#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3geb s HIS 266 N 0.00 3.76 0.55 0.66 4.02 -1.26 -5.04 115.29 117.98 3geb s HIS 266 Ca 0.00 1.81 -0.18 0.00 1.02 0.00 0.00 55.06 57.72 3geb s HIS 266 Cb 0.00 -3.06 -0.06 0.00 -1.02 0.00 0.00 32.58 28.44 3geb s HIS 266 CO 0.00 0.06 1.05 1.41 1.02 0.00 0.00 174.74 178.28 3geb s MET 267 N -1.54 3.53 -0.03 1.40 -2.45 -1.26 -5.05 119.30 113.91 3geb s MET 267 Ca 0.45 1.28 -0.01 0.00 -1.25 0.00 0.00 55.69 56.16 3geb s MET 267 Cb -0.26 -2.06 0.03 0.00 1.25 0.00 0.00 34.83 33.80 3geb s MET 267 CO 0.32 -0.65 0.05 -1.21 1.05 0.00 0.00 175.02 174.58 3geb s GLU 268 N -3.71 -0.03 -0.05 4.11 2.02 -1.26 -4.84 118.70 114.93 3geb s GLU 268 Ca 0.65 0.24 0.00 0.00 0.02 0.00 0.00 54.97 55.88 3geb s GLU 268 Cb -0.16 -0.28 -0.03 0.00 0.10 0.00 0.00 34.13 33.75 3geb s GLU 268 CO 0.30 -0.20 -0.02 1.03 0.02 0.00 0.00 175.26 176.39 3geb s ARG 269 N 1.27 2.82 -0.16 1.61 0.52 -0.67 -0.39 118.95 123.95 3geb s ARG 269 Ca -0.07 -0.53 0.01 0.00 -0.52 0.00 0.00 55.73 54.62 3geb s ARG 269 Cb -0.13 -2.67 0.02 0.00 0.52 0.00 0.00 34.95 32.68 3geb s ARG 269 CO -0.03 0.66 -0.20 0.08 0.02 0.00 0.00 175.30 175.83 3geb s VAL 270 N -0.93 2.00 -0.37 3.52 1.01 -0.72 -1.61 120.40 123.30 3geb s VAL 270 Ca 0.15 -0.92 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 3geb s VAL 270 Cb -0.11 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.47 3geb s VAL 270 CO 0.05 0.53 0.25 -0.36 0.00 0.00 0.00 175.10 175.58 3geb s PHE 271 N 1.13 3.23 -0.53 5.22 0.40 0.82 -1.39 117.98 126.86 3geb s PHE 271 Ca 0.00 -0.45 -0.16 0.00 -0.60 0.00 0.00 56.93 55.73 3geb s PHE 271 Cb -0.14 -2.51 0.12 0.00 0.51 0.00 0.00 43.02 41.00 3geb s PHE 271 CO -0.09 -0.48 0.48 0.08 0.70 0.00 0.00 175.22 175.92 3geb s VAL 272 N 1.68 5.21 0.39 -0.44 1.01 0.02 -0.55 120.40 127.72 3geb s VAL 272 Ca 0.05 -1.42 -0.06 0.00 0.00 0.00 0.00 61.98 60.56 3geb s VAL 272 Cb -0.18 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.85 3geb s VAL 272 CO 0.10 -0.82 0.68 0.26 0.00 0.00 0.00 175.10 175.32 3geb s TRP 273 N 1.61 3.51 0.26 5.22 0.52 0.06 -1.76 118.94 128.36 3geb s TRP 273 Ca 0.03 0.76 0.05 0.00 0.02 0.00 0.00 56.10 56.97 3geb s TRP 273 Cb -0.29 -2.23 -0.03 0.00 -1.15 0.00 0.00 33.47 29.77 3geb s TRP 273 CO 0.04 -0.05 0.36 0.34 0.02 0.00 0.00 176.95 177.66 3geb s ASP 274 N -3.57 6.19 -0.07 2.95 2.15 -0.71 -1.33 116.67 122.28 3geb s ASP 274 Ca 0.46 -0.00 -0.07 0.00 0.43 0.00 0.00 52.55 53.37 3geb s ASP 274 Cb -0.10 -1.71 -0.02 0.00 -0.30 0.00 0.00 42.92 40.78 3geb s ASP 274 CO 0.36 -0.13 -0.14 -0.11 -0.17 0.00 0.00 175.17 174.98 3geb n LEU 275 N -1.43 0.84 -4.70 -1.34 7.94 -1.26 -4.00 117.00 113.05 3geb n LEU 275 Ca -0.07 0.14 -0.42 0.00 -1.11 0.00 0.00 56.01 54.55 3geb n LEU 275 Cb 0.57 -0.55 -0.03 0.00 0.53 0.00 0.00 43.42 43.94 3geb n LEU 275 CO 0.44 -0.42 1.25 -1.81 -1.11 0.00 0.00 177.39 175.74 3geb s ASP 276 N -4.95 6.62 -0.72 1.96 1.11 -1.26 -0.92 116.67 118.51 3geb s ASP 276 Ca -0.12 2.51 0.00 0.00 0.18 0.00 0.00 52.55 55.13 3geb s ASP 276 Cb 0.02 -2.58 0.00 0.00 1.07 0.00 0.00 42.92 41.43 3geb s ASP 276 CO 0.17 -0.83 0.00 -0.62 1.18 0.00 0.00 175.17 175.07 3geb n GLU 277 N 4.74 -1.27 0.03 8.23 4.71 0.31 -4.74 120.64 132.64 3geb n GLU 277 Ca 0.14 0.66 0.00 0.00 -0.01 0.00 0.00 57.16 57.96 3geb n GLU 277 Cb 0.40 -4.77 0.00 0.00 -1.01 0.00 0.00 31.44 26.06 3geb n GLU 277 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3geb n THR 278 N -2.40 0.46 0.01 2.62 -1.04 -0.99 -4.66 114.28 108.27 3geb n THR 278 Ca -0.07 0.15 -0.18 0.00 -2.04 0.00 0.00 64.05 61.91 3geb n THR 278 Cb 0.42 -1.12 -0.14 0.00 -1.82 0.00 0.00 70.33 67.67 3geb n THR 278 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3geb h ILE 279 N 0.00 0.76 -3.25 12.58 2.04 -1.16 -3.47 117.51 125.01 3geb h ILE 279 Ca 0.00 -2.49 -0.41 0.00 1.00 0.00 0.00 64.86 62.96 3geb h ILE 279 Cb 0.00 2.54 -0.16 0.00 -0.74 0.00 0.00 36.82 38.47 3geb h ILE 279 CO 0.00 0.80 -0.74 0.27 0.00 0.00 0.00 178.15 178.48 3geb s ILE 280 N -2.58 1.47 -0.25 -0.67 -4.36 -0.74 -4.44 121.20 109.63 3geb s ILE 280 Ca -0.16 -2.01 -0.06 0.00 -0.26 0.00 0.00 60.65 58.16 3geb s ILE 280 Cb 0.07 -1.83 -0.01 0.00 1.25 0.00 0.00 42.46 41.94 3geb s ILE 280 CO 0.80 -0.57 0.03 -0.63 0.24 0.00 0.00 174.94 174.82 3geb s ILE 281 N -2.76 3.91 0.27 8.37 -1.09 -1.26 0.11 121.20 128.74 3geb s ILE 281 Ca 0.16 -0.41 0.00 0.00 -2.23 0.00 0.00 60.65 58.17 3geb s ILE 281 Cb -0.01 -2.86 0.00 0.00 -1.58 0.00 0.00 42.46 38.01 3geb s ILE 281 CO 0.04 0.30 0.00 0.33 -1.23 0.00 0.00 174.94 174.38 3geb n PHE 282 N 4.87 -2.70 -0.32 3.97 7.35 -1.26 -4.91 117.46 124.45 3geb n PHE 282 Ca -0.16 0.64 -0.04 0.00 -0.76 0.00 0.00 57.45 57.12 3geb n PHE 282 Cb 0.50 1.43 0.08 0.00 0.35 0.00 0.00 39.48 41.85 3geb n PHE 282 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 3geb h HIS 283 N 0.00 1.24 0.00 -5.13 3.86 -1.97 -2.26 115.15 110.89 3geb h HIS 283 Ca 0.00 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 3geb h HIS 283 Cb 0.00 -0.39 0.00 0.00 1.06 0.00 0.00 27.41 28.08 3geb h HIS 283 CO 0.00 0.88 0.00 -1.13 0.86 0.00 0.00 177.93 178.54 3geb n SER 284 N -4.31 0.00 -0.03 2.45 3.41 -1.26 -1.26 113.62 112.62 3geb n SER 284 Ca 0.09 -0.79 -0.10 0.00 -0.26 0.00 0.00 58.87 57.81 3geb n SER 284 Cb 0.13 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.94 3geb n SER 284 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3geb n LEU 285 N -0.78 0.94 0.08 1.04 4.77 -0.85 -2.73 117.00 119.47 3geb n LEU 285 Ca 0.07 0.36 -0.01 0.00 -0.03 0.00 0.00 56.01 56.40 3geb n LEU 285 Cb 0.03 0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 3geb n LEU 285 CO 0.06 0.44 0.13 -0.07 -1.33 0.00 0.00 177.39 176.61 3geb h LEU 286 N 0.01 0.00 0.00 2.23 3.38 -1.26 -3.09 115.31 116.58 3geb h LEU 286 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 3geb h LEU 286 Cb 2.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.79 3geb h LEU 286 CO 0.07 0.68 -1.02 0.35 0.09 0.00 0.00 178.44 178.61 3geb n THR 287 N -3.16 0.08 -0.92 0.22 -2.24 -1.13 -4.93 114.28 102.21 3geb n THR 287 Ca -0.03 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 3geb n THR 287 Cb 0.84 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 3geb n THR 287 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3geb n GLY 288 N 1.42 0.59 0.18 3.38 0.00 -1.22 -4.94 105.19 104.59 3geb n GLY 288 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 3geb n GLY 288 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3geb h THR 289 N 0.00 1.37 0.02 2.61 1.35 -1.91 -1.20 112.91 115.15 3geb h THR 289 Ca 0.00 -2.13 -0.00 0.00 -0.55 0.00 0.00 66.41 63.73 3geb h THR 289 Cb 0.00 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 3geb h THR 289 CO 0.00 0.64 -0.01 0.15 -0.25 0.00 0.00 175.52 176.05 3geb h PHE 290 N 0.31 -0.03 -0.92 4.73 3.57 -1.88 0.27 116.94 122.99 3geb h PHE 290 Ca -0.03 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.55 3geb h PHE 290 Cb 1.32 0.01 -0.07 0.00 2.79 0.00 0.00 35.95 40.00 3geb h PHE 290 CO 0.05 0.49 0.57 0.00 -2.23 0.00 0.00 178.31 177.19 3geb h ALA 291 N 0.39 1.30 -0.16 2.41 0.00 -1.77 0.64 119.26 122.08 3geb h ALA 291 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3geb h ALA 291 Cb 0.53 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3geb h ALA 291 CO 0.00 0.28 -0.14 1.03 0.00 0.00 0.00 179.25 180.43 3geb h SER 292 N 1.00 0.39 -0.04 0.00 0.87 -1.14 0.66 113.55 115.29 3geb h SER 292 Ca 0.42 -0.47 -0.08 0.00 -1.23 0.00 0.00 61.79 60.43 3geb h SER 292 Cb 0.27 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 3geb h SER 292 CO -0.20 0.77 -0.20 -0.09 -0.53 0.00 0.00 176.83 176.58 3geb h ARG 293 N 0.01 