95 57.29 2qqi s SER 416 Cb -0.18 0.28 -0.00 0.00 -1.71 0.00 0.00 66.02 64.41 2qqi s SER 416 CO 0.13 -0.10 0.07 -0.04 1.20 0.00 0.00 173.24 174.50 2qqi s MET 417 N -0.17 0.35 0.04 5.44 -1.94 -0.44 -3.89 119.30 118.68 2qqi s MET 417 Ca -0.03 -0.35 0.05 0.00 -1.71 0.00 0.00 55.69 53.66 2qqi s MET 417 Cb -0.02 0.14 -0.02 0.00 2.01 0.00 0.00 34.83 36.94 2qqi s MET 417 CO 0.00 -0.07 -0.15 1.03 -0.01 0.00 0.00 175.02 175.82 2qqi s ARG 418 N -1.10 1.02 0.13 2.03 0.52 -0.40 -1.98 118.95 119.17 2qqi s ARG 418 Ca -0.12 -0.76 -0.15 0.00 -0.52 0.00 0.00 55.73 54.18 2qqi s ARG 418 Cb -0.07 -1.05 0.03 0.00 0.52 0.00 0.00 34.95 34.38 2qqi s ARG 418 CO 0.00 0.26 0.37 -0.59 0.02 0.00 0.00 175.30 175.37 2qqi s PHE 419 N -0.80 -0.10 0.08 -0.53 -0.71 0.21 -0.21 117.98 115.92 2qqi s PHE 419 Ca 0.03 -0.24 0.06 0.00 -1.04 0.00 0.00 56.93 55.74 2qqi s PHE 419 Cb -0.08 0.20 -0.03 0.00 -1.21 0.00 0.00 43.02 41.90 2qqi s PHE 419 CO 0.01 -0.70 -0.15 -2.00 -1.34 0.00 0.00 175.22 171.04 2qqi s GLU 420 N -3.83 0.89 -0.08 1.99 2.56 -0.10 -1.65 118.70 118.48 2qqi s GLU 420 Ca 0.05 -1.03 0.03 0.00 0.00 0.00 0.00 54.97 54.01 2qqi s GLU 420 Cb 0.02 -0.92 -0.02 0.00 2.00 0.00 0.00 34.13 35.22 2qqi s GLU 420 CO -0.10 0.20 -0.17 0.08 -0.56 0.00 0.00 175.26 174.71 2qqi s VAL 421 N -1.40 2.80 0.00 3.70 1.01 -1.26 -0.92 120.40 124.33 2qqi s VAL 421 Ca 0.01 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.26 2qqi s VAL 421 Cb -0.09 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 2qqi s VAL 421 CO 0.03 0.56 -0.18 -0.31 0.00 0.00 0.00 175.10 175.19 2qqi s TYR 422 N -0.17 2.56 -0.79 5.22 2.02 0.19 -0.37 117.35 126.02 2qqi s TYR 422 Ca -0.01 -0.26 0.00 0.00 -0.37 0.00 0.00 57.07 56.43 2qqi s TYR 422 Cb -0.13 -1.52 0.00 0.00 -0.40 0.00 0.00 41.96 39.91 2qqi s TYR 422 CO 0.03 0.18 0.00 0.41 -1.57 0.00 0.00 175.55 174.61 2qqi n GLY 423 N 1.93 -0.75 3.76 0.71 0.00 -0.20 -0.68 105.19 109.96 2qqi n GLY 423 Ca -0.16 -0.28 -0.03 0.00 0.00 0.00 0.00 46.02 45.55 2qqi n GLY 423 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqi s LYS 425 N -3.01 4.83 0.42 0.00 1.02 -1.26 -1.26 119.74 120.46 2qqi s LYS 425 Ca 0.14 1.48 0.12 0.00 0.02 0.00 0.00 55.97 57.73 2qqi s LYS 425 Cb -0.01 -3.30 0.96 0.00 -0.52 0.00 0.00 37.83 34.96 2qqi s LYS 425 CO 0.02 0.46 1.97 0.82 -0.92 0.00 0.00 175.35 177.71 2qqi h ILE 426 N 3.31 0.92 0.00 2.17 2.04 -1.92 0.48 117.51 124.52 2qqi h ILE 426 Ca -0.45 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2qqi h ILE 426 Cb 1.20 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 2qqi h ILE 426 CO 0.69 0.09 0.00 0.35 0.00 0.00 0.00 178.15 179.28 2qqi n THR 427 N -4.48 0.56 0.31 -0.27 -2.24 -1.26 -2.99 114.28 103.92 2qqi n THR 427 Ca 0.10 0.14 0.16 0.00 -2.27 0.00 0.00 64.05 62.18 2qqi n THR 427 Cb 0.34 -0.83 0.74 0.00 -2.10 0.00 0.00 70.33 68.48 2qqi n THR 427 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2qqi h ASP 428 N 0.00 0.00 -3.61 3.42 3.32 -1.24 -3.43 116.42 114.88 2qqi h ASP 428 Ca 0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 2qqi h ASP 428 Cb 0.23 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2qqi h ASP 428 CO 0.00 0.00 0.04 -0.31 -1.72 0.00 0.00 179.24 177.25 2qqi s TYR 429 N -3.67 3.42 0.37 4.55 2.02 -1.16 -5.02 117.35 117.87 2qqi s TYR 429 Ca 0.00 1.04 -0.28 0.00 -0.37 0.00 0.00 57.07 57.46 2qqi s TYR 429 Cb 0.10 -2.41 -0.11 0.00 -0.40 0.00 0.00 41.96 39.14 2qqi s TYR 429 CO 0.42 0.07 1.45 -2.14 -1.57 0.00 0.00 175.55 173.78 2qqi s PRO 430 N -3.30 4.13 -1.16 -1.71 0.02 -1.26 -3.56 135.00 128.16 2qqi s PRO 430 Ca 0.51 2.50 -0.25 0.00 0.02 0.00 0.00 61.00 63.77 2qqi s PRO 430 Cb -0.10 -2.97 0.01 0.00 0.02 0.00 0.00 34.50 31.46 2qqi s PRO 430 CO 0.24 -0.49 0.76 0.00 -0.33 0.00 0.00 177.00 177.18 2qqi n SER 432 N -2.49 1.01 -4.78 0.00 7.64 -1.23 -3.94 113.62 109.83 2qqi n SER 432 Ca -0.10 -2.00 -0.34 0.00 1.01 0.00 0.00 58.87 57.44 2qqi n SER 432 Cb 0.58 -0.30 -0.01 0.00 -1.01 0.00 0.00 64.21 63.47 2qqi n SER 432 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2qqi s GLY 433 N -2.18 2.50 -0.08 0.23 0.00 -0.37 -4.07 107.32 103.36 2qqi s GLY 433 Ca 0.32 0.68 -0.30 0.00 0.00 0.00 0.00 44.72 45.43 2qqi s GLY 433 CO -0.15 1.02 1.09 1.06 0.00 0.00 0.00 173.10 176.12 2qqi s MET 434 N -3.41 4.40 0.11 2.90 -1.94 -1.26 -1.05 119.30 119.04 2qqi s MET 434 Ca 0.69 1.52 0.27 0.00 -1.71 0.00 0.00 55.69 56.46 2qqi s MET 434 Cb -0.20 -3.54 0.95 0.00 2.01 0.00 0.00 34.83 34.04 2qqi s MET 434 CO 0.27 -0.36 1.80 1.28 -0.01 0.00 0.00 175.02 177.99 2qqi n LEU 435 N 5.04 0.46 0.00 -0.03 4.77 -0.11 -4.87 117.00 122.26 2qqi n LEU 435 Ca 0.10 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 2qqi n LEU 435 Cb 0.48 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2qqi n LEU 435 CO 0.53 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 2qqi n GLY 436 N 1.40 -0.99 0.27 -0.72 0.00 -1.26 -4.30 105.19 99.59 2qqi n GLY 436 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 2qqi n GLY 436 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qqi h MET 437 N 0.00 0.94 -0.00 1.61 2.86 -1.85 -0.50 114.93 117.98 2qqi h MET 437 Ca 0.00 -0.42 -0.00 0.00 -2.06 0.00 0.00 59.70 57.21 2qqi h MET 437 Cb 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2qqi h MET 437 CO 0.00 1.09 -0.01 0.28 1.06 0.00 0.00 176.91 179.32 2qqi h VAL 438 N 0.77 1.48 0.00 -2.22 2.07 -1.84 -3.35 116.25 113.16 2qqi h VAL 438 Ca 0.09 -1.44 -0.08 0.00 0.82 0.00 0.00 66.70 66.09 2qqi h VAL 438 Cb 0.82 2.45 -0.01 0.00 -1.52 0.00 0.00 31.29 33.03 2qqi h VAL 438 CO 0.07 0.38 -0.40 0.77 0.02 0.00 0.00 177.57 178.41 2qqi h SER 439 N -0.59 0.00 0.00 0.57 4.64 -1.93 -3.47 113.55 112.78 2qqi h SER 439 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qqi