0.41 -0.40 2.24 2.43 0.08 -3.20 114.38 115.95 3geb h ARG 293 Ca 0.03 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3geb h ARG 293 Cb 0.66 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 3geb h ARG 293 CO 0.03 0.60 0.00 0.66 -1.51 0.00 0.00 179.97 179.75 3geb n TYR 294 N -4.17 0.53 -2.76 2.20 4.02 0.17 -5.00 117.16 112.15 3geb n TYR 294 Ca -0.00 -0.48 -0.09 0.00 -0.01 0.00 0.00 57.90 57.32 3geb n TYR 294 Cb 0.36 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.70 3geb n TYR 294 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3geb n GLY 295 N 0.72 0.11 3.79 2.72 0.00 0.15 -5.02 105.19 107.66 3geb n GLY 295 Ca 0.14 -0.21 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 3geb n GLY 295 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3geb s LYS 296 N -4.89 2.55 0.08 1.61 3.01 0.21 -5.02 119.74 117.29 3geb s LYS 296 Ca 0.07 -1.42 -0.31 0.00 -1.01 0.00 0.00 55.97 53.30 3geb s LYS 296 Cb -0.03 -2.32 -0.07 0.00 -1.01 0.00 0.00 37.83 34.40 3geb s LYS 296 CO 0.34 0.10 1.27 0.34 0.51 0.00 0.00 175.35 177.92 3geb s ASP 297 N -3.92 6.98 0.16 2.83 2.15 -1.26 -4.55 116.67 119.05 3geb s ASP 297 Ca 0.39 2.14 0.05 0.00 0.43 0.00 0.00 52.55 55.56 3geb s ASP 297 Cb -0.04 -2.58 -0.05 0.00 -0.30 0.00 0.00 42.92 39.95 3geb s ASP 297 CO 0.25 -0.54 1.36 0.71 -0.17 0.00 0.00 175.17 176.77 3geb h THR 298 N 4.41 1.57 -0.55 1.71 1.35 -1.96 -2.40 112.91 117.05 3geb h THR 298 Ca -0.42 -2.87 -0.03 0.00 -0.55 0.00 0.00 66.41 62.54 3geb h THR 298 Cb 1.21 2.59 -0.02 0.00 -1.73 0.00 0.00 68.15 70.20 3geb h THR 298 CO 0.83 0.83 0.22 0.74 -0.25 0.00 0.00 175.52 177.89 3geb h THR 299 N 0.05 1.22 -0.32 6.82 2.02 -1.98 -1.74 112.91 118.98 3geb h THR 299 Ca -0.03 -0.67 -0.15 0.00 0.77 0.00 0.00 66.41 66.32 3geb h THR 299 Cb 1.57 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.62 3geb h THR 299 CO 0.13 0.26 -0.40 0.74 0.37 0.00 0.00 175.52 176.61 3geb h THR 300 N 0.75 1.28 -0.28 3.16 2.02 -1.97 -2.18 112.91 115.69 3geb h THR 300 Ca 0.18 -1.58 0.03 0.00 0.77 0.00 0.00 66.41 65.81 3geb h THR 300 Cb 0.19 1.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 3geb h THR 300 CO -0.02 0.52 0.09 -1.28 0.37 0.00 0.00 175.52 175.20 3geb h SER 301 N 0.64 0.10 -0.21 4.18 0.87 -1.13 -1.44 113.55 116.57 3geb h SER 301 Ca 0.05 0.03 -0.15 0.00 -1.23 0.00 0.00 61.79 60.49 3geb h SER 301 Cb 0.97 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.94 3geb h SER 301 CO 0.09 0.09 -0.43 0.58 -0.53 0.00 0.00 176.83 176.63 3geb h VAL 302 N 0.22 1.29 -0.09 2.23 2.07 -1.23 -0.32 116.25 120.42 3geb h VAL 302 Ca 0.12 -1.61 0.00 0.00 0.82 0.00 0.00 66.70 66.03 3geb h VAL 302 Cb 0.10 1.51 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 3geb h VAL 302 CO -0.13 0.52 0.06 -0.09 0.02 0.00 0.00 177.57 177.95 3geb h ARG 303 N 0.61 0.11 -0.34 1.57 2.43 -1.17 -0.99 114.38 116.61 3geb h ARG 303 Ca 0.04 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3geb h ARG 303 Cb 0.99 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 3geb h ARG 303 CO 0.09 0.08 0.14 0.82 -1.51 0.00 0.00 179.97 179.59 3geb h ILE 304 N 0.12 1.18 -0.42 1.20 2.04 -1.22 -1.89 117.51 118.52 3geb h ILE 304 Ca 0.03 -0.56 0.08 0.00 1.00 0.00 0.00 64.86 65.41 3geb h ILE 304 Cb -0.01 0.92 -0.07 0.00 -0.74 0.00 0.00 36.82 36.92 3geb h ILE 304 CO -0.01 0.20 0.02 1.23 0.00 0.00 0.00 178.15 179.59 3geb h GLY 305 N 0.40 0.44 1.40 5.37 0.00 -0.74 -1.67 103.07 108.28 3geb h GLY 305 Ca 0.11 0.04 -0.10 0.00 0.00 0.00 0.00 47.33 47.38 3geb h GLY 305 CO -0.01 -0.10 -0.16 1.41 0.00 0.00 0.00 176.54 177.68 3geb h LEU 306 N 0.13 0.70 -0.78 3.11 3.38 -1.10 -1.52 115.31 119.22 3geb h LEU 306 Ca 0.21 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3geb h LEU 306 Cb 0.30 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3geb h LEU 306 CO -0.33 0.87 0.01 0.24 0.09 0.00 0.00 178.44 179.31 3geb h MET 307 N 0.63 0.93 -0.16 1.13 2.86 -0.85 -0.84 114.93 118.63 3geb h MET 307 Ca 0.10 -0.27 -0.04 0.00 -2.06 0.00 0.00 59.70 57.44 3geb h MET 307 Cb 0.63 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 3geb h MET 307 CO 0.04 0.92 -0.04 1.98 1.06 0.00 0.00 176.91 180.87 3geb h MET 308 N 0.86 0.32 -0.31 1.72 4.05 -1.17 -2.08 114.93 118.33 3geb h MET 308 Ca 0.16 -0.12 0.07 0.00 -0.28 0.00 0.00 59.70 59.53 3geb h MET 308 Cb 0.49 -0.02 -0.08 0.00 -0.80 0.00 0.00 31.60 31.20 3geb h MET 308 CO 0.02 0.59 -0.23 1.49 0.23 0.00 0.00 176.91 179.01 3geb h GLU 309 N 0.02 -0.20 -0.78 0.39 4.81 -1.00 0.15 114.58 117.98 3geb h GLU 309 Ca 0.04 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.35 3geb h GLU 309 Cb 0.47 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.85 3geb h GLU 309 CO 0.02 -0.13 0.51 1.49 -0.73 0.00 0.00 179.01 180.16 3geb h GLU 310 N -0.21 0.81 -0.33 1.92 4.57 -1.06 -2.08 114.58 118.20 3geb h GLU 310 Ca 0.16 -0.05 -0.16 0.00 -1.18 0.00 0.00 59.36 58.13 3geb h GLU 310 Cb 0.46 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 3geb h GLU 310 CO -0.43 0.54 -0.44 0.52 -1.18 0.00 0.00 179.01 178.02 3geb h MET 311 N 0.83 0.85 -0.29 1.92 2.86 -0.31 -1.13 114.93 119.65 3geb h MET 311 Ca 0.34 -0.47 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 3geb h MET 311 Cb 0.24 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 3geb h MET 311 CO -0.12 1.11 0.15 0.82 1.06 0.00 0.00 176.91 179.93 3geb h ILE 312 N 0.68 1.14 0.00 -1.22 2.04 -0.14 -1.58 117.51 118.44 3geb h ILE 312 Ca 0.04 -0.40 -0.19 0.00 1.00 0.00 0.00 64.86 65.31 3geb h ILE 312 Cb 1.02 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 3geb h ILE 312 CO 0.10 0.15 -0.89 -0.26 0.00 0.00 0.00 178.15 177.25 3geb h PHE 313 N 0.35 0.03 -0.22 1.37 0.05 -1.43 -1.56 116.94 115.54 3geb h PHE 313 Ca 0.10 -0.02 -0.05 0.00 3.82 0.00 0.00 57.97 61.82 3geb h PHE 313 Cb 0.10 -0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.04 3geb h PHE 313 CO -0.02 0.90 -0.06 -0.97 -0.18 0.00 0.00 178.31 177.98 3geb h ASN 314 N 0.01 0.43 -0.73 2.17 -0.73 -1.15 0.15 115.58 115.74 3geb h ASN 314 Ca -0.01 -0.37 -0.05 0.00 1.87 0.00 0.00 56.30 57.74 3geb h ASN 314 Cb 1.57 -0.12 -0.03 0.00 0.27 0.00 0.00 38.32 40.01 3geb h ASN 314 CO 0.12 0.70 0.28 0.25 -0.37 0.00 0.00 177.43 178.41 3geb h LEU 315 N 0.16 1.02 -0.75 0.34 6.46 -1.29 0.11 115.31 121.35 3geb h LEU 315 Ca 0.06 -0.18 -0.05 0.00 -0.12 0.00 0.00 57.88 57.59 3geb h LEU 315 Cb 0.52 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.15 3geb h LEU 315 CO 0.02 0.92 0.29 0.00 -0.62 0.00 0.00 178.44 179.05 3geb h ALA 316 N 1.14 0.98 0.05 1.25 0.00 -0.96 0.35 119.26 122.06 3geb h ALA 316 Ca 0.24 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 3geb h ALA 316 Cb 0.23 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.74 3geb h ALA 316 CO -0.02 0.62 -0.46 -0.44 0.00 0.00 0.00 179.25 178.95 3geb h ASP 317 N 1.10 0.32 -0.54 0.00 3.32 -0.49 -1.68 116.42 118.44 3geb h ASP 317 Ca 0.25 -0.87 -0.08 0.00 0.02 0.00 0.00 57.03 56.35 3geb h ASP 317 Cb 0.23 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 3geb h ASP 317 CO -0.02 1.16 0.04 0.74 -1.72 0.00 0.00 179.24 179.45 3geb h THR 318 N -0.47 1.26 0.00 0.35 2.02 -0.78 -3.37 112.91 111.92 3geb h THR 318 Ca -0.07 -1.04 0.00 0.00 0.77 0.00 0.00 66.41 66.07 3geb h THR 318 Cb 1.27 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 3geb h THR 318 CO 0.09 0.37 -0.07 1.41 0.37 0.00 0.00 175.52 177.69 3geb n HIS 319 N -4.31 0.00 -1.38 3.16 8.25 0.10 -4.77 115.22 116.27 3geb n HIS 319 Ca 0.02 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.52 3geb n HIS 319 Cb 0.30 -0.00 0.20 0.00 1.12 0.00 0.00 29.99 31.60 3geb n HIS 319 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3geb n LEU 320 N -1.03 3.17 -3.77 2.41 4.77 -0.70 -4.92 117.00 116.92 3geb n LEU 320 Ca 0.00 -3.60 -0.29 0.00 -0.03 0.00 0.00 56.01 52.09 3geb n LEU 320 Cb 0.01 -0.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.54 3geb n LEU 320 CO 0.01 1.13 -0.03 0.49 -1.33 0.00 0.00 177.39 177.66 3geb n PHE 321 N -1.13 -1.76 -0.09 -1.77 3.01 -1.18 -4.85 117.46 109.69 3geb n PHE 321 Ca 0.23 0.61 -0.07 0.00 1.01 0.00 0.00 57.45 59.23 3geb n PHE 321 Cb 0.80 -2.82 0.11 0.00 -0.01 0.00 0.00 39.48 37.57 3geb n PHE 321 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 3geb h PHE 322 N -1.17 0.86 -0.35 1.38 3.57 -1.56 0.33 116.94 120.00 3geb h PHE 322 Ca -0.49 -0.17 0.03 0.00 3.53 0.00 0.00 57.97 60.87 3geb h PHE 322 Cb 1.32 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.83 3geb h PHE 322 CO 0.67 0.88 0.23 -0.97 -2.23 0.00 0.00 178.31 176.89 3geb h ASN 323 N 0.69 0.29 0.01 0.41 -0.73 -1.83 0.32 115.58 114.75 3geb h ASN 323 Ca 0.11 -0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.27 3geb h ASN 323 Cb 0.65 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 39.17 3geb h ASN 323 CO 0.05 0.20 -0.01 0.44 -0.37 0.00 0.00 177.43 177.74 3geb h ASP 324 N 0.34 -0.01 0.41 1.15 3.45 -1.78 -3.39 116.42 116.58 3geb h ASP 324 Ca 0.14 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 57.55 3geb h ASP 324 Cb 0.15 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.92 3geb h ASP 324 CO -0.03 0.43 -0.24 -0.07 -1.57 0.00 0.00 179.24 177.76 3geb h LEU 325 N -0.89 0.00 -0.66 1.55 3.38 -0.26 -3.36 115.31 115.07 3geb h LEU 325 Ca -0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3geb h LEU 325 Cb 0.01 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.65 3geb h LEU 325 CO 0.00 0.24 -0.25 1.21 0.09 0.00 0.00 178.44 179.73 3geb n GLU 326 N -3.86 -0.15 -1.19 1.13 2.13 0.11 -1.08 120.64 117.74 3geb n GLU 326 Ca -0.02 1.02 -0.24 0.00 0.66 0.00 0.00 57.16 58.58 3geb n GLU 326 Cb 0.33 -1.51 -0.10 0.00 0.27 0.00 0.00 31.44 30.42 3geb n GLU 326 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3geb n ASP 327 N -4.98 6.78 -3.19 4.31 8.00 -1.26 -4.52 116.55 121.69 3geb n ASP 327 Ca 0.07 -2.58 0.02 0.00 0.71 0.00 0.00 54.79 53.01 3geb n ASP 327 Cb 0.27 -1.46 -0.01 0.00 -0.02 0.00 0.00 41.12 39.90 3geb n ASP 327 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3geb n ASP 329 N 4.56 6.15 -4.72 0.00 8.00 -1.26 -4.92 116.55 124.36 3geb n ASP 329 Ca 0.10 -2.40 -0.42 0.00 0.71 0.00 0.00 54.79 52.78 3geb n ASP 329 Cb 0.57 -1.24 -0.03 0.00 -0.02 0.00 0.00 41.12 40.39 3geb n ASP 329 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 3geb s GLN 330 N 2.97 4.47 -0.03 -1.24 0.74 -1.26 -4.69 119.66 120.62 3geb s GLN 330 Ca 0.49 1.71 -0.19 0.00 0.05 0.00 0.00 55.36 57.43 3geb s GLN 330 Cb 0.13 -3.35 -0.11 0.00 1.10 0.00 0.00 33.01 30.78 3geb s GLN 330 CO -0.04 -0.18 0.78 0.82 -0.55 0.00 0.00 175.29 176.12 3geb h ILE 331 N 4.43 0.11 -2.43 -2.34 5.03 -1.92 -3.41 117.51 116.98 3geb h ILE 331 Ca -0.42 -0.58 -0.54 0.00 -0.12 0.00 0.00 64.86 63.19 3geb h ILE 331 Cb 1.21 0.17 -0.07 0.00 -3.03 0.00 0.00 36.82 35.11 3geb h ILE 331 CO 0.79 0.02 -0.57 -2.28 -0.68 0.00 0.00 178.15 175.43 3geb s HIS 332 N -3.67 3.04 0.36 1.37 2.46 -1.26 -1.39 115.29 116.19 3geb s HIS 332 Ca -0.10 -0.10 0.10 0.00 0.47 0.00 0.00 55.06 55.43 3geb s HIS 332 Cb 0.01 -1.41 0.68 0.00 -0.13 0.00 0.00 32.58 31.73 3geb s HIS 332 CO 0.31 0.53 1.83 0.28 -2.47 0.00 0.00 174.74 175.22 3geb h VAL 333 N 1.83 1.24 -0.58 0.89 2.07 -1.86 -3.14 116.25 116.69 3geb h VAL 333 Ca -0.48 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 65.92 3geb h VAL 333 Cb 1.22 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.47 3geb h VAL 333 CO 0.61 0.34 0.00 0.47 0.02 0.00 0.00 177.57 179.01 3geb n ASP 334 N -4.16 5.39 0.30 0.57 8.00 -1.26 -4.63 116.55 120.76 3geb n ASP 334 Ca -0.01 -2.80 0.19 0.00 0.71 0.00 0.00 54.79 52.88 3geb n ASP 334 Cb 0.37 -0.65 0.88 0.00 -0.02 0.00 0.00 41.12 41.70 3geb n ASP 334 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3geb h ASP 335 N 3.93 0.00 -0.03 -2.24 3.32 -1.97 -2.80 116.42 116.63 3geb h ASP 335 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3geb h ASP 335 Cb 1.81 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.35 3geb h ASP 335 CO 0.41 0.01 -0.26 1.33 -1.72 0.00 0.00 179.24 179.01 3geb n VAL 336 N -3.12 2.10 0.99 -1.35 0.24 -1.26 -4.72 118.33 111.21 3geb n VAL 336 Ca -0.01 -2.78 0.07 0.00 -2.04 0.00 0.00 64.34 59.58 3geb n VAL 336 Cb 0.22 -0.24 0.44 0.00 -1.47 0.00 0.00 33.84 32.78 3geb n VAL 336 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3geb n SER 337 N -1.23 0.00 -0.08 -1.34 3.41 -1.06 -2.62 113.62 110.71 3geb n SER 337 Ca 0.19 -0.53 -0.09 0.00 -0.26 0.00 0.00 58.87 58.18 3geb n SER 337 Cb 0.69 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.71 3geb n SER 337 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3geb h SER 338 N 0.00 0.79 -0.62 4.04 0.02 -1.84 -3.09 113.55 112.85 3geb h SER 338 Ca 0.00 -0.32 -0.26 0.00 -0.84 0.00 0.00 61.79 60.38 3geb h SER 338 Cb 0.00 -0.22 -0.15 0.00 0.14 0.00 0.00 62.40 62.17 3geb h SER 338 CO 0.00 1.03 0.33 0.47 -1.14 0.00 0.00 176.83 177.52 3geb n ASP 339 N -4.08 3.79 -4.38 3.07 8.00 -1.08 -4.89 116.55 116.99 3geb n ASP 339 Ca -0.01 -3.00 -0.35 0.00 0.71 0.00 0.00 54.79 52.14 3geb n ASP 339 Cb 0.47 -0.71 -0.13 0.00 -0.02 0.00 0.00 41.12 40.73 3geb n ASP 339 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3geb s ASP 340 N -0.61 4.63 0.00 -2.24 3.68 -1.17 -4.25 116.67 116.71 3geb s ASP 340 Ca 0.40 -0.30 0.25 0.00 2.13 0.00 0.00 52.55 55.03 3geb s ASP 340 Cb 0.33 -1.80 1.22 0.00 -1.45 0.00 0.00 42.92 41.21 3geb s ASP 340 CO 0.09 0.00 1.81 -0.46 0.13 0.00 0.00 175.17 176.75 3geb n ASN 341 N 4.65 0.71 -0.39 -0.34 0.23 -1.26 -4.91 115.26 113.95 3geb n ASN 341 Ca -0.17 -1.40 -0.05 0.00 -0.53 0.00 0.00 54.58 52.43 3geb n ASN 341 Cb 0.51 -0.02 -0.02 0.00 -2.08 0.00 0.00 39.78 38.17 3geb n ASN 341 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3geb n GLY 342 N 1.00 0.62 3.46 4.83 0.00 -1.26 -4.98 105.19 108.86 3geb n GLY 342 Ca 0.18 -0.11 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 3geb n GLY 342 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3geb s GLN 343 N -2.04 -1.63 -0.05 1.61 -2.07 -1.26 -4.96 119.66 109.25 3geb s GLN 343 Ca 0.00 0.32 -0.25 0.00 -1.82 0.00 0.00 55.36 53.61 3geb s GLN 343 Cb 0.00 -1.51 -0.03 0.00 -1.09 0.00 0.00 33.01 30.37 3geb s GLN 343 CO 0.00 -4.07 0.77 0.34 -1.32 0.00 0.00 175.29 171.02 3geb s ASP 344 N -3.17 7.08 0.00 12.60 2.15 -1.26 -4.95 116.67 129.12 3geb s ASP 344 Ca 0.69 1.30 0.22 0.00 0.43 0.00 0.00 52.55 55.18 3geb s ASP 344 Cb -0.16 -2.45 0.48 0.00 -0.30 0.00 0.00 42.92 40.49 3geb s ASP 344 CO 0.59 -0.16 1.42 0.18 -0.17 0.00 0.00 175.17 177.04 3geb n LEU 345 N 3.85 3.56 -0.02 -1.34 4.77 -1.26 -4.50 117.00 122.06 3geb n LEU 345 Ca 0.01 -1.71 -0.09 0.00 -0.03 0.00 0.00 56.01 54.19 3geb n LEU 345 Cb 0.51 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 3geb n LEU 345 CO 0.48 0.82 0.70 0.28 -1.33 0.00 0.00 177.39 178.34 3geb h SER 346 N 4.14 -0.77 -0.24 -1.43 0.02 -2.04 -2.85 113.55 110.39 3geb h SER 346 Ca 0.00 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3geb h SER 346 Cb 0.95 0.35 0.00 0.00 0.14 0.00 0.00 62.40 63.84 3geb h SER 346 CO 0.00 -0.29 0.00 0.35 -1.14 0.00 0.00 176.83 175.75 3geb n THR 347 N -5.37 0.30 -2.10 -2.27 -2.24 -1.26 -4.98 114.28 96.35 3geb n THR 347 Ca -0.02 -0.65 -0.41 0.00 -2.27 0.00 0.00 64.05 60.70 3geb n THR 347 Cb 0.29 1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 69.68 3geb n THR 347 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3geb s TYR 348 N -1.65 3.06 -0.50 