h SER 439 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2qqi h SER 439 CO 0.00 0.40 0.00 0.61 -0.87 0.00 0.00 176.83 176.97 2qqi n GLY 440 N 0.38 0.64 0.23 -0.77 0.00 -0.25 -4.94 105.19 100.49 2qqi n GLY 440 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.18 2qqi n GLY 440 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qqi h LEU 441 N 0.00 0.00 -8.53 0.99 3.38 -1.80 -3.22 115.31 106.12 2qqi h LEU 441 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 2qqi h LEU 441 Cb 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.58 2qqi h LEU 441 CO 0.00 0.00 -0.05 -0.63 0.09 0.00 0.00 178.44 177.85 2qqi s ILE 442 N -3.56 4.96 0.71 1.22 1.01 -0.89 -4.91 121.20 119.73 2qqi s ILE 442 Ca 0.02 -0.20 -0.11 0.00 0.00 0.00 0.00 60.65 60.36 2qqi s ILE 442 Cb 0.09 -4.14 0.01 0.00 0.01 0.00 0.00 42.46 38.43 2qqi s ILE 442 CO 0.49 -0.55 1.07 -0.94 0.00 0.00 0.00 174.94 175.01 2qqi s SER 443 N 2.01 5.35 0.28 3.58 1.04 -1.22 -4.69 113.70 120.05 2qqi s SER 443 Ca 0.16 1.41 0.02 0.00 0.48 0.00 0.00 55.95 58.03 2qqi s SER 443 Cb -0.16 -2.28 0.68 0.00 0.10 0.00 0.00 66.02 64.36 2qqi s SER 443 CO 0.15 -1.44 1.68 0.44 0.98 0.00 0.00 173.24 175.06 2qqi h ASP 444 N -0.72 0.20 0.29 7.02 5.19 -1.92 -1.02 116.42 125.46 2qqi h ASP 444 Ca -0.45 0.16 -0.01 0.00 -0.62 0.00 0.00 57.03 56.11 2qqi h ASP 444 Cb 1.23 0.18 -0.00 0.00 0.18 0.00 0.00 39.33 40.91 2qqi h ASP 444 CO 0.60 -0.05 -0.06 0.77 -3.12 0.00 0.00 179.24 177.37 2qqi h SER 445 N 0.33 0.00 0.30 6.45 4.64 -2.01 -1.28 113.55 121.98 2qqi h SER 445 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2qqi h SER 445 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2qqi h SER 445 CO -0.56 0.06 -0.10 0.00 -0.87 0.00 0.00 176.83 175.36 2qqi n GLN 446 N -3.53 0.79 -3.88 4.77 6.02 -0.39 -4.70 117.38 116.45 2qqi n GLN 446 Ca -0.02 -0.29 -0.35 0.00 -0.01 0.00 0.00 57.00 56.33 2qqi n GLN 446 Cb 0.18 -1.49 -0.14 0.00 1.02 0.00 0.00 30.24 29.81 2qqi n GLN 446 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2qqi s ILE 447 N -2.41 3.31 0.30 5.09 1.01 -0.48 -1.16 121.20 126.86 2qqi s ILE 447 Ca 0.31 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 60.13 2qqi s ILE 447 Cb 0.20 -2.68 -0.06 0.00 0.01 0.00 0.00 42.46 39.94 2qqi s ILE 447 CO 0.46 0.18 0.08 0.42 0.00 0.00 0.00 174.94 176.08 2qqi s THR 448 N 1.40 0.89 0.22 2.92 -4.23 -0.54 -4.87 115.64 111.44 2qqi s THR 448 Ca 0.02 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.42 2qqi s THR 448 Cb -0.17 -2.72 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 2qqi s THR 448 CO -0.02 0.00 0.38 -0.94 -0.54 0.00 0.00 174.62 173.50 2qqi s SER 449 N -3.41 -0.03 0.15 3.99 1.04 -1.26 -0.31 113.70 113.87 2qqi s SER 449 Ca 0.37 -0.99 0.18 0.00 0.48 0.00 0.00 55.95 56.00 2qqi s SER 449 Cb 0.08 0.52 0.80 0.00 0.10 0.00 0.00 66.02 67.52 2qqi s SER 449 CO 0.15 -1.04 1.57 -1.54 0.98 0.00 0.00 173.24 173.35 2qqi n SER 450 N -0.33 0.37 -2.72 7.02 3.41 -0.30 -3.23 113.62 117.83 2qqi n SER 450 Ca -0.02 0.60 -0.18 0.00 -0.26 0.00 0.00 58.87 59.01 2qqi n SER 450 Cb 0.63 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 2qqi n SER 450 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2qqi n ASN 451 N -1.92 2.75 -0.08 4.04 5.15 -1.26 -4.92 115.26 119.03 2qqi n ASN 451 Ca 0.02 -3.20 0.13 0.00 -0.60 0.00 0.00 54.58 50.94 2qqi n ASN 451 Cb 0.18 -0.53 0.50 0.00 -0.53 0.00 0.00 39.78 39.40 2qqi n ASN 451 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qqi n GLN 452 N -0.16 0.39 0.00 1.20 10.64 -1.20 -3.07 117.38 125.18 2qqi n GLN 452 Ca 0.24 -0.15 0.15 0.00 -1.83 0.00 0.00 57.00 55.41 2qqi n GLN 452 Cb 0.69 -1.50 0.80 0.00 -0.86 0.00 0.00 30.24 29.38 2qqi n GLN 452 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2qqi n GLY 453 N 1.39 -0.67 3.78 2.61 0.00 -1.26 -4.79 105.19 106.25 2qqi n GLY 453 Ca 0.10 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 2qqi n GLY 453 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qqi s ASP 454 N -2.01 6.94 0.29 1.61 -1.08 -1.17 -4.95 116.67 116.30 2qqi s ASP 454 Ca 0.44 2.03 0.03 0.00 -0.52 0.00 0.00 52.55 54.53 2qqi s ASP 454 Cb 0.22 -2.59 0.68 0.00 -1.46 0.00 0.00 42.92 39.77 2qqi s ASP 454 CO 0.36 -0.36 1.73 0.03 0.52 0.00 0.00 175.17 177.45 2qqi h ARG 455 N 2.81 0.50 -0.11 4.34 3.08 -1.92 -1.93 114.38 121.15 2qqi h ARG 455 Ca -0.48 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.54 2qqi h ARG 455 Cb 1.21 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2qqi h ARG 455 CO 0.63 0.33 0.00 0.09 -1.07 0.00 0.00 179.97 179.96 2qqi n ASN 456 N -4.95 1.36 -4.70 7.04 3.02 -1.26 -4.86 115.26 110.90 2qqi n ASN 456 Ca 0.21 -1.60 -0.42 0.00 -0.03 0.00 0.00 54.58 52.74 2qqi n ASN 456 Cb 0.59 -0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.66 2qqi n ASN 456 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2qqi s TRP 457 N -1.87 3.06 -0.27 3.10 -0.11 -0.73 -4.68 118.94 117.44 2qqi s TRP 457 Ca 0.34 0.90 -0.04 0.00 1.22 0.00 0.00 56.10 58.51 2qqi s TRP 457 Cb 0.18 -3.66 0.15 0.00 -1.50 0.00 0.00 33.47 28.63 2qqi s TRP 457 CO 0.28 -2.38 0.54 1.41 -4.62 0.00 0.00 176.95 172.17 2qqi s MET 458 N 1.72 0.49 0.51 5.86 1.75 -1.26 -5.01 119.30 123.36 2qqi s MET 458 Ca 0.64 1.03 0.20 0.00 -1.25 0.00 0.00 55.69 56.31 2qqi s MET 458 Cb -0.34 0.39 1.30 0.00 2.84 0.00 0.00 34.83 39.01 2qqi s MET 458 CO 0.29 -0.46 2.04 -1.35 -0.65 0.00 0.00 175.02 174.89 2qqi h PRO 459 N 8.07 0.06 -1.01 4.11 0.11 -1.91 -0.06 132.00 141.37 2qqi h PRO 459 Ca -0.20 -0.00 0.24 0.00 0.11 0.00 0.00 66.00 66.15 2qqi h PRO 459 Cb 1.14 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.12 2qqi h PRO 459 CO 0.20 0.04 0.61 1.49 -0.21 0.00 0.00 178.00 180.14 2qqi h GLU 460 N 0.07 0.57 -0.16 1.05 4.57 -1.97 -0.60 114.58 