4.78 5.04 -1.08 -4.99 117.35 122.01 3geb s TYR 348 Ca 0.33 1.32 -0.12 0.00 -2.44 0.00 0.00 57.07 56.16 3geb s TYR 348 Cb 0.21 -3.70 0.12 0.00 0.35 0.00 0.00 41.96 38.94 3geb s TYR 348 CO 0.30 -2.02 0.40 1.21 -1.34 0.00 0.00 175.55 174.10 3geb s ASN 349 N -0.24 5.90 0.16 4.32 2.47 -1.26 -4.94 114.94 121.35 3geb s ASN 349 Ca 0.52 -1.84 -0.01 0.00 0.42 0.00 0.00 52.86 51.94 3geb s ASN 349 Cb -0.40 -2.09 0.01 0.00 -1.45 0.00 0.00 41.25 37.32 3geb s ASN 349 CO 0.50 -0.75 1.39 -0.26 -3.72 0.00 0.00 177.10 174.25 3geb h PHE 350 N 8.63 0.49 0.13 0.43 -1.00 -1.97 -3.35 116.94 120.29 3geb h PHE 350 Ca -0.25 -0.24 0.00 0.00 2.81 0.00 0.00 57.97 60.29 3geb h PHE 350 Cb 1.08 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.56 3geb h PHE 350 CO 0.67 1.03 -0.31 0.66 -1.61 0.00 0.00 178.31 178.75 3geb h SER 351 N 0.21 -0.91 -3.25 2.17 4.64 -1.96 -3.32 113.55 111.13 3geb h SER 351 Ca -0.05 0.09 -0.75 0.00 -0.47 0.00 0.00 61.79 60.61 3geb h SER 351 Cb 1.43 0.33 -0.23 0.00 -0.31 0.00 0.00 62.40 63.61 3geb h SER 351 CO 0.14 -0.35 0.06 0.00 -0.87 0.00 0.00 176.83 175.81 3geb s ALA 352 N -4.80 3.73 0.00 5.18 0.00 -1.25 -4.52 121.76 120.09 3geb s ALA 352 Ca -0.10 -2.77 0.00 0.00 0.00 0.00 0.00 51.96 49.09 3geb s ALA 352 Cb 0.03 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.67 3geb s ALA 352 CO 0.36 -2.27 0.00 -0.40 0.00 0.00 0.00 175.76 173.44 3geb n ASP 353 N 5.15 0.00 0.00 0.00 3.85 -1.25 -4.89 116.55 119.41 3geb n ASP 353 Ca 0.00 -0.68 0.00 0.00 -0.71 0.00 0.00 54.79 53.41 3geb n ASP 353 Cb 0.44 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.21 3geb n ASP 353 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3geb n GLY 354 N 0.00 2.63 2.70 6.12 0.00 -1.26 -5.11 105.19 110.27 3geb n GLY 354 Ca 0.00 -1.63 -0.07 0.00 0.00 0.00 0.00 46.02 44.32 3geb n GLY 354 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3geb n PHE 355 N 1.12 -2.40 0.00 1.61 1.16 -1.26 -5.04 117.46 112.65 3geb n PHE 355 Ca 0.00 -1.87 0.00 0.00 -1.87 0.00 0.00 57.45 53.71 3geb n PHE 355 Cb 0.00 1.59 0.00 0.00 -1.61 0.00 0.00 39.48 39.46 3geb n PHE 355 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3geb n GLY 372 N -0.43 -0.91 1.89 4.97 0.00 -1.26 -5.16 105.19 104.29 3geb n GLY 372 Ca -0.03 -1.62 -0.01 0.00 0.00 0.00 0.00 46.02 44.36 3geb n GLY 372 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3geb n GLY 373 N -0.67 -1.01 2.03 -0.02 0.00 -1.26 -4.91 105.19 99.36 3geb n GLY 373 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3geb n GLY 373 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3geb n VAL 374 N -0.17 0.00 0.54 1.61 0.31 -1.26 -4.64 118.33 114.72 3geb n VAL 374 Ca -0.11 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.34 3geb n VAL 374 Cb 0.54 -0.25 0.10 0.00 -0.91 0.00 0.00 33.84 33.32 3geb n VAL 374 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3geb n ASP 375 N -2.77 0.66 0.10 4.52 2.03 -1.26 -3.16 116.55 116.68 3geb n ASP 375 Ca 0.00 -0.01 -0.19 0.00 0.52 0.00 0.00 54.79 55.12 3geb n ASP 375 Cb 0.00 0.45 -0.12 0.00 -0.72 0.00 0.00 41.12 40.72 3geb n ASP 375 CO 0.00 0.00 0.00 -0.25 -1.92 0.00 0.00 177.20 175.03 3geb h TRP 376 N 0.00 0.74 -0.16 -0.67 7.01 -1.91 -3.19 115.95 117.77 3geb h TRP 376 Ca 0.00 -0.50 0.00 0.00 2.11 0.00 0.00 58.89 60.50 3geb h TRP 376 Cb 0.75 -0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.76 3geb h TRP 376 CO 0.00 1.36 0.10 0.52 -2.79 0.00 0.00 178.44 177.63 3geb h MET 377 N 0.16 0.21 0.00 2.65 2.86 -1.81 -1.23 114.93 117.78 3geb h MET 377 Ca -0.16 -0.01 -0.13 0.00 -2.06 0.00 0.00 59.70 57.33 3geb h MET 377 Cb 1.93 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 33.52 3geb h MET 377 CO 0.22 0.15 -0.64 0.00 1.06 0.00 0.00 176.91 177.70 3geb h ARG 378 N 0.22 0.00 0.00 1.72 3.08 -1.59 -2.65 114.38 115.16 3geb h ARG 378 Ca 0.06 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.98 3geb h ARG 378 Cb -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3geb h ARG 378 CO -0.01 0.64 -0.59 0.87 -1.07 0.00 0.00 179.97 179.80 3geb h LYS 379 N 0.00 0.00 0.59 0.04 1.57 -1.26 -2.55 116.57 114.96 3geb h LYS 379 Ca -0.01 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3geb h LYS 379 Cb 1.14 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.45 3geb h LYS 379 CO 0.08 0.59 -0.28 1.25 -0.57 0.00 0.00 179.45 180.53 3geb h LEU 380 N 0.00 -0.67 -1.29 2.94 6.46 -1.25 -2.72 115.31 118.78 3geb h LEU 380 Ca -0.01 0.02 0.27 0.00 -0.12 0.00 0.00 57.88 58.05 3geb h LEU 380 Cb 1.27 0.17 -0.10 0.00 -0.73 0.00 0.00 40.66 41.27 3geb h LEU 380 CO 0.08 -0.31 0.66 0.00 -0.62 0.00 0.00 178.44 178.25 3geb h ALA 381 N -1.31 2.17 -0.71 1.25 0.00 -1.54 0.35 119.26 119.47 3geb h ALA 381 Ca -0.08 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3geb h ALA 381 Cb 0.60 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 3geb h ALA 381 CO 0.13 -0.61 0.34 0.74 0.00 0.00 0.00 179.25 179.85 3geb h PHE 382 N 0.41 1.04 -0.43 0.00 0.05 -1.36 0.24 116.94 116.88 3geb h PHE 382 Ca 0.62 -0.05 -0.12 0.00 3.82 0.00 0.00 57.97 62.24 3geb h PHE 382 Cb 1.52 -0.32 -0.01 0.00 2.00 0.00 0.00 35.95 39.13 3geb h PHE 382 CO -0.00 0.77 -0.19 0.00 -0.18 0.00 0.00 178.31 178.71 3geb h ARG 383 N 1.00 0.89 -0.13 1.51 3.08 -0.02 -1.09 114.38 119.62 3geb h ARG 383 Ca 0.24 -0.38 -0.16 0.00 0.07 0.00 0.00 59.98 59.76 3geb h ARG 383 Cb 0.13 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3geb h ARG 383 CO -0.03 1.03 -0.59 1.88 -1.07 0.00 0.00 179.97 181.19 3geb h TYR 384 N 0.72 0.54 -0.09 3.04 -1.99 -1.05 0.04 116.97 118.17 3geb h TYR 384 Ca 0.10 -0.20 -0.14 0.00 2.00 0.00 0.00 58.73 60.49 3geb h TYR 384 Cb 0.75 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 39.37 3geb h TYR 384 CO 0.05 0.91 -0.56 -0.09 -0.00 0.00 0.00 178.16 178.47 3geb h ARG 385 N 0.32 0.29 -0.03 4.88 2.43 -0.91 -1.78 114.38 119.58 3geb h ARG 385 Ca -0.00 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 58.89 3geb h ARG 385 Cb 1.12 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.68 3geb h ARG 385 CO 0.10 0.78 -0.41 -0.09 -1.51 0.00 0.00 179.97 178.84 3geb h ARG 386 N 0.22 0.05 -0.18 0.20 9.65 -0.87 -1.33 114.38 122.12 3geb h ARG 386 Ca 0.00 -0.02 -0.05 0.00 -1.10 0.00 0.00 59.98 58.81 3geb h ARG 386 Cb 1.06 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.63 3geb h ARG 386 CO 0.09 0.46 -0.09 0.28 2.80 0.00 0.00 179.97 183.51 3geb h VAL 387 N 0.05 1.31 -0.91 0.20 2.07 -0.63 -2.43 116.25 115.91 3geb h VAL 387 Ca 0.00 -1.13 0.09 0.00 0.82 0.00 0.00 66.70 66.48 3geb h VAL 387 Cb 0.74 1.67 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 3geb h VAL 387 CO 0.06 0.34 0.56 0.50 0.02 0.00 0.00 177.57 179.04 3geb h LYS 388 N 0.07 0.92 -0.38 1.57 3.64 -0.87 -1.37 116.57 120.14 3geb h LYS 388 Ca 0.04 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 3geb h LYS 388 Cb 0.56 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 3geb h LYS 388 CO 0.03 0.61 -0.17 0.93 -2.27 0.00 0.00 179.45 178.58 3geb h GLU 389 N 0.95 0.71 -0.43 1.90 5.08 -1.14 -1.60 114.58 120.05 3geb h GLU 389 Ca 0.43 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.48 3geb h GLU 389 Cb 0.33 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 3geb h GLU 389 CO -0.23 0.83 0.06 0.52 -1.00 0.00 0.00 179.01 179.20 3geb h MET 390 N 0.63 0.73 0.67 2.33 2.86 -0.84 -1.47 114.93 119.84 3geb h MET 390 Ca 0.10 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 3geb h MET 390 Cb 0.64 -0.08 0.01 0.00 0.06 0.00 0.00 31.60 32.22 3geb h MET 390 CO 0.05 0.76 -0.32 -0.92 1.06 0.00 0.00 176.91 177.54 3geb h TYR 391 N 0.58 -0.83 -0.58 -0.22 3.20 -1.14 -0.16 116.97 117.82 3geb h TYR 391 Ca 0.13 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 3geb h TYR 391 Cb 0.40 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 3geb h TYR 391 CO 0.03 -0.50 0.22 -0.91 -1.64 0.00 0.00 178.16 175.36 3geb h ASN 392 N -0.94 0.77 1.79 -2.11 2.35 -1.28 0.68 115.58 116.85 3geb h ASN 392 Ca -0.09 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.52 3geb h ASN 392 Cb 0.70 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 3geb h ASN 392 CO 0.15 0.70 -0.18 0.71 -1.65 0.00 0.00 177.43 177.17 3geb h THR 393 N 0.83 0.31 -0.01 2.81 1.35 -1.23 -3.35 112.91 113.62 3geb h THR 393 Ca 0.20 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 64.64 3geb h THR 393 Cb 0.18 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3geb h THR 393 CO -0.02 0.17 0.00 -1.22 -0.25 0.00 0.00 175.52 174.21 3geb n TYR 394 N -3.15 0.00 0.18 4.73 4.02 -0.08 -4.59 117.16 118.28 3geb n TYR 394 Ca 0.03 -0.01 0.18 0.00 -0.01 0.00 0.00 57.90 58.10 3geb n TYR 394 Cb 0.60 -0.00 0.81 0.00 -0.02 0.00 0.00 39.34 40.73 3geb n TYR 394 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 3geb h LYS 395 N 0.84 0.00 -0.17 -0.72 2.10 0.23 0.56 116.57 119.42 3geb h LYS 395 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3geb h LYS 395 Cb 0.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 3geb h LYS 395 CO 0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 3geb n ASN 396 N -3.73 2.32 -3.03 7.07 3.02 -1.26 -4.20 115.26 115.44 3geb n ASN 396 Ca 0.03 -1.78 -0.15 0.00 -0.03 0.00 0.00 54.58 52.65 3geb n ASN 396 Cb 0.41 -0.11 0.01 0.00 -0.61 0.00 0.00 39.78 39.48 3geb n ASN 396 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3geb n ASN 397 N 0.27 -0.31 0.28 6.41 5.15 0.09 -4.93 115.26 122.21 3geb n ASN 397 Ca 0.07 -3.24 0.17 0.00 -0.60 0.00 0.00 54.58 50.98 3geb n ASN 397 Cb 0.31 0.28 0.70 0.00 -0.53 0.00 0.00 39.78 40.54 3geb n ASN 397 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 3geb h VAL 398 N 1.73 0.00 0.00 3.44 2.07 -1.54 -2.24 116.25 119.70 3geb h VAL 398 Ca 0.03 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 3geb h VAL 398 Cb 1.01 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 32.27 3geb h VAL 398 CO 0.37 0.00 -0.10 1.23 0.02 0.00 0.00 177.57 179.09 3geb h GLY 399 N 2.01 0.00 1.60 2.17 0.00 -1.92 -2.28 103.07 104.65 3geb h GLY 399 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 3geb h GLY 399 CO 0.00 0.00 -0.73 -1.33 0.00 0.00 0.00 176.54 174.48 3geb h GLY 400 N 3.21 0.00 0.58 4.60 0.00 -1.75 -1.37 103.07 108.35 3geb h GLY 400 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 3geb h GLY 400 CO 0.01 0.00 -0.61 -2.00 0.00 0.00 0.00 176.54 173.94 3geb h LEU 401 N 0.00 0.39 -0.50 3.11 5.85 -1.46 -3.33 115.31 119.37 3geb h LEU 401 Ca -0.05 -0.92 -0.12 0.00 0.84 0.00 0.00 57.88 57.64 3geb h LEU 401 Cb 1.33 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 3geb h LEU 401 CO 0.04 1.27 -0.57 0.40 -0.34 0.00 0.00 178.44 179.24 3geb h ILE 402 N -0.44 1.15 -0.65 4.05 5.03 -1.52 -3.50 117.51 121.63 3geb h ILE 402 Ca -0.10 -2.17 0.00 0.00 -0.12 0.00 0.00 64.86 62.46 3geb h ILE 402 Cb 1.44 2.27 0.00 0.00 -3.03 0.00 0.00 36.82 37.50 3geb h ILE 402 CO 0.12 0.56 0.00 0.61 -0.68 0.00 0.00 178.15 178.76 3geb n GLY 403 N 0.69 -1.71 3.61 5.37 0.00 -0.51 -4.56 105.19 108.08 3geb n GLY 403 Ca 0.00 -1.28 -0.32 0.00 0.00 0.00 0.00 46.02 44.42 3geb n GLY 403 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3geb s THR 404 N 0.00 3.68 -2.14 2.61 2.01 -1.26 0.60 115.64 121.14 3geb s THR 404 Ca 0.00 -0.85 0.17 0.00 0.31 0.00 0.00 61.69 61.32 3geb s THR 404 Cb 0.00 -2.63 0.41 0.00 0.01 0.00 0.00 72.50 70.28 3geb s THR 404 CO 0.00 0.33 1.48 -0.81 -0.69 0.00 0.00 174.62 174.94 3geb n PRO 405 N 1.34 1.51 -0.25 4.92 -0.04 -1.26 -4.88 135.00 136.34 3geb n PRO 405 Ca -0.15 -0.78 -0.03 0.00 -0.04 0.00 0.00 63.50 62.51 3geb n PRO 405 Cb 0.52 -1.31 0.08 0.00 -0.04 0.00 0.00 33.50 32.75 3geb n PRO 405 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3geb h LYS 406 N 1.48 0.83 -0.73 0.54 1.79 -1.78 -2.01 116.57 116.69 3geb h LYS 406 Ca 0.00 -0.05 0.08 0.00 -2.18 0.00 0.00 60.65 58.50 3geb h LYS 406 Cb 0.33 -0.19 -0.06 0.00 -1.58 0.00 0.00 32.23 30.73 3geb h LYS 406 CO 0.00 0.55 0.40 -0.09 -1.08 0.00 0.00 179.45 179.22 3geb h ARG 407 N 0.85 0.68 -0.33 3.15 2.43 -0.09 -1.06 114.38 120.02 3geb h ARG 407 Ca 0.29 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.32 3geb h ARG 407 Cb 0.04 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 3geb h ARG 407 CO -0.12 0.45 -0.16 0.93 -1.51 0.00 0.00 179.97 179.56 3geb h GLU 408 N 0.70 0.69 0.00 0.20 3.07 -1.64 -1.92 114.58 115.67 3geb h GLU 408 Ca 0.34 -0.30 -0.02 0.00 -0.50 0.00 0.00 59.36 58.88 3geb h GLU 408 Cb 0.28 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.17 3geb h GLU 408 CO -0.22 0.90 -0.09 0.00 -1.40 0.00 0.00 179.01 178.19 3geb h THR 409 N 0.45 0.27 -0.03 1.13 1.03 -1.08 -2.81 112.91 111.88 3geb h THR 409 Ca 0.07 -0.68 -0.05 0.00 -0.01 0.00 0.00 66.41 65.74 3geb h THR 409 Cb 0.69 1.53 0.00 0.00 -1.07 0.00 0.00 68.15 69.30 3geb h THR 409 CO 0.05 0.09 -0.19 -0.25 -0.01 0.00 0.00 175.52 175.20 3geb h TRP 410 N 0.00 0.25 -0.16 0.00 7.01 -0.95 -1.79 115.95 120.30 3geb h TRP 410 Ca -0.00 -0.12 -0.02 0.00 2.11 0.00 0.00 58.89 60.86 3geb h TRP 410 Cb 0.52 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 27.54 3geb h TRP 410 CO 0.00 0.85 -0.01 -0.07 -2.79 0.00 0.00 178.44 176.42 3geb h LEU 411 N -0.42 0.21 -0.25 0.65 3.38 -1.24 -0.10 115.31 117.54 3geb h LEU 411 Ca -0.02 -0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.72 3geb h LEU 411 Cb 0.88 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3geb h LEU 411 CO 0.04 0.27 -0.76 1.56 0.09 0.00 0.00 178.44 179.64 3geb h GLN 412 N 0.23 0.65 -0.09 1.13 4.20 -1.51 -2.80 115.11 116.93 3geb h GLN 412 Ca 0.06 -0.53 -0.02 0.00 0.06 0.00 0.00 58.65 58.22 3geb h GLN 412 Cb 0.18 0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 3geb h GLN 412 CO 0.00 1.15 -0.01 1.25 -0.67 0.00 0.00 178.83 180.55 3geb h LEU 413 N 0.44 0.16 -2.26 1.46 5.85 -0.60 -1.98 115.31 118.38 3geb h LEU 413 Ca -0.04 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.36 3geb h LEU 413 Cb 1.37 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.35 3geb h LEU 413 CO 0.15 0.46 0.11 0.03 -0.34 0.00 0.00 178.44 178.85 3geb h ARG 414 N -0.15 0.00 -0.03 1.25 2.47 -1.08 0.34 114.38 117.18 3geb h ARG 414 Ca 0.02 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.49 3geb h ARG 414 Cb 0.39 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.72 3geb h ARG 414 CO 0.01 0.00 -0.97 0.00 0.56 0.00 0.00 179.97 179.57 3geb h ALA 415 N 1.88 0.23 -0.01 0.04 0.00 -1.18 -1.13 119.26 119.09 3geb h ALA 415 Ca 0.05 -0.68 -0.22 0.00 0.00 0.00 0.00 54.91 54.06 3geb h ALA 415 Cb 0.27 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3geb h ALA 415 CO -0.00 0.72 -0.91 0.93 0.00 0.00 0.00 179.25 179.99 3geb h GLU 416 N 0.38 0.37 -0.41 0.00 5.08 -0.55 -2.95 114.58 116.49 3geb h GLU 416 Ca -0.10 -0.39 -0.05 0.00 -1.00 0.00 0.00 59.36 57.82 3geb h GLU 416 Cb 1.61 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.96 3geb h GLU 416 CO 0.19 1.07 0.07 1.25 -1.00 0.00 0.00 179.01 180.58 3geb h LEU 417 N 0.21 0.66 -0.88 1.33 5.85 -0.98 -1.34 115.31 120.16 3geb h LEU 417 Ca -0.07 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.35 3geb h LEU 417 Cb 1.54 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.36 3geb h LEU 417 CO 0.15 0.75 0.28 -0.33 -0.34 0.00 0.00 178.44 178.96 3geb h GLU 418 N 0.54 1.10 -0.09 1.25 4.39 -1.26 -1.05 114.58 119.46 3geb h GLU 418 Ca 0.13 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 3geb h GLU 418 Cb 0.37 