118.11 2qqi h GLU 460 Ca 0.17 -0.03 0.05 0.00 -1.18 0.00 0.00 59.36 58.36 2qqi h GLU 460 Cb 0.61 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 2qqi h GLU 460 CO -0.01 0.37 0.21 -0.91 -1.18 0.00 0.00 179.01 177.49 2qqi h ASN 461 N 0.58 0.00 0.16 1.04 2.35 -1.31 -2.21 115.58 116.20 2qqi h ASN 461 Ca 0.62 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.37 2qqi h ASN 461 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 2qqi h ASN 461 CO -0.42 0.00 -0.59 -0.38 -1.65 0.00 0.00 177.43 174.39 2qqi n ILE 462 N -3.62 0.00 -2.70 2.81 5.41 -0.23 -4.61 119.36 116.42 2qqi n ILE 462 Ca 0.01 -0.10 -0.42 0.00 1.00 0.00 0.00 62.75 63.24 2qqi n ILE 462 Cb 0.32 0.76 -0.03 0.00 -0.71 0.00 0.00 39.64 39.99 2qqi n ILE 462 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2qqi s ARG 463 N -2.75 4.43 0.16 0.38 0.52 -0.83 -0.31 118.95 120.55 2qqi s ARG 463 Ca 0.15 1.38 -0.32 0.00 -0.52 0.00 0.00 55.73 56.42 2qqi s ARG 463 Cb 0.18 -3.54 -0.17 0.00 0.52 0.00 0.00 34.95 31.94 2qqi s ARG 463 CO 0.68 -0.29 0.83 -0.11 0.02 0.00 0.00 175.30 176.43 2qqi n LEU 464 N 4.91 -0.06 -1.91 2.53 7.94 -0.65 -1.06 117.00 128.70 2qqi n LEU 464 Ca 0.08 1.14 -0.14 0.00 -1.11 0.00 0.00 56.01 55.98 2qqi n LEU 464 Cb 0.49 -1.03 -0.04 0.00 0.53 0.00 0.00 43.42 43.37 2qqi n LEU 464 CO 0.52 -2.22 -0.16 1.33 -1.11 0.00 0.00 177.39 175.75 2qqi n VAL 465 N 0.68 -0.33 -1.96 1.96 0.24 -1.26 -4.66 118.33 112.99 2qqi n VAL 465 Ca 0.17 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 62.11 2qqi n VAL 465 Cb 0.22 -1.71 0.04 0.00 -1.47 0.00 0.00 33.84 30.92 2qqi n VAL 465 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2qqi s THR 466 N -2.46 2.51 -1.70 3.34 -1.32 -0.23 -4.92 115.64 110.86 2qqi s THR 466 Ca 0.00 0.32 0.26 0.00 -1.21 0.00 0.00 61.69 61.06 2qqi s THR 466 Cb 0.00 -3.13 0.21 0.00 -1.51 0.00 0.00 72.50 68.07 2qqi s THR 466 CO 0.00 -0.07 1.50 -1.54 -2.21 0.00 0.00 174.62 172.30 2qqi n SER 467 N -1.65 1.07 -4.73 8.08 3.41 -1.26 -4.92 113.62 113.63 2qqi n SER 467 Ca 0.14 -0.90 -0.41 0.00 -0.26 0.00 0.00 58.87 57.45 2qqi n SER 467 Cb 0.49 0.19 -0.05 0.00 -0.26 0.00 0.00 64.21 64.59 2qqi n SER 467 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2qqi s ARG 468 N -2.55 4.63 -0.16 4.33 3.52 -1.26 -5.04 118.95 122.41 2qqi s ARG 468 Ca 0.22 1.32 -0.08 0.00 -0.13 0.00 0.00 55.73 57.06 2qqi s ARG 468 Cb 0.19 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 30.16 2qqi s ARG 468 CO 0.55 0.22 0.12 0.45 -0.81 0.00 0.00 175.30 175.83 2qqi s SER 469 N 0.03 6.19 0.00 -2.12 0.15 -1.26 -4.79 113.70 111.90 2qqi s SER 469 Ca 0.44 0.31 0.00 0.00 0.70 0.00 0.00 55.95 57.40 2qqi s SER 469 Cb -0.22 -2.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.04 2qqi s SER 469 CO 0.27 0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.60 2qqi n GLY 470 N 2.89 2.66 3.76 9.45 0.00 -1.26 -5.05 105.19 117.64 2qqi n GLY 470 Ca -0.18 -1.06 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 2qqi n GLY 470 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qqi s TRP 471 N -2.00 2.50 0.01 1.61 0.23 -1.26 -4.84 118.94 115.19 2qqi s TRP 471 Ca 0.00 1.34 -0.18 0.00 -2.03 0.00 0.00 56.10 55.23 2qqi s TRP 471 Cb 0.00 -3.80 -0.31 0.00 0.03 0.00 0.00 33.47 29.39 2qqi s TRP 471 CO 0.00 -2.66 1.00 0.00 0.96 0.00 0.00 176.95 176.25 2qqi h ALA 472 N 2.10 -0.07 -3.34 0.98 0.00 -0.62 -3.43 119.26 114.88 2qqi h ALA 472 Ca -0.51 -0.74 -0.56 0.00 0.00 0.00 0.00 54.91 53.10 2qqi h ALA 472 Cb 1.27 0.12 -0.39 0.00 0.00 0.00 0.00 17.79 18.78 2qqi h ALA 472 CO 0.60 0.53 -0.77 -1.17 0.00 0.00 0.00 179.25 178.45 2qqi s LEU 473 N -7.86 1.95 0.70 0.00 2.96 -1.04 -4.86 118.68 110.53 2qqi s LEU 473 Ca -0.11 -1.19 -0.16 0.00 -0.22 0.00 0.00 54.13 52.45 2qqi s LEU 473 Cb 0.03 -0.86 0.02 0.00 0.50 0.00 0.00 46.19 45.89 2qqi s LEU 473 CO 0.89 -0.32 1.23 -2.84 -1.32 0.00 0.00 176.35 173.99 2qqi s PRO 474 N 1.64 2.29 0.43 0.98 0.02 -1.26 -1.00 135.00 138.10 2qqi s PRO 474 Ca 0.01 1.85 -0.24 0.00 0.02 0.00 0.00 61.00 62.64 2qqi s PRO 474 Cb -0.18 -1.84 -0.08 0.00 0.02 0.00 0.00 34.50 32.42 2qqi s PRO 474 CO -0.13 -1.74 1.14 -1.25 -0.33 0.00 0.00 177.00 174.69 2qqi s PRO 475 N -3.73 3.95 -0.45 5.54 0.04 -1.26 -4.81 135.00 134.28 2qqi s PRO 475 Ca 0.77 1.74 0.06 0.00 0.04 0.00 0.00 61.00 63.60 2qqi s PRO 475 Cb -0.31 -2.53 0.21 0.00 0.04 0.00 0.00 34.50 31.90 2qqi s PRO 475 CO 0.43 -0.38 0.46 0.00 0.04 0.00 0.00 177.00 177.55 2qqi n ALA 476 N -0.20 2.86 0.29 8.56 0.00 -1.26 -4.98 120.51 125.79 2qqi n ALA 476 Ca 0.06 -3.51 0.17 0.00 0.00 0.00 0.00 53.44 50.16 2qqi n ALA 476 Cb 0.48 -0.81 0.89 0.00 0.00 0.00 0.00 19.45 20.00 2qqi n ALA 476 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2qqi h PRO 477 N 4.85 0.00 -0.02 0.00 0.13 -1.98 -0.95 132.00 134.03 2qqi h PRO 477 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2qqi h PRO 477 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2qqi h PRO 477 CO 0.48 0.05 -0.01 0.72 -0.23 0.00 0.00 178.00 179.01 2qqi n HIS 478 N -3.44 0.00 -2.44 1.56 8.25 -1.26 -4.97 115.22 112.93 2qqi n HIS 478 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.11 2qqi n HIS 478 Cb 0.18 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.25 2qqi n HIS 478 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2qqi s SER 479 N -2.02 6.50 -0.29 0.41 0.15 -0.36 -4.99 113.70 113.09 2qqi s SER 479 Ca 0.36 1.68 0.08 0.00 0.70 0.00 0.00 55.95 58.78 2qqi s SER 479 Cb 0.21 -2.53 0.46 0.00 -1.71 0.00 0.00 66.02 62.45 2qqi s SER 479 CO 0.34 -0.67 1.33 -1.22 1.20 0.00 0.00 173.24 174.22 2qqi n TYR 480 N -1.40 1.54 -4.06 3.44 4.02 -1.26 -5.02 117.16 114.42 2qqi n TYR 480 Ca 0.07 -1.91 -0.12 0.00 -0.01 0.00 0.00 57.90 55.94 2qqi n TYR 480 Cb 0.54 -0.43 -0.11 0.00 -0.02 0.00 0.00 39.34 39.31 2qqi n TYR 480 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 2qqi s ILE 481 N -3.87 0.46 0.33 -0.72 -4.36 -1.26 -5.13 121.20 106.65 2qqi s ILE 481 Ca 0.47 -1.19 -0.29 0.00 -0.26 0.00 0.00 60.65 59.38 2qqi s ILE 481 Cb 0.40 -0.72 -0.11 0.00 1.25 0.00 0.00 42.46 43.29 2qqi s ILE 481 CO -0.01 -0.50 1.43 0.20 0.24 0.00 0.00 174.94 176.30 2qqi s ASN 482 N -1.81 6.55 0.28 4.36 0.01 -1.26 -4.97 114.94 118.11 2qqi s ASN 482 Ca -0.08 2.85 -0.29 0.00 -0.71 0.00 0.00 52.86 54.63 2qqi s ASN 482 Cb -0.07 -2.65 -0.10 0.00 0.41 0.00 0.00 41.25 38.84 2qqi s ASN 482 CO -0.01 -0.73 1.20 -1.61 -1.51 0.00 0.00 177.10 174.44 2qqi s GLU 483 N -1.52 4.50 0.05 -0.60 2.02 -1.26 -4.90 118.70 116.99 2qqi s GLU 483 Ca 0.54 1.98 -0.24 0.00 0.02 0.00 0.00 54.97 57.27 2qqi s GLU 483 Cb -0.43 -3.15 0.06 0.00 0.10 0.00 0.00 34.13 30.70 2qqi s GLU 483 CO 0.54 -0.00 0.56 1.67 0.02 0.00 0.00 175.26 178.06 2qqi s TRP 484 N -0.93 -0.49 -0.05 1.61 1.48 -1.26 -4.15 118.94 115.15 2qqi s TRP 484 Ca 0.48 0.57 -0.00 0.00 -1.06 0.00 0.00 56.10 56.08 2qqi s TRP 484 Cb -0.35 0.40 -0.03 0.00 -1.16 0.00 0.00 33.47 32.32 2qqi s TRP 484 CO 0.45 -0.68 -0.01 -0.51 -4.06 0.00 0.00 176.95 172.14 2qqi s LEU 485 N -1.98 3.48 -0.03 -4.66 1.43 -0.44 -1.15 118.68 115.34 2qqi s LEU 485 Ca -0.05 0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.16 2qqi s LEU 485 Cb -0.01 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 2qqi s LEU 485 CO -0.02 0.34 -0.20 -1.58 0.23 0.00 0.00 176.35 175.12 2qqi s GLN 486 N -1.13 1.78 -0.15 1.70 0.74 0.58 -0.93 119.66 122.25 2qqi s GLN 486 Ca 0.16 -0.72 0.02 0.00 0.05 0.00 0.00 55.36 54.86 2qqi s GLN 486 Cb -0.11 -1.65 0.01 0.00 1.10 0.00 0.00 33.01 32.35 2qqi s GLN 486 CO 0.05 0.39 -0.20 0.42 -0.55 0.00 0.00 175.29 175.40 2qqi s ILE 487 N -0.33 2.16 -0.36 -2.34 -1.09 0.24 -1.46 121.20 118.01 2qqi s ILE 487 Ca 0.04 -0.94 -0.15 0.00 -2.23 0.00 0.00 60.65 57.38 2qqi s ILE 487 Cb -0.09 -1.88 -0.00 0.00 -1.58 0.00 0.00 42.46 38.90 2qqi s ILE 487 CO 0.00 0.54 0.32 -0.62 -1.23 0.00 0.00 174.94 173.95 2qqi s ASP 488 N 0.94 6.13 0.00 3.58 2.15 -0.31 -0.96 116.67 128.20 2qqi s ASP 488 Ca -0.04 -0.48 0.30 0.00 0.43 0.00 0.00 52.55 52.76 2qqi s ASP 488 Cb -0.15 -2.17 1.41 0.00 -0.30 0.00 0.00 42.92 41.71 2qqi s ASP 488 CO -0.04 -0.36 2.00 0.18 -0.17 0.00 0.00 175.17 176.78 2qqi n LEU 489 N 5.27 0.01 0.00 -1.34 4.77 -0.05 -4.83 117.00 120.84 2qqi n LEU 489 Ca -0.10 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 2qqi n LEU 489 Cb 0.49 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2qqi n LEU 489 CO 0.40 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2qqi n GLY 490 N 1.36 2.66 3.39 -0.72 0.00 -1.26 -4.90 105.19 105.72 2qqi n GLY 490 Ca 0.12 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 2qqi n GLY 490 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2qqi s GLU 491 N 0.00 1.21 0.01 1.61 -1.05 -1.26 -5.11 118.70 114.12 2qqi s GLU 491 Ca 0.00 -1.08 -0.30 0.00 -0.15 0.00 0.00 54.97 53.44 2qqi s GLU 491 Cb 0.00 0.42 -0.06 0.00 -0.44 0.00 0.00 34.13 34.05 2qqi s GLU 491 CO 0.00 -0.47 1.49 -2.00 0.95 0.00 0.00 175.26 175.23 2qqi s GLU 492 N -3.94 4.25 0.21 -4.83 2.12 -1.26 -4.33 118.70 110.93 2qqi s GLU 492 Ca 0.14 2.08 0.03 0.00 0.36 0.00 0.00 54.97 57.58 2qqi s GLU 492 Cb 0.02 -3.61 -0.05 0.00 0.26 0.00 0.00 34.13 30.75 2qqi s GLU 492 CO -0.01 -0.64 0.01 0.15 -0.54 0.00 0.00 175.26 174.23 2qqi s LYS 493 N 2.58 1.27 0.02 4.30 1.02 -0.29 -4.45 119.74 124.19 2qqi s LYS 493 Ca 0.67 -1.64 -0.23 0.00 0.02 0.00 0.00 55.97 54.79 2qqi s LYS 493 Cb -0.34 -0.43 -0.05 0.00 -0.52 0.00 0.00 37.83 36.48 2qqi s LYS 493 CO 0.28 -0.14 0.69 0.42 -0.92 0.00 0.00 175.35 175.68 2qqi s ILE 494 N -3.56 4.82 -0.06 2.17 -1.09 -0.10 -0.68 121.20 122.71 2qqi s ILE 494 Ca 0.28 1.45 0.01 0.00 -2.23 0.00 0.00 60.65 60.16 2qqi s ILE 494 Cb 0.06 -4.03 0.02 0.00 -1.58 0.00 0.00 42.46 36.93 2qqi s ILE 494 CO 0.08 0.38 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.42 2qqi s VAL 495 N -0.08 0.76 -0.00 2.92 1.01 0.21 -1.31 120.40 123.91 2qqi s VAL 495 Ca 0.35 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2qqi s VAL 495 Cb -0.19 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.42 2qqi s VAL 495 CO 0.20 0.29 0.61 -2.11 0.00 0.00 0.00 175.10 174.09 2qqi n ARG 496 N 4.28 0.51 -3.64 2.72 1.85 -0.20 -0.85 116.66 121.33 2qqi n ARG 496 Ca -0.20 -0.71 -0.03 0.00 -1.00 0.00 0.00 57.85 55.91 2qqi n ARG 496 Cb 0.51 -0.59 -0.01 0.00 -1.05 0.00 0.00 32.46 31.31 2qqi n ARG 496 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2qqi s GLY 497 N -0.24 -0.34 -0.03 2.89 0.00 -1.18 -3.09 107.32 105.32 2qqi s GLY 497 Ca 0.00 0.71 0.02 0.00 0.00 0.00 0.00 44.72 45.46 2qqi s GLY 497 CO 0.00 0.19 -0.08 -1.50 0.00 0.00 0.00 173.10 171.71 2qqi s ILE 498 N -2.82 0.71 -0.25 0.90 2.07 0.06 -0.77 121.20 121.10 2qqi s ILE 498 Ca 0.11 -0.29 -0.10 0.00 -1.41 0.00 0.00 60.65 58.96 2qqi s ILE 498 Cb 0.01 -0.65 -0.05 0.00 0.13 0.00 0.00 42.46 41.90 2qqi s ILE 498 CO -0.03 0.24 0.14 -0.63 -1.91 0.00 0.00 174.94 172.75 2qqi s ILE 499 N 0.38 5.09 0.07 2.00 1.01 0.74 -0.29 121.20 130.22 2qqi s ILE 499 Ca -0.06 0.09 0.07 0.00 0.00 0.00 0.00 60.65 60.75 2qqi s ILE 499 Cb -0.10 -3.38 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 2qqi s ILE 499 CO 0.01 0.33 -0.14 0.27 0.00 0.00 0.00 174.94 175.41 2qqi s ILE 500 N 1.26 3.12 0.02 2.92 -4.36 -0.01 -1.33 121.20 122.81 2qqi s ILE 500 Ca 0.07 -1.21 0.02 0.00 -0.26 0.00 0.00 60.65 59.26 2qqi s ILE 500 Cb -0.14 -2.39 -0.01 0.00 1.25 0.00 0.00 42.46 41.16 2qqi s ILE 500 CO 0.06 0.23 -0.06 -1.58 0.24 0.00 0.00 174.94 173.83 2qqi s GLN 501 N -1.82 0.41 0.91 0.37 0.74 0.78 -0.35 119.66 120.70 2qqi s GLN 501 Ca 