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 3geb h GLU 418 CO 0.01 0.90 0.03 0.00 -1.16 0.00 0.00 179.01 178.79 3geb h ALA 419 N 1.23 0.12 -0.69 3.43 0.00 -1.38 0.89 119.26 122.86 3geb h ALA 419 Ca 0.25 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3geb h ALA 419 Cb 0.22 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3geb h ALA 419 CO -0.02 -0.26 0.20 1.25 0.00 0.00 0.00 179.25 180.42 3geb h LEU 420 N -0.04 1.01 -0.73 0.00 6.46 -1.10 -2.79 115.31 118.12 3geb h LEU 420 Ca 0.03 -0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.60 3geb h LEU 420 Cb 0.22 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 39.89 3geb h LEU 420 CO -0.00 0.95 0.00 0.35 -0.62 0.00 0.00 178.44 179.12 3geb n THR 421 N -4.25 0.25 -3.98 1.05 -2.24 -0.41 -4.89 114.28 99.81 3geb n THR 421 Ca 0.05 -0.26 -0.31 0.00 -2.27 0.00 0.00 64.05 61.27 3geb n THR 421 Cb 0.23 0.13 0.01 0.00 -2.10 0.00 0.00 70.33 68.60 3geb n THR 421 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3geb n ASP 422 N 0.06 -3.79 -3.20 3.42 8.00 -1.01 -2.34 116.55 117.69 3geb n ASP 422 Ca 0.08 -0.86 -0.19 0.00 0.71 0.00 0.00 54.79 54.53 3geb n ASP 422 Cb 0.18 -3.55 0.07 0.00 -0.02 0.00 0.00 41.12 37.80 3geb n ASP 422 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3geb n LEU 423 N -4.56 -3.47 0.03 0.64 4.77 0.28 -4.95 117.00 109.74 3geb n LEU 423 Ca -0.00 -0.51 -0.12 0.00 -0.03 0.00 0.00 56.01 55.35 3geb n LEU 423 Cb 0.54 -2.78 -0.08 0.00 -2.33 0.00 0.00 43.42 38.78 3geb n LEU 423 CO 0.78 0.48 0.81 -0.25 -1.33 0.00 0.00 177.39 177.88 3geb h TRP 424 N -2.11 -0.01 0.00 -1.77 2.91 -1.72 -2.71 115.95 110.54 3geb h TRP 424 Ca -0.51 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.49 3geb h TRP 424 Cb 1.32 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.97 3geb h TRP 424 CO 0.42 0.11 -0.07 1.25 -1.03 0.00 0.00 178.44 179.11 3geb h LEU 425 N -0.13 0.00 -0.57 0.65 5.85 -1.89 -0.62 115.31 118.60 3geb h LEU 425 Ca -0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 3geb h LEU 425 Cb 0.13 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 3geb h LEU 425 CO 0.00 0.07 0.15 0.74 -0.34 0.00 0.00 178.44 179.06 3geb h THR 426 N 0.00 1.25 -0.46 1.05 2.02 -1.86 -0.87 112.91 114.03 3geb h THR 426 Ca -0.00 -0.88 -0.11 0.00 0.77 0.00 0.00 66.41 66.20 3geb h THR 426 Cb 0.13 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 3geb h THR 426 CO 0.01 0.32 -0.12 0.45 0.37 0.00 0.00 175.52 176.55 3geb h HIS 427 N 0.81 1.02 -0.22 3.16 3.86 -0.90 -2.90 115.15 119.98 3geb h HIS 427 Ca 0.18 -0.22 -0.16 0.00 -1.16 0.00 0.00 60.37 59.01 3geb h HIS 427 Cb 0.33 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 3geb h HIS 427 CO 0.02 1.00 -0.51 0.66 0.86 0.00 0.00 177.93 179.96 3geb h SER 428 N 0.75 0.68 -0.22 2.45 4.64 -1.18 -3.09 113.55 117.57 3geb h SER 428 Ca 0.12 -0.35 -0.01 0.00 -0.47 0.00 0.00 61.79 61.08 3geb h SER 428 Cb 0.67 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 3geb h SER 428 CO 0.05 1.07 0.12 -0.07 -0.87 0.00 0.00 176.83 177.12 3geb h LEU 429 N 0.48 0.31 -1.42 5.97 3.38 -1.09 -1.67 115.31 121.26 3geb h LEU 429 Ca 0.02 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3geb h LEU 429 Cb 1.06 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 3geb h LEU 429 CO 0.10 0.27 -0.10 0.11 0.09 0.00 0.00 178.44 178.91 3geb h LYS 430 N 0.35 0.26 0.10 1.13 1.57 -1.42 -0.53 116.57 118.02 3geb h LYS 430 Ca 0.09 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.66 3geb h LYS 430 Cb 0.05 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.33 3geb h LYS 430 CO -0.01 0.37 -0.71 0.00 -0.57 0.00 0.00 179.45 178.53 3geb h ALA 431 N 1.66 -0.02 -0.94 3.86 0.00 -1.49 -3.07 119.26 119.25 3geb h ALA 431 Ca 0.05 -0.72 0.08 0.00 0.00 0.00 0.00 54.91 54.32 3geb h ALA 431 Cb 0.34 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 3geb h ALA 431 CO 0.02 0.36 0.59 -0.07 0.00 0.00 0.00 179.25 180.14 3geb h LEU 432 N -0.54 0.90 -0.00 0.00 3.38 -1.19 -0.56 115.31 117.30 3geb h LEU 432 Ca -0.14 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3geb h LEU 432 Cb 1.49 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 42.07 3geb h LEU 432 CO 0.09 0.55 -0.08 0.78 0.09 0.00 0.00 178.44 179.87 3geb h ASN 433 N 1.02 0.00 0.69 -0.43 2.35 -1.23 -2.20 115.58 115.79 3geb h ASN 433 Ca 0.42 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.91 3geb h ASN 433 Cb 0.27 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.64 3geb h ASN 433 CO -0.20 0.08 -1.20 0.25 -1.65 0.00 0.00 177.43 174.71 3geb h LEU 434 N 0.00 0.36 -0.92 1.61 5.85 -1.24 -1.58 115.31 119.39 3geb h LEU 434 Ca -0.00 -0.38 -0.08 0.00 0.84 0.00 0.00 57.88 58.26 3geb h LEU 434 Cb 1.06 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3geb h LEU 434 CO 0.01 1.30 -0.38 0.40 -0.34 0.00 0.00 178.44 179.43 3geb h ILE 435 N 0.06 0.89 0.02 4.05 2.04 -1.10 -2.38 117.51 121.09 3geb h ILE 435 Ca -0.11 -1.53 -0.06 0.00 1.00 0.00 0.00 64.86 64.15 3geb h ILE 435 Cb 1.93 1.94 0.01 0.00 -0.74 0.00 0.00 36.82 39.96 3geb h ILE 435 CO 0.19 0.37 -0.26 -1.13 0.00 0.00 0.00 178.15 177.32 3geb h ASN 436 N 0.00 0.20 1.09 1.72 -0.73 -1.28 -3.31 115.58 113.28 3geb h ASN 436 Ca -0.00 -0.84 -0.04 0.00 1.87 0.00 0.00 56.30 57.28 3geb h ASN 436 Cb 0.91 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 39.43 3geb h ASN 436 CO 0.05 1.02 -0.18 0.77 -0.37 0.00 0.00 177.43 178.72 3geb h SER 437 N -0.60 0.00 -3.24 1.15 4.64 -1.31 -3.43 113.55 110.75 3geb h SER 437 Ca -0.04 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.75 3geb h SER 437 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3geb h SER 437 CO 0.05 0.18 0.55 -0.13 -0.87 0.00 0.00 176.83 176.61 3geb s ARG 438 N -3.55 4.45 0.27 4.77 0.52 -0.90 -4.97 118.95 119.54 3geb s ARG 438 Ca 0.02 1.76 -0.04 0.00 -0.52 0.00 0.00 55.73 56.94 3geb s ARG 438 Cb 0.09 -3.34 0.34 0.00 0.52 0.00 0.00 34.95 32.56 3geb s ARG 438 CO 0.63 -0.22 1.91 -1.00 0.02 0.00 0.00 175.30 176.65 3geb h PRO 439 N 6.59 1.15 -0.60 3.54 0.13 -1.87 -3.23 132.00 137.71 3geb h PRO 439 Ca -0.42 -0.11 -0.28 0.00 -0.87 0.00 0.00 66.00 64.33 3geb h PRO 439 Cb 1.21 -0.24 -0.17 0.00 0.13 0.00 0.00 31.00 31.94 3geb h PRO 439 CO 0.80 0.81 0.21 0.09 -0.23 0.00 0.00 178.00 179.68 3geb n ASN 440 N -4.36 3.29 -4.18 1.44 3.02 -1.26 -4.94 115.26 108.26 3geb n ASN 440 Ca 0.09 -3.59 -0.23 0.00 -0.03 0.00 0.00 54.58 50.82 3geb n ASN 440 Cb 0.07 -0.71 -0.14 0.00 -0.61 0.00 0.00 39.78 38.39 3geb n ASN 440 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3geb s VAL 442 N -0.76 0.72 -0.28 0.00 1.01 -0.64 -4.74 120.40 115.73 3geb s VAL 442 Ca 0.05 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 3geb s VAL 442 Cb -0.08 -0.62 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 3geb s VAL 442 CO 0.01 0.15 0.23 0.20 0.00 0.00 0.00 175.10 175.69 3geb s ASN 443 N -0.35 6.07 0.06 3.32 0.01 -1.26 -0.13 114.94 122.67 3geb s ASN 443 Ca 0.03 0.06 0.07 0.00 -0.71 0.00 0.00 52.86 52.31 3geb s ASN 443 Cb -0.04 -2.14 -0.03 0.00 0.41 0.00 0.00 41.25 39.45 3geb s ASN 443 CO -0.00 -0.07 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.63 3geb s VAL 444 N 1.79 1.63 -0.11 1.60 1.01 0.28 -4.66 120.40 121.94 3geb s VAL 444 Ca 0.09 -1.30 0.02 0.00 0.00 0.00 0.00 61.98 60.78 3geb s VAL 444 Cb -0.16 -1.45 0.01 0.00 0.00 0.00 0.00 36.38 34.79 3geb s VAL 444 CO 0.11 0.09 -0.16 -0.22 0.00 0.00 0.00 175.10 174.91 3geb s LEU 445 N -1.43 1.79 -0.18 3.92 2.96 0.17 -0.76 118.68 125.15 3geb s LEU 445 Ca 0.06 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 3geb s LEU 445 Cb -0.09 -1.15 0.02 0.00 0.50 0.00 0.00 46.19 45.47 3geb s LEU 445 CO 0.03 0.03 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.21 