0.18 -0.44 -0.11 0.00 0.05 0.00 0.00 55.36 55.03 2qqi s GLN 501 Cb -0.11 -0.27 0.14 0.00 1.10 0.00 0.00 33.01 33.87 2qqi s GLN 501 CO 0.09 0.06 1.09 0.20 -0.55 0.00 0.00 175.29 176.18 2qqi s GLY 502 N -0.84 1.63 0.66 2.59 0.00 -1.26 -0.64 107.32 109.46 2qqi s GLY 502 Ca -0.05 0.07 -0.16 0.00 0.00 0.00 0.00 44.72 44.58 2qqi s GLY 502 CO -0.00 0.55 1.17 -0.32 0.00 0.00 0.00 173.10 174.50 2qqi s GLY 503 N -3.22 2.40 0.51 0.20 0.00 -1.22 -4.26 107.32 101.73 2qqi s GLY 503 Ca 0.64 0.80 -0.22 0.00 0.00 0.00 0.00 44.72 45.94 2qqi s GLY 503 CO 0.58 1.18 1.25 0.54 0.00 0.00 0.00 173.10 176.64 2qqi s LYS 504 N -3.78 3.44 -0.08 2.90 1.02 -1.26 -4.94 119.74 117.03 2qqi s LYS 504 Ca 0.73 1.96 -0.06 0.00 0.02 0.00 0.00 55.97 58.61 2qqi s LYS 504 Cb -0.26 -2.30 0.03 0.00 -0.52 0.00 0.00 37.83 34.78 2qqi s LYS 504 CO 0.40 -0.87 0.21 -1.58 -0.92 0.00 0.00 175.35 172.59 2qqi s HIS 505 N -1.46 -0.24 0.39 3.18 2.46 -1.26 -4.71 115.29 113.65 2qqi s HIS 505 Ca 0.68 0.60 0.12 0.00 0.47 0.00 0.00 55.06 56.92 2qqi s HIS 505 Cb -0.33 0.06 0.78 0.00 -0.13 0.00 0.00 32.58 32.95 2qqi s HIS 505 CO 0.40 -0.14 1.88 -0.09 -2.47 0.00 0.00 174.74 174.31 2qqi h ARG 506 N 6.27 0.09 -0.57 2.88 2.43 -1.95 -1.80 114.38 121.72 2qqi h ARG 506 Ca -0.31 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 2qqi h ARG 506 Cb 1.18 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2qqi h ARG 506 CO 0.38 0.35 0.00 0.39 -1.51 0.00 0.00 179.97 179.58 2qqi n GLU 507 N -4.20 3.38 -2.02 0.20 -0.58 -1.26 -4.95 120.64 111.21 2qqi n GLU 507 Ca -0.02 -2.72 -0.21 0.00 -0.42 0.00 0.00 57.16 53.80 2qqi n GLU 507 Cb 0.33 -1.74 -0.05 0.00 -0.57 0.00 0.00 31.44 29.42 2qqi n GLU 507 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2qqi n ASN 508 N 0.94 -5.70 -4.79 1.62 5.03 -0.68 -4.97 115.26 106.72 2qqi n ASN 508 Ca 0.23 0.23 -0.34 0.00 0.87 0.00 0.00 54.58 55.57 2qqi n ASN 508 Cb 0.78 -4.85 -0.03 0.00 -1.02 0.00 0.00 39.78 34.66 2qqi n ASN 508 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2qqi s LYS 509 N -4.43 3.72 -0.15 3.52 1.02 -1.26 -4.73 119.74 117.43 2qqi s LYS 509 Ca 0.00 1.43 0.02 0.00 0.02 0.00 0.00 55.97 57.43 2qqi s LYS 509 Cb 0.00 -2.10 0.01 0.00 -0.52 0.00 0.00 37.83 35.23 2qqi s LYS 509 CO 0.00 -0.51 -0.20 0.08 -0.92 0.00 0.00 175.35 173.80 2qqi s VAL 510 N -1.92 2.18 -0.16 3.17 1.01 -1.26 -4.78 120.40 118.64 2qqi s VAL 510 Ca 0.68 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.74 2qqi s VAL 510 Cb -0.18 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.33 2qqi s VAL 510 CO 0.22 0.54 -0.17 -0.36 0.00 0.00 0.00 175.10 175.33 2qqi s PHE 511 N 0.95 2.47 -0.15 5.22 0.08 -1.26 -5.10 117.98 120.18 2qqi s PHE 511 Ca -0.04 -1.44 -0.19 0.00 0.12 0.00 0.00 56.93 55.39 2qqi s PHE 511 Cb -0.15 -1.75 -0.04 0.00 -0.57 0.00 0.00 43.02 40.51 2qqi s PHE 511 CO -0.04 -0.74 0.51 -1.64 -0.10 0.00 0.00 175.22 173.20 2qqi s MET 512 N 1.39 4.28 -0.05 0.44 -1.94 -1.26 -4.84 119.30 117.31 2qqi s MET 512 Ca 0.05 0.46 -0.01 0.00 -1.71 0.00 0.00 55.69 54.47 2qqi s MET 512 Cb -0.13 -3.49 0.03 0.00 2.01 0.00 0.00 34.83 33.25 2qqi s MET 512 CO -0.12 0.02 0.02 0.50 -0.01 0.00 0.00 175.02 175.43 2qqi s ARG 513 N 1.08 0.32 0.68 2.03 3.52 -1.26 -4.98 118.95 120.35 2qqi s ARG 513 Ca 0.26 0.19 -0.13 0.00 -0.13 0.00 0.00 55.73 55.91 2qqi s ARG 513 Cb -0.15 -0.72 0.01 0.00 -1.56 0.00 0.00 34.95 32.53 2qqi s ARG 513 CO 0.10 -0.27 1.08 0.15 -0.81 0.00 0.00 175.30 175.55 2qqi s LYS 514 N 1.82 2.84 0.06 5.12 1.02 -1.26 -3.43 119.74 125.91 2qqi s LYS 514 Ca 0.02 1.17 -0.08 0.00 0.02 0.00 0.00 55.97 57.09 2qqi s LYS 514 Cb -0.12 -1.97 -0.00 0.00 -0.52 0.00 0.00 37.83 35.21 2qqi s LYS 514 CO -0.04 -1.19 0.18 -0.59 -0.92 0.00 0.00 175.35 172.79 2qqi s PHE 515 N -2.70 0.13 0.32 3.18 -0.12 -0.75 -0.83 117.98 117.21 2qqi s PHE 515 Ca 0.62 -0.47 0.08 0.00 -0.05 0.00 0.00 56.93 57.12 2qqi s PHE 515 Cb -0.17 -0.07 -0.04 0.00 -0.63 0.00 0.00 43.02 42.12 2qqi s PHE 515 CO 0.47 -0.47 0.13 0.15 -0.05 0.00 0.00 175.22 175.45 2qqi s LYS 516 N -3.21 2.43 -0.13 1.99 1.02 -0.22 0.09 119.74 121.71 2qqi s LYS 516 Ca -0.00 -1.46 0.01 0.00 0.02 0.00 0.00 55.97 54.54 2qqi s LYS 516 Cb 0.02 -2.23 0.02 0.00 -0.52 0.00 0.00 37.83 35.12 2qqi s LYS 516 CO -0.07 0.18 -0.14 0.42 -0.92 0.00 0.00 175.35 174.81 2qqi s ILE 517 N -2.37 1.53 0.28 2.17 1.01 -1.26 -0.97 121.20 121.58 2qqi s ILE 517 Ca 0.36 -0.63 0.08 0.00 0.00 0.00 0.00 60.65 60.47 2qqi s ILE 517 Cb -0.04 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2qqi s ILE 517 CO 0.23 0.45 0.15 -0.83 0.00 0.00 0.00 174.94 174.93 2qqi s GLY 518 N 1.31 1.60 -0.04 6.18 0.00 0.06 -1.00 107.32 115.43 2qqi s GLY 518 Ca 0.01 -1.57 -0.22 0.00 0.00 0.00 0.00 44.72 42.93 2qqi s GLY 518 CO -0.07 -1.59 0.49 -2.52 0.00 0.00 0.00 173.10 169.41 2qqi s TYR 519 N -2.25 -0.42 -0.07 1.90 -0.85 -0.18 -0.61 117.35 114.87 2qqi s TYR 519 Ca 0.34 0.72 -0.21 0.00 -0.52 0.00 0.00 57.07 57.41 2qqi s TYR 519 Cb -0.06 0.24 0.04 0.00 0.38 0.00 0.00 41.96 42.56 2qqi s TYR 519 CO 0.23 -0.48 0.48 0.45 -1.52 0.00 0.00 175.55 174.71 2qqi s SER 520 N -1.16 -0.42 -0.03 -0.18 0.15 -0.97 -0.67 113.70 110.42 2qqi s SER 520 Ca -0.12 0.51 0.21 0.00 0.70 0.00 0.00 55.95 57.25 2qqi s SER 520 Cb -0.03 0.55 -0.26 0.00 -1.71 0.00 0.00 66.02 64.58 2qqi s SER 520 CO 0.07 -0.44 0.50 0.59 1.20 0.00 0.00 173.24 175.16 2qqi n ASN 521 N 1.52 0.20 -0.04 5.45 3.02 -1.26 -1.36 115.26 122.77 2qqi n ASN 521 Ca -0.19 0.08 0.01 0.00 -0.03 0.00 0.00 54.58 54.46 2qqi n ASN 521 Cb 0.56 1.39 -0.14 0.00 -0.61 0.00 0.00 39.78 40.98 2qqi n ASN 521 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2qqi n ASN 522 N -2.49 0.63 0.00 6.41 0.23 -1.26 -4.82 115.26 113.96 2qqi n ASN 522 Ca -0.10 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.95 2qqi n ASN 522 Cb 0.73 1.45 0.00 0.00 -2.08 0.00 0.00 39.78 39.87 2qqi n ASN 522 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2qqi n GLY 523 N 1.64 2.12 0.06 4.83 0.00 -1.26 -4.87 105.19 107.70 2qqi n GLY 523 Ca -0.15 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.92 2qqi n GLY 523 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qqi n SER 524 N 0.00 0.25 -3.59 1.61 7.64 -1.26 -4.87 113.62 113.40 2qqi n SER 524 Ca 0.00 0.10 -0.23 0.00 1.01 0.00 0.00 58.87 59.75 2qqi n SER 524 Cb 0.00 1.29 -0.16 0.00 -1.01 0.00 0.00 64.21 64.33 2qqi n SER 524 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qqi s ASP 525 N -5.04 1.89 -0.20 6.43 2.15 -1.26 -5.12 116.67 115.51 2qqi s ASP 525 Ca -0.07 -0.39 -0.05 0.00 0.43 0.00 0.00 52.55 52.47 2qqi s ASP 525 Cb 0.11 -0.05 -0.02 0.00 -0.30 0.00 0.00 42.92 42.66 2qqi s ASP 525 CO 0.86 -0.33 0.00 0.26 -0.17 0.00 0.00 175.17 175.80 2qqi s TRP 526 N 2.20 3.04 0.48 -5.34 0.52 -1.26 -4.52 118.94 114.05 2qqi s TRP 526 Ca 0.04 -0.46 -0.09 0.00 0.02 0.00 0.00 56.10 55.60 2qqi s TRP 526 Cb -0.15 -2.09 -0.05 0.00 -1.15 0.00 0.00 33.47 30.02 2qqi s TRP 526 CO -0.09 -0.25 0.84 0.15 0.02 0.00 0.00 176.95 177.62 2qqi s LYS 527 N 1.04 3.67 -0.02 4.98 -0.14 0.16 -4.85 119.74 124.58 2qqi s LYS 527 Ca 0.02 0.44 0.03 0.00 -1.36 0.00 0.00 55.97 55.11 2qqi s LYS 527 Cb -0.14 -2.31 -0.03 0.00 -1.68 0.00 0.00 37.83 33.66 2qqi s LYS 527 CO 0.02 -0.21 -0.10 -1.64 -0.76 0.00 0.00 175.35 172.66 2qqi s MET 528 N -4.44 2.52 0.10 1.68 -1.94 -1.26 -1.01 119.30 114.94 2qqi s MET 528 Ca 0.51 -0.71 -0.31 0.00 -1.71 0.00 0.00 55.69 53.47 2qqi s MET 528 Cb -0.10 -2.45 -0.09 0.00 2.01 0.00 0.00 34.83 34.19 2qqi s MET 528 CO 0.40 0.61 1.71 0.42 -0.01 0.00 0.00 175.02 178.16 2qqi s ILE 529 N -0.89 2.80 0.37 2.53 1.01 -0.17 -4.91 121.20 121.93 2qqi s ILE 529 Ca 0.15 0.31 -0.00 0.00 0.00 0.00 0.00 60.65 61.11 2qqi s ILE 529 Cb -0.11 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 2qqi s ILE 529 CO 0.04 0.00 0.59 -0.04 0.00 0.00 0.00 174.94 175.53 2qqi s MET 530 N 2.53 3.49 1.04 2.79 -1.94 -1.26 -0.33 119.30 125.61 2qqi s MET 530 Ca 0.76 -0.25 -0.15 0.00 -1.71 0.00 0.00 55.69 54.34 2qqi s MET 530 Cb -0.43 -2.61 0.21 0.00 2.01 0.00 0.00 34.83 34.01 2qqi s MET 530 CO 0.34 0.09 1.16 0.16 -0.01 0.00 0.00 175.02 176.76 2qqi s ASP 531 N -4.05 2.39 0.35 3.03 1.47 0.39 -4.40 116.67 115.86 2qqi s ASP 531 Ca 0.41 0.73 0.10 0.00 1.18 0.00 0.00 52.55 54.98 2qqi s ASP 531 Cb -0.10 -1.10 0.86 0.00 -0.34 0.00 0.00 42.92 42.25 2qqi s ASP 531 CO 0.37 -3.22 1.83 0.44 0.68 0.00 0.00 175.17 175.28 2qqi h ASP 532 N -1.96 0.64 1.12 2.11 5.19 -1.99 0.25 116.42 121.77 2qqi h ASP 532 Ca -0.48 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 2qqi h ASP 532 Cb 1.30 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2qqi h ASP 532 CO 0.47 0.27 0.00 0.77 -3.12 0.00 0.00 179.24 177.63 2qqi h SER 533 N 0.65 0.00 -5.27 6.45 4.64 -1.93 -3.47 113.55 114.61 2qqi h SER 533 Ca 0.50 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 61.41 2qqi h SER 533 Cb 0.90 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.04 2qqi h SER 533 CO -0.25 0.00 -0.64 0.29 -0.87 0.00 0.00 176.83 175.35 2qqi n LYS 534 N -2.38 -5.67 -0.03 4.77 5.02 0.08 -4.89 118.16 115.07 2qqi n LYS 534 Ca 0.03 0.78 -0.02 0.00 -2.02 0.00 0.00 58.31 57.09 2qqi n LYS 534 Cb 0.33 -5.69 -0.07 0.00 -0.02 0.00 0.00 35.03 29.58 2qqi n LYS 534 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qqi n ARG 535 N -4.37 1.92 -4.06 1.97 5.12 -1.26 -4.97 116.66 111.01 2qqi n ARG 535 Ca -0.04 -0.03 -0.08 0.00 -1.93 0.00 0.00 57.85 55.78 2qqi n ARG 535 Cb 0.58 -1.23 -0.10 0.00 -1.16 0.00 0.00 32.46 30.55 2qqi n ARG 535 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2qqi s LYS 536 N -2.34 0.55 0.29 5.56 1.02 -1.26 -5.04 119.74 118.52 2qqi s LYS 536 Ca -0.04 -1.08 -0.30 0.00 0.02 0.00 0.00 55.97 54.58 2qqi s LYS 536 Cb 0.04 0.19 -0.11 0.00 -0.52 0.00 0.00 37.83 37.43 2qqi s LYS 536 CO 0.38 -0.10 1.49 0.00 -0.92 0.00 0.00 175.35 176.20 2qqi s ALA 537 N -3.37 3.65 0.15 5.17 0.00 -1.26 -0.47 121.76 125.63 2qqi s ALA 537 Ca 0.02 1.45 -0.30 0.00 0.00 0.00 0.00 51.96 53.13 2qqi s ALA 537 Cb 0.04 -3.59 -0.07 0.00 0.00 0.00 0.00 23.12 19.50 2qqi s ALA 537 CO -0.08 -0.87 1.18 0.21 0.00 0.00 0.00 175.76 176.20 2qqi s LYS 538 N -0.82 4.50 -0.34 0.00 2.20 0.55 -4.57 119.74 121.25 2qqi s LYS 538 Ca 0.59 1.82 -0.19 0.00 -0.36 0.00 0.00 55.97 57.83 2qqi s LYS 538 Cb -0.45 -3.27 -0.01 0.00 -1.51 0.00 0.00 37.83 32.59 2qqi s LYS 538 CO 0.49 -0.10 0.54 0.45 -0.36 0.00 0.00 175.35 176.37 2qqi s SER 539 N 0.32 6.36 0.19 1.43 0.15 -1.26 -4.36 113.70 116.52 2qqi s SER 539 Ca 0.54 0.09 -0.22 0.00 0.70 0.00 0.00 55.95 57.06 2qqi s SER 539 Cb -0.31 -2.28 -0.08 0.00 -1.71 0.00 0.00 66.02 61.64 2qqi s SER 539 CO 0.34 -0.47 0.74 -0.36 1.20 0.00 0.00 173.24 174.69 2qqi s PHE 540 N 2.44 3.76 0.37 3.44 0.40 0.11 -4.89 117.98 123.62 2qqi s PHE 540 Ca 0.20 1.49 -0.25 0.00 -0.60 0.00 0.00 56.93 57.77 2qqi s PHE 540 Cb -0.15 -2.68 -0.09 0.00 0.51 0.00 0.00 43.02 40.60 2qqi s PHE 540 CO 0.13 0.42 1.03 -1.21 0.70 0.00 0.00 175.22 176.29 2qqi s GLU 541 N -1.59 4.32 0.00 0.44 0.41 -1.26 -1.81 118.70 119.22 2qqi s GLU 541 Ca 0.39 1.50 0.00 0.00 -0.41 0.00 0.00 54.97 56.45 2qqi s GLU 541 Cb -0.19 -2.67 0.00 0.00 -1.78 0.00 0.00 34.13 29.48 2qqi s GLU 541 CO 0.23 0.00 0.00 0.41 -0.49 0.00 0.00 175.26 175.41 2qqi n GLY 542 N 0.48 -1.56 3.74 -1.39 0.00 -1.22 -4.87 105.19 100.36 2qqi n GLY 542 Ca 0.04 -1.59 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 2qqi n GLY 542 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qqi s ASN 543 N -1.17 7.46 0.13 1.61 -0.87 -1.26 -4.93 114.94 115.91 2qqi s ASN 543 Ca 0.00 1.74 0.24 0.00 -1.57 0.00 0.00 52.86 53.27 2qqi s ASN 543 Cb 0.00 -2.56 0.38 0.00 -0.02 0.00 0.00 41.25 39.05 2qqi s ASN 543 CO 0.00 0.05 1.36 -0.46 -2.57 0.00 0.00 177.10 175.47 2qqi n ASN 544 N 2.29 0.72 -4.26 -1.22 0.23 -1.26 -4.60 115.26 107.16 2qqi n ASN 544 Ca -0.01 0.17 -0.14 0.00 -0.53 0.00 0.00 54.58 54.07 2qqi n ASN 544 Cb 0.49 0.07 -0.10 0.00 -2.08 0.00 0.00 39.78 38.16 2qqi n ASN 544 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2qqi s ASN 545 N -4.28 0.99 0.27 0.53 2.20 -1.26 -5.03 114.94 108.36 2qqi s ASN 545 Ca 0.06 -1.29 -0.03 0.00 -0.94 0.00 0.00 52.86 50.66 2qqi s ASN 545 Cb 0.13 0.18 0.34 0.00 -2.00 0.00 0.00 41.25 39.91 2qqi s ASN 545 CO 0.71 -0.68 1.85 0.22 -2.94 0.00 0.00 177.10 176.26 2qqi h TYR 546 N 2.57 1.02 0.00 1.54 5.03 -1.90 -3.39 116.97 121.84 2qqi h TYR 546 Ca -0.37 -0.05 0.00 0.00 2.58 0.00 0.00 58.73 60.89 2qqi h TYR 546 Cb 1.23 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 39.19 2qqi h TYR 546 CO 0.47 0.76 -0.85 -3.47 -1.32 0.00 0.00 178.16 173.75 2qqi n ASP 547 N -4.31 3.80 -4.68 -2.11 2.03 -1.26 -4.22 116.55 105.80 2qqi n ASP 547 Ca 0.06 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.95 2qqi n ASP 547 Cb 0.16 0.21 -0.03 0.00 -0.72 0.00 0.00 41.12 40.74 2qqi n ASP 547 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2qqi s THR 548 N -1.85 3.20 0.50 5.18 2.01 -1.26 -4.67 115.64 118.75 2qqi s THR 548 Ca 0.00 0.49 -0.22 0.00 0.31 0.00 0.00 61.69 62.28 2qqi s THR 548 Cb 0.00 -3.32 -0.06 0.00 0.01 0.00 0.00 72.50 69.13 2qqi s THR 548 CO 0.00 -0.02 1.21 -2.84 -0.69 0.00 0.00 174.62 172.28 2qqi s PRO 549 N 3.28 3.48 -0.01 4.92 0.02 -1.26 -4.74 135.00 140.69 2qqi s PRO 549 Ca 0.76 1.86 0.04 0.00 0.02 0.00 0.00 61.00 63.68 2qqi s PRO 549 Cb -0.38 -2.27 -0.01 0.00 0.02 0.00 0.00 34.50 31.86 2qqi s PRO 549 CO 0.33 -0.81 -0.13 -1.21 -0.33 0.00 0.00 177.00 174.85 2qqi s GLU 550 N -2.88 1.07 -0.05 5.54 2.02 0.53 -4.31 118.70 120.61 2qqi s GLU 550 Ca 0.68 -0.50 -0.18 0.00 0.02 0.00 0.00 54.97 54.99 2qqi s GLU 550 Cb -0.31 -1.04 -0.05 0.00 0.10 0.00 0.00 34.13 32.83 2qqi s GLU 550 CO 0.36 0.28 0.49 -1.17 0.02 0.00 0.00 175.26 175.25 2qqi s LEU 551 N -0.39 4.37 -0.12 1.80 2.96 -1.26 -0.83 118.68 125.22 2qqi s LEU 551 Ca 0.05 0.95 0.02 0.00 -0.22 0.00 0.00 54.13 54.94 2qqi s LEU 551 Cb -0.05 -2.73 -0.00 0.00 0.50 0.00 0.00 46.19 43.90 2qqi s LEU 551 CO -0.00 0.12 -0.20 -0.13 -1.32 0.00 0.00 176.35 174.82 2qqi s ARG 552 N -0.07 3.16 0.30 1.98 1.81 0.61 -4.99 118.95 121.75 2qqi s ARG 552 Ca 0.27 -0.81 0.10 0.00 -1.72 0.00 0.00 55.73 53.57 2qqi s ARG 552 Cb -0.16 -2.44 -0.05 0.00 -0.45 0.00 0.00 34.95 31.84 2qqi s ARG 552 CO 0.13 0.15 -0.02 0.95 -0.68 0.00 0.00 175.30 175.83 2qqi s THR 553 N 0.45 2.99 0.17 0.02 -4.23 -1.26 -0.76 115.64 113.02 2qqi s THR 553 Ca -0.14 -2.01 -0.23 0.00 -1.18 0.00 0.00 61.69 58.13 2qqi s THR 553 Cb -0.17 -2.74 0.06 0.00 1.34 0.00 0.00 72.50 70.99 2qqi s THR 553 CO 0.06 -0.31 0.71 0.72 -0.54 0.00 0.00 174.62 175.26 2qqi s PHE 554 N -2.42 -0.37 0.22 3.99 -0.12 -1.18 -4.99 117.98 113.11 2qqi s PHE 554 Ca 0.33 0.09 -0.32 0.00 -0.05 0.00 0.00 56.93 56.98 2qqi s PHE 554 Cb -0.04 0.61 -0.14 0.00 -0.63 0.00 0.00 43.02 42.82 2qqi s PHE 554 CO 0.19 -0.92 1.44 -2.30 -0.05 0.00 0.00 175.22 173.59 2qqi n PRO 555 N -0.39 2.05 -1.62 1.99 -0.02 -1.26 -4.69 135.00 131.05 2qqi n PRO 555 Ca -0.11 0.73 -0.46 0.00 -2.02 0.00 0.00 63.50 61.64 2qqi n PRO 555 Cb 0.62 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 2qqi n PRO 555 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qqi n ALA 556 N 2.22 0.15 -2.41 3.55 0.00 -1.26 -4.87 120.51 117.89 2qqi n ALA 556 Ca 0.13 0.42 -0.21 0.00 0.00 0.00 0.00 53.44 53.78 2qqi n ALA 556 Cb 0.31 -2.13 -0.10 0.00 0.00 0.00 0.00 19.45 17.53 2qqi n ALA 556 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2qqi s LEU 557 N 0.28 2.54 -0.27 0.00 0.05 -0.03 -4.95 118.68 116.30 2qqi s LEU 557 Ca 0.66 -1.10 -0.02 0.00 0.05 0.00 0.00 54.13 53.72 2qqi s LEU 557 Cb -0.72 -0.74 0.03 0.00 -2.05 0.00 0.00 46.19 42.71 2qqi s LEU 557 CO 0.54 -0.21 -0.03 -0.55 -0.55 0.00 0.00 176.35 175.55 2qqi s SER 558 N -3.41 4.58 0.04 1.48 0.15 -1.26 -0.62 113.70 114.65 2qqi s SER 558 Ca 0.27 -0.98 -0.28 0.00 0.70 0.00 0.00 55.95 55.66 2qqi s SER 558 Cb 0.01 -1.70 0.07 0.00 -1.71 0.00 0.00 66.02 62.69 2qqi s SER 558 CO 0.11 -0.18 0.67 0.28 1.20 0.00 0.00 173.24 175.32 2qqi s THR 559 N 1.32 0.00 -0.17 6.45 -1.32 0.15 -4.90 115.64 117.17 2qqi s THR 559 Ca -0.01 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.48 2qqi s THR 559 Cb -0.18 -1.00 -0.22 0.00 -1.51 0.00 0.00 72.50 69.59 2qqi s THR 559 CO -0.03 0.00 0.15 -1.14 -2.21 0.00 0.00 174.62 171.39 2qqi n ARG 560 N 0.31 0.70 -5.07 7.08 0.63 -1.20 -1.14 116.66 117.96 2qqi n ARG 560 Ca -0.17 0.19 -0.32 0.00 -0.92 0.00 0.00 57.85 56.63 2qqi n ARG 560 Cb 0.61 -1.63 -0.14 0.00 0.45 0.00 0.00 32.46 31.74 2qqi n ARG 560 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2qqi s PHE 561 N -2.54 2.54 -0.07 -0.14 0.40 -0.47 -0.87 117.98 116.83 2qqi s PHE 561 Ca -0.23 -0.31 0.05 0.00 -0.60 0.00 0.00 56.93 55.83 2qqi s PHE 561 Cb 0.08 -1.58 -0.01 0.00 0.51 0.00 0.00 43.02 42.01 2qqi s PHE 561 CO 0.72 0.07 -0.21 0.42 0.70 0.00 0.00 175.22 176.92 2qqi s ILE 562 N -0.63 2.44 -0.09 0.64 -1.09 -0.14 -2.30 121.20 120.04 2qqi s ILE 562 Ca 0.10 -0.93 0.02 0.00 -2.23 0.00 0.00 60.65 57.62 2qqi s ILE 562 Cb -0.11 -1.93 -0.02 0.00 -1.58 0.00 0.00 42.46 38.83 2qqi s ILE 562 CO 0.00 0.57 -0.16 -0.13 -1.23 0.00 0.00 174.94 173.99 2qqi s ARG 563 N -0.21 2.93 -0.25 2.79 0.52 0.22 -0.60 118.95 124.36 2qqi s ARG 563 Ca -0.01 -0.74 -0.10 0.00 -0.52 0.00 0.00 55.73 54.36 2qqi s ARG 563 Cb -0.13 -2.44 -0.04 0.00 0.52 0.00 0.00 34.95 32.85 2qqi s ARG 563 CO 0.03 0.37 0.14 0.42 0.02 0.00 0.00 175.30 176.28 2qqi s ILE 564 N -0.09 5.02 -0.43 1.52 -1.09 -0.10 -0.76 121.20 125.27 2qqi s ILE 564 Ca -0.03 0.07 -0.03 0.00 -2.23 0.00 0.00 60.65 58.43 2qqi s ILE 564 Cb -0.14 -3.35 0.12 0.00 -1.58 0.00 0.00 42.46 37.50 2qqi s ILE 564 CO 0.04 0.32 0.22 -0.31 -1.23 0.00 0.00 174.94 173.99 2qqi s TYR 565 N 1.36 3.57 0.50 3.97 1.51 -0.15 -1.32 117.35 126.80 2qqi s TYR 565 Ca 0.06 -2.47 -0.19 0.00 -1.01 0.00 0.00 57.07 53.46 2qqi s TYR 565 Cb -0.15 -3.21 -0.08 0.00 -0.11 0.00 0.00 41.96 38.41 2qqi s TYR 565 CO 0.06 -0.96 1.02 -1.25 -1.11 0.00 0.00 175.55 173.31 2qqi s PRO 566 N 1.01 3.80 0.76 -1.71 0.04 -1.26 -1.06 135.00 136.58 2qqi s PRO 566 Ca 0.09 1.24 -0.12 0.00 0.04 0.00 0.00 61.00 62.26 2qqi s PRO 566 Cb -0.22 -2.10 0.05 0.00 0.04 0.00 0.00 34.50 32.27 2qqi s PRO 566 CO -0.04 -0.42 1.11 -1.83 0.04 0.00 0.00 177.00 175.86 2qqi s GLU 567 N -3.48 2.24 0.46 4.56 -1.05 -0.01 -4.86 118.70 116.56 2qqi s GLU 567 Ca 0.65 1.29 -0.24 0.00 -0.15 0.00 0.00 54.97 56.51 2qqi s GLU 567 Cb -0.14 -1.89 -0.08 0.00 -0.44 0.00 0.00 34.13 31.58 2qqi s GLU 567 CO 0.23 -1.67 1.25 0.54 0.95 0.00 0.00 175.26 176.56 2qqi n ARG 568 N -3.32 1.76 -4.53 -4.83 1.74 -1.26 -4.93 116.66 101.29 2qqi n ARG 568 Ca 0.10 0.63 -0.29 0.00 -0.77 0.00 0.00 57.85 57.52 2qqi n ARG 568 Cb 0.53 -2.39 -0.13 0.00 -1.02 0.00 0.00 32.46 29.45 2qqi n ARG 568 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qqi s ALA 569 N -1.25 2.40 0.23 7.54 0.00 -1.26 -5.04 121.76 124.38 2qqi s ALA 569 Ca 0.65 -1.38 0.07 0.00 0.00 0.00 0.00 51.96 51.29 2qqi s ALA 569 Cb -0.48 -0.47 0.22 0.00 0.00 0.00 0.00 23.12 22.40 2qqi s ALA 569 CO 0.55 0.55 1.54 1.79 0.00 0.00 0.00 175.76 180.18 2qqi h THR 570 N 3.93 1.45 -3.65 0.00 1.35 -2.00 -3.46 112.91 110.53 2qqi h THR 570 Ca -0.49 -2.24 -0.07 0.00 -0.55 0.00 0.00 66.41 63.06 2qqi h THR 570 Cb 1.16 2.19 -0.11 0.00 -1.73 0.00 0.00 68.15 69.67 2qqi h THR 570 CO 0.42 0.65 -0.15 -1.38 -0.25 0.00 0.00 175.52 174.80 2qqi s HIS 571 N -3.54 0.27 0.04 4.73 -3.43 -1.26 -5.14 115.29 106.96 2qqi s HIS 571 Ca -0.02 -0.62 0.00 0.00 -0.80 0.00 0.00 55.06 53.61 2qqi s HIS 571 Cb 0.12 0.15 0.00 0.00 -1.43 0.00 0.00 32.58 31.42 2qqi s HIS 571 CO 0.79 -0.88 0.00 0.41 -2.00 0.00 0.00 174.74 173.06 2qqi n GLY 572 N -0.32 -2.38 0.25 -1.38 0.00 -1.26 -5.01 105.19 95.10 2qqi n GLY 572 Ca -0.05 -1.44 -0.02 0.00 0.00 0.00 0.00 46.02 44.51 2qqi n GLY 572 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqi n GLY 573 N -2.37 0.16 3.68 -0.02 0.00 -1.26 -4.53 105.19 100.85 2qqi n GLY 573 Ca -0.01 -1.87 -0.38 0.00 0.00 0.00 0.00 46.02 43.76 2qqi n GLY 573 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qqi s LEU 574 N 0.00 4.18 -0.25 0.99 2.96 -0.17 -4.92 118.68 121.47 2qqi s LEU 574 Ca 0.05 0.61 -0.14 0.00 -0.22 0.00 0.00 54.13 54.42 2qqi s LEU 574 Cb -0.00 -2.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.06 2qqi s LEU 574 CO 0.03 -0.08 0.33 -0.83 -1.32 0.00 0.00 176.35 174.48 2qqi s GLY 575 N 0.97 1.95 -0.27 7.98 0.00 -1.26 0.09 107.32 116.77 2qqi s GLY 575 Ca 0.21 -0.79 -0.19 0.00 0.00 0.00 0.00 44.72 43.95 2qqi s GLY 575 CO 0.09 0.82 0.69 -2.27 0.00 0.00 0.00 173.10 172.42 2qqi s LEU 576 N 1.70 -0.82 -0.03 0.66 2.96 -1.26 -3.37 118.68 118.52 2qqi s LEU 576 Ca 0.14 1.46 0.07 0.00 -0.22 0.00 0.00 54.13 55.58 2qqi s LEU 576 Cb -0.15 2.38 -0.02 0.00 0.50 0.00 0.00 46.19 48.90 2qqi s LEU 576 CO 0.09 -0.24 -0.24 -0.13 -1.32 0.00 0.00 176.35 174.50 2qqi s ARG 577 N 1.11 2.09 0.12 1.98 0.52 0.19 -4.30 118.95 120.65 2qqi s ARG 577 Ca -0.06 -0.87 -0.12 0.00 -0.52 0.00 0.00 55.73 54.16 2qqi s ARG 577 Cb -0.05 -1.95 0.02 0.00 0.52 0.00 0.00 34.95 33.48 2qqi s ARG 577 CO -0.11 0.49 0.31 0.00 0.02 0.00 0.00 175.30 176.01 2qqi s MET 578 N -0.47 1.01 -0.01 3.54 0.23 0.58 -0.16 119.30 124.03 2qqi s MET 578 Ca 0.06 -0.87 -0.11 0.00 -1.03 0.00 0.00 55.69 53.75 2qqi s MET 578 Cb -0.10 0.41 0.01 0.00 -1.53 0.00 0.00 34.83 33.62 2qqi s MET 578 CO 0.00 -0.37 0.22 -2.00 -2.03 0.00 0.00 175.02 170.84 2qqi s GLU 579 N -3.85 0.55 -0.01 3.16 2.56 -0.44 -1.64 118.70 119.03 2qqi s GLU 579 Ca 0.06 -0.26 0.02 0.00 0.00 0.00 0.00 54.97 54.78 2qqi s GLU 579 Cb 0.03 0.24 -0.03 0.00 2.00 0.00 0.00 34.13 36.36 2qqi s GLU 579 CO -0.10 -0.14 -0.02 -0.51 -0.56 0.00 0.00 175.26 173.94 2qqi s LEU 580 N -1.27 3.42 -0.07 2.70 1.43 -1.26 -0.18 118.68 123.45 2qqi s LEU 580 Ca -0.13 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 52.95 2qqi s LEU 580 Cb -0.06 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 2qqi s LEU 580 CO 0.03 0.29 -0.11 -0.76 0.23 0.00 0.00 176.35 176.03 2qqi s LEU 581 N -1.45 2.92 0.00 1.79 1.43 0.05 -0.93 118.68 122.48 2qqi s LEU 581 Ca 0.18 -0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 2qqi s LEU 581 Cb -0.11 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.48 2qqi s LEU 581 CO 0.09 0.31 0.00 0.61 0.23 0.00 0.00 176.35 177.59 2qqi n GLY 582 N 2.54 -0.68 3.83 -3.19 0.00 -0.21 -1.03 105.19 106.45 2qqi n GLY 582 Ca -0.18 -0.43 -0.04 0.00 0.00 0.00 0.00 46.02 45.37 2qqi n GLY 582 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqi s GLU 584 N -2.55 4.03 0.35 0.00 2.02 -1.26 -0.92 118.70 120.37 2qqi s GLU 584 Ca 0.18 1.06 -0.27 0.00 0.02 0.00 0.00 54.97 55.95 2qqi s GLU 584 Cb -0.03 -2.15 -0.09 0.00 0.10 0.00 0.00 34.13 31.96 2qqi s GLU 584 CO 0.06 -0.20 1.22 0.08 0.02 0.00 0.00 175.26 176.43 2qqi s VAL 585 N -2.39 3.02 -2.08 2.63 1.01 -1.26 -4.69 120.40 116.63 2qqi s VAL 585 Ca 0.61 0.96 0.31 0.00 0.00 0.00 0.00 61.98 63.86 2qqi s VAL 585 Cb -0.10 -3.58 0.85 0.00 0.00 0.00 0.00 36.38 33.55 2qqi s VAL 585 CO 0.23 0.18 2.15 -1.84 0.00 0.00 0.00 175.10 175.82