3geb s VAL 446 N 0.95 1.96 -0.00 1.68 1.01 -0.44 0.39 120.40 125.94 3geb s VAL 446 Ca -0.07 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.03 3geb s VAL 446 Cb -0.15 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 3geb s VAL 446 CO -0.01 0.49 -0.09 0.28 0.00 0.00 0.00 175.10 175.76 3geb s THR 447 N 1.32 0.72 -0.24 3.92 -1.32 0.16 -4.27 115.64 115.94 3geb s THR 447 Ca 0.04 -0.43 0.28 0.00 -1.21 0.00 0.00 61.69 60.38 3geb s THR 447 Cb -0.13 -0.61 0.32 0.00 -1.51 0.00 0.00 72.50 70.56 3geb s THR 447 CO -0.12 0.18 1.83 0.71 -2.21 0.00 0.00 174.62 175.01 3geb h THR 448 N 4.89 0.00 -4.18 5.08 1.35 -1.88 0.33 112.91 118.50 3geb h THR 448 Ca -0.31 -0.43 -0.52 0.00 -0.55 0.00 0.00 66.41 64.61 3geb h THR 448 Cb 1.18 1.32 0.12 0.00 -1.73 0.00 0.00 68.15 69.04 3geb h THR 448 CO 0.49 0.00 0.38 -0.89 -0.25 0.00 0.00 175.52 175.26 3geb s THR 449 N -3.45 2.91 0.87 6.82 2.01 -1.26 -3.61 115.64 119.93 3geb s THR 449 Ca 0.04 0.44 -0.11 0.00 0.31 0.00 0.00 61.69 62.37 3geb s THR 449 Cb 0.09 -2.98 0.12 0.00 0.01 0.00 0.00 72.50 69.74 3geb s THR 449 CO 0.49 -0.25 1.11 -1.10 -0.69 0.00 0.00 174.62 174.19 3geb s GLN 450 N -3.97 1.43 0.08 4.92 -0.21 -1.26 -4.46 119.66 116.18 3geb s GLN 450 Ca 0.70 1.28 -0.30 0.00 0.02 0.00 0.00 55.36 57.06 3geb s GLN 450 Cb -0.24 -1.79 -0.16 0.00 1.00 0.00 0.00 33.01 31.82 3geb s GLN 450 CO 0.42 -2.26 1.65 1.25 -2.12 0.00 0.00 175.29 174.23 3geb h LEU 451 N -1.59 -0.61 0.37 2.90 5.85 -1.91 -0.89 115.31 119.43 3geb h LEU 451 Ca -0.45 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.29 3geb h LEU 451 Cb 1.26 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.47 3geb h LEU 451 CO 0.47 -0.40 -0.21 0.40 -0.34 0.00 0.00 178.44 178.37 3geb h ILE 452 N -0.63 0.57 -0.68 4.05 1.08 -1.93 -1.77 117.51 118.20 3geb h ILE 452 Ca -0.05 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.48 3geb h ILE 452 Cb 0.51 0.57 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 3geb h ILE 452 CO 0.05 0.00 0.45 -0.65 -0.69 0.00 0.00 178.15 177.31 3geb h PRO 453 N -0.54 0.69 -0.16 2.37 0.11 -1.93 -1.39 132.00 131.15 3geb h PRO 453 Ca -0.04 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.97 3geb h PRO 453 Cb 0.44 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.38 3geb h PRO 453 CO 0.05 0.46 -0.15 0.00 -0.21 0.00 0.00 178.00 178.15 3geb h ALA 454 N 1.63 1.46 0.19 -0.75 0.00 -0.81 -1.21 119.26 119.77 3geb h ALA 454 Ca 0.29 -0.22 -0.31 0.00 0.00 0.00 0.00 54.91 54.67 3geb h ALA 454 Cb 0.23 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.96 3geb h ALA 454 CO -0.09 0.38 -1.35 -0.07 0.00 0.00 0.00 179.25 178.12 3geb h LEU 455 N 0.24 0.72 -0.87 0.00 3.38 -0.40 -1.30 115.31 117.08 3geb h LEU 455 Ca 0.05 -0.74 -0.02 0.00 0.09 0.00 0.00 57.88 57.26 3geb h LEU 455 Cb 0.41 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 3geb h LEU 455 CO 0.02 1.57 0.48 0.00 0.09 0.00 0.00 178.44 180.60 3geb h ALA 456 N 0.33 1.11 -0.15 1.53 0.00 -1.19 0.74 119.26 121.64 3geb h ALA 456 Ca -0.20 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 3geb h ALA 456 Cb 2.05 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 3geb h ALA 456 CO 0.24 0.62 0.03 -0.22 0.00 0.00 0.00 179.25 179.92 3geb h LYS 457 N 1.21 0.24 -0.93 0.00 3.64 -1.22 0.23 116.57 119.73 3geb h LYS 457 Ca 0.31 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 3geb h LYS 457 Cb 0.02 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.77 3geb h LYS 457 CO -0.05 0.41 0.59 0.28 -2.27 0.00 0.00 179.45 178.41 3geb h VAL 458 N 0.04 1.25 -0.07 2.00 2.07 -0.84 -1.34 116.25 119.35 3geb h VAL 458 Ca 0.05 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 3geb h VAL 458 Cb 0.28 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 3geb h VAL 458 CO 0.00 0.25 -0.09 -0.07 0.02 0.00 0.00 177.57 177.68 3geb h LEU 459 N 1.28 0.20 -2.25 2.57 3.38 -0.70 0.34 115.31 120.14 3geb h LEU 459 Ca 0.34 -0.51 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 3geb h LEU 459 Cb -0.11 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3geb h LEU 459 CO -0.07 0.67 -0.00 -0.07 0.09 0.00 0.00 178.44 179.06 3geb h LEU 460 N -0.26 0.00 -2.60 1.67 3.38 -0.76 -0.92 115.31 115.81 3geb h LEU 460 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3geb h LEU 460 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 3geb h LEU 460 CO 0.02 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.33 3geb n TYR 461 N -3.09 0.79 -2.65 1.13 4.02 -0.52 -4.96 117.16 111.89 3geb n TYR 461 Ca -0.01 -0.41 -0.14 0.00 -0.01 0.00 0.00 57.90 57.33 3geb n TYR 461 Cb 0.19 -0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.52 3geb n TYR 461 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3geb n GLY 462 N 1.58 -0.08 0.04 2.72 0.00 -0.35 -4.92 105.19 104.17 3geb n GLY 462 Ca 0.22 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 46.09 3geb n GLY 462 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3geb n LEU 463 N -2.47 0.89 -0.32 0.99 4.77 0.12 -4.55 117.00 116.43 3geb n LEU 463 Ca -0.08 -0.52 0.24 0.00 -0.03 0.00 0.00 56.01 55.61 3geb n LEU 463 Cb 0.58 0.00 0.54 0.00 -2.33 0.00 0.00 43.42 42.21 3geb n LEU 463 CO 0.27 0.21 1.23 1.23 -1.33 0.00 0.00 177.39 179.01 3geb h GLY 464 N 4.01 1.05 1.77 -0.72 0.00 -1.74 -0.41 103.07 107.03 3geb h GLY 464 Ca 0.00 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 47.10 3geb h GLY 464 CO 0.00 -0.12 -0.42 1.48 0.00 0.00 0.00 176.54 177.48 3geb h SER 465 N 0.34 0.00 0.87 0.19 4.64 -1.80 -3.32 113.55 114.48 3geb h SER 465 Ca 0.58 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.79 3geb h SER 465 Cb 1.57 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.64 3geb h SER 465 CO -0.26 0.20 -1.20 1.62 -0.87 0.00 0.00 176.83 176.33 3geb h VAL 466 N 0.00 0.37 -3.60 0.95 3.04 -1.40 -3.44 116.25 112.16 3geb h VAL 466 Ca -0.01 -1.70 -0.68 0.00 -1.01 0.00 0.00 66.70 63.30 3geb h VAL 466 Cb 1.17 1.90 -0.29 0.00 -2.01 0.00 0.00 31.29 32.07 3geb h VAL 466 CO 0.02 0.21 -0.66 -0.36 -1.01 0.00 0.00 177.57 175.77 3geb s PHE 467 N -3.06 3.15 0.31 3.17 0.40 -0.67 -4.84 117.98 116.44 3geb s PHE 467 Ca -0.02 -1.28 -0.29 0.00 -0.60 0.00 0.00 56.93 54.75 3geb s PHE 467 Cb 0.09 -2.19 -0.10 0.00 0.51 0.00 0.00 43.02 41.33 3geb s PHE 467 CO 0.80 -0.66 1.30 -1.25 0.70 0.00 0.00 175.22 176.11 3geb s PRO 468 N 1.42 4.37 0.53 0.24 0.04 -1.26 -4.80 135.00 135.54 3geb s PRO 468 Ca 0.01 2.18 0.22 0.00 0.04 0.00 0.00 61.00 63.45 3geb s PRO 468 Cb -0.18 -3.09 1.38 0.00 0.04 0.00 0.00 34.50 32.65 3geb s PRO 468 CO 0.00 -0.18 2.07 0.97 0.04 0.00 0.00 177.00 179.90 3geb h ILE 469 N 3.12 0.80 0.00 0.56 2.10 -1.98 0.23 117.51 122.34 3geb h ILE 469 Ca -0.48 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.46 3geb h ILE 469 Cb 1.22 0.85 0.00 0.00 -1.09 0.00 0.00 36.82 37.80 3geb h ILE 469 CO 0.67 0.00 0.00 -0.62 -1.08 0.00 0.00 178.15 177.12 3geb n GLU 470 N -4.37 0.37 -0.30 2.19 4.71 -1.26 -2.64 120.64 119.33 3geb n GLU 470 Ca 0.04 0.08 0.10 0.00 -0.01 0.00 0.00 57.16 57.36 3geb n GLU 470 Cb 0.38 -1.50 0.26 0.00 -1.01 0.00 0.00 31.44 29.57 3geb n GLU 470 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3geb n ASN 471 N -1.21 3.61 -4.60 1.62 4.13 0.80 -4.94 115.26 114.67 3geb n ASN 471 Ca 0.11 -2.00 -0.34 0.00 1.68 0.00 0.00 54.58 54.03 3geb n ASN 471 Cb 0.13 -0.40 -0.10 0.00 -1.54 0.00 0.00 39.78 37.87 3geb n ASN 471 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3geb s ILE 472 N -1.01 4.40 -0.10 2.41 1.01 -1.08 -0.65 121.20 126.18 3geb s ILE 472 Ca 0.40 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.88 3geb s ILE 472 Cb 0.21 -2.94 0.02 0.00 0.01 0.00 0.00 42.46 39.76 3geb s ILE 472 CO 0.28 0.51 -0.10 -0.31 0.00 0.00 0.00 174.94 175.31 3geb s TYR 473 N 0.07 1.50 -0.55 3.97 1.51 0.16 -4.57 117.35 119.44 3geb s TYR 473 Ca 0.03 -0.68 -0.22 0.00 -1.01 0.00 0.00 57.07 55.19 3geb s TYR 473 Cb -0.13 -1.18 0.05 0.00 -0.11 0.00 0.00 41.96 40.60 3geb s TYR 473 CO 0.02 -0.42 0.81 0.45 -1.11 0.00 0.00 175.55 175.29 3geb s SER 474 N 1.27 6.27 -0.01 2.29 0.15 -0.49 -0.67 113.70 122.52 3geb s SER 474 Ca -0.03 -0.70 0.00 0.00 0.70 0.00 0.00 55.95 55.93 3geb s SER 474 Cb -0.14 -2.37 0.02 0.00 -1.71 0.00 0.00 66.02 61.83 3geb s SER 474 CO -0.04 -1.11 0.59 0.00 1.20 0.00 0.00 173.24 173.89 3geb n ALA 475 N 6.93 2.54 -0.27 5.45 0.00 0.11 -4.25 120.51 131.01 3geb n ALA 475 Ca -0.03 -0.06 0.02 0.00 0.00 0.00 0.00 53.44 53.38 3geb n ALA 475 Cb 0.46 -1.00 0.16 0.00 0.00 0.00 0.00 19.45 19.06 3geb n ALA 475 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3geb h THR 476 N 0.12 0.89 0.00 0.00 2.02 -1.71 -2.73 112.91 111.51 3geb h THR 476 Ca 0.00 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.93 3geb h THR 476 Cb 0.49 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.00 3geb h THR 476 CO 0.01 0.13 0.00 1.17 0.37 0.00 0.00 175.52 177.21 3geb n LYS 477 N -4.78 0.00 -0.09 6.66 3.00 -1.26 -4.67 118.16 117.01 3geb n LYS 477 Ca 0.13 0.00 0.22 0.00 -0.00 0.00 0.00 58.31 58.66 3geb n LYS 477 Cb 0.27 -0.26 0.66 0.00 0.00 0.00 0.00 35.03 35.71 3geb n LYS 477 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 3geb h THR 478 N 0.00 0.68 0.00 3.15 1.35 -1.86 -3.49 112.91 112.74 3geb h THR 478 Ca 0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 3geb h THR 478 Cb 0.00 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 67.01 3geb h THR 478 CO 0.00 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 3geb n GLY 479 N -1.64 2.27 0.07 5.82 0.00 -1.03 -4.48 105.19 106.20 3geb n GLY 479 Ca 0.14 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.08 3geb n GLY 479 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3geb h LYS 480 N 0.00 -0.07 -0.40 1.61 1.79 -1.92 -2.69 116.57 114.88 3geb h LYS 480 Ca 0.00 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 3geb h LYS 480 Cb 0.00 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 3geb h LYS 480 CO 0.00 0.02 0.17 1.05 -1.08 0.00 0.00 179.45 179.61 3geb h GLU 481 N -0.15 0.57 -0.15 3.15 4.11 -1.88 0.20 114.58 120.42 3geb h GLU 481 Ca -0.01 -0.07 -0.00 0.00 0.07 0.00 0.00 59.36 59.35 3geb h GLU 481 Cb 0.13 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3geb h GLU 481 CO 0.01 0.46 0.09 0.77 0.07 0.00 0.00 179.01 180.42 3geb h SER 482 N 0.57 0.19 -0.69 3.06 0.02 -1.76 0.02 113.55 114.95 3geb h SER 482 Ca 0.14 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 3geb h SER 482 Cb 0.10 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 3geb h SER 482 CO -0.02 0.19 0.24 0.00 -1.14 0.00 0.00 176.83 176.11 3geb h PHE 484 N 1.04 1.12 -0.23 0.00 0.05 -0.07 -0.89 116.94 117.96 3geb h PHE 484 Ca 0.23 0.01 -0.19 0.00 3.82 0.00 0.00 57.97 61.84 3geb h PHE 484 Cb 0.26 -0.37 0.00 0.00 2.00 0.00 0.00 35.95 37.84 3geb h PHE 484 CO 0.02 0.73 -0.62 1.49 -0.18 0.00 0.00 178.31 179.75 3geb h GLU 485 N 1.19 0.80 -0.43 1.51 4.81 -0.81 -2.59 114.58 119.06 3geb h GLU 485 Ca 0.32 -0.55 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 3geb h GLU 485 Cb -0.10 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 3geb h GLU 485 CO -0.06 1.17 0.25 -0.09 -0.73 0.00 0.00 179.01 179.55 3geb h ARG 486 N 0.59 0.57 -0.04 1.92 2.43 -0.88 -0.65 114.38 118.33 3geb h ARG 486 Ca -0.01 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 58.96 3geb h ARG 486 Cb 1.23 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 3geb h ARG 486 CO 0.13 0.41 -0.70 0.82 -1.51 0.00 0.00 179.97 179.12 3geb h ILE 487 N 0.59 1.44 -0.13 1.20 2.04 -1.05 -2.39 117.51 119.20 3geb h ILE 487 Ca 0.15 -2.24 -0.19 0.00 1.00 0.00 0.00 64.86 63.58 3geb h ILE 487 Cb -0.01 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 3geb h ILE 487 CO -0.03 0.65 -0.71 0.24 0.00 0.00 0.00 178.15 178.31 3geb h MET 488 N 0.13 0.59 -0.66 2.37 2.86 -0.96 -1.28 114.93 117.99 3geb h MET 488 Ca -0.02 -0.46 -0.01 0.00 -2.06 0.00 0.00 59.70 57.15 3geb h MET 488 Cb 1.24 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.96 3geb h MET 488 CO 0.10 1.08 0.37 1.96 1.06 0.00 0.00 176.91 181.49 3geb h GLN 489 N 0.42 0.90 -0.10 1.72 1.08 -1.03 0.42 115.11 118.51 3geb h GLN 489 Ca -0.03 -0.09 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 3geb h GLN 489 Cb 1.30 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 28.55 3geb h GLN 489 CO 0.13 0.65 -0.36 -0.09 -0.95 0.00 0.00 178.83 178.21 3geb h ARG 490 N 0.91 0.42 0.00 1.46 2.43 -1.17 -3.35 114.38 115.07 3geb h ARG 490 Ca 0.23 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3geb h ARG 490 Cb 0.00 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3geb h ARG 490 CO -0.04 0.94 -0.81 1.19 -1.51 0.00 0.00 179.97 179.74 3geb n PHE 491 N -4.37 0.49 0.00 2.20 3.01 -0.51 -5.08 117.46 113.20 3geb n PHE 491 Ca -0.08 0.14 0.00 0.00 1.01 0.00 0.00 57.45 58.53 3geb n PHE 491 Cb 0.52 -0.61 0.00 0.00 -0.01 0.00 0.00 39.48 39.38 3geb n PHE 491 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3geb n GLY 492 N 1.33 0.98 0.20 1.37 0.00 0.14 -4.60 105.19 104.62 3geb n GLY 492 Ca 0.02 -1.86 0.10 0.00 0.00 0.00 0.00 46.02 44.29 3geb n GLY 492 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3geb h ARG 493 N 0.00 0.00 0.00 1.61 0.11 -1.95 -3.25 114.38 110.90 3geb h ARG 493 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3geb h ARG 493 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 3geb h ARG 493 CO 0.00 0.13 0.00 1.63 0.10 0.00 0.00 179.97 181.83 3geb n LYS 494 N -3.14 0.75 -3.75 0.08 5.02 -1.26 -4.82 118.16 111.03 3geb n LYS 494 Ca 0.03 0.01 -0.31 0.00 -2.02 0.00 0.00 58.31 56.02 3geb n LYS 494 Cb 0.57 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.04 3geb n LYS 494 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3geb s ALA 495 N -2.16 3.87 -0.40 7.82 0.00 -1.23 -4.59 121.76 125.07 3geb s ALA 495 Ca 0.38 -0.69 -0.15 0.00 0.00 0.00 0.00 51.96 51.50 3geb s ALA 495 Cb 0.19 -2.01 0.01 0.00 0.00 0.00 0.00 23.12 21.31 3geb s ALA 495 CO 0.35 0.68 0.33 0.14 0.00 0.00 0.00 175.76 177.27 3geb s VAL 496 N -1.65 5.21 0.04 0.00 -7.23 0.48 -4.98 120.40 112.28 3geb s VAL 496 Ca 0.39 -0.46 -0.19 0.00 -1.81 0.00 0.00 61.98 59.91 3geb s VAL 496 Cb -0.12 -3.92 -0.06 0.00 0.56 0.00 0.00 36.38 32.83 3geb s VAL 496 CO 0.26 -0.28 0.54 -0.31 -0.31 0.00 0.00 175.10 175.00 3geb s TYR 497 N 1.84 3.76 -0.15 2.82 1.51 -1.26 -1.76 117.35 124.11 3geb s TYR 497 Ca 0.08 1.20 -0.00 0.00 -1.01 0.00 0.00 57.07 57.33 3geb s TYR 497 Cb -0.18 -2.49 0.04 0.00 -0.11 0.00 0.00 41.96 39.22 3geb s TYR 497 CO 0.11 0.54 -0.06 0.08 -1.11 0.00 0.00 175.55 175.11 3geb s VAL 498 N -0.88 1.09 -0.25 0.71 1.01 -0.48 -3.40 120.40 118.19 3geb s VAL 498 Ca 0.28 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.57 3geb s VAL 498 Cb -0.19 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 3geb s VAL 498 CO 0.17 0.21 0.50 -0.69 0.00 0.00 0.00 175.10 175.30 3geb s VAL 499 N 1.66 5.08 -0.16 2.92 1.01 0.20 -0.80 120.40 130.31 3geb s VAL 499 Ca 0.02 0.87 -0.02 0.00 0.00 0.00 0.00 61.98 62.85 3geb s VAL 499 Cb -0.14 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 3geb s VAL 499 CO -0.08 0.10 -0.10 -0.63 0.00 0.00 0.00 175.10 174.40 3geb s ILE 500 N 2.21 3.22 -0.07 2.22 1.01 -0.72 0.93 121.20 129.98 3geb s ILE 500 Ca 0.21 -0.58 -0.32 0.00 0.00 0.00 0.00 60.65 59.96 3geb s ILE 500 Cb -0.16 -2.39 0.13 0.00 0.01 0.00 0.00 42.46 40.05 3geb s ILE 500 CO 0.09 0.49 1.39 -0.83 0.00 0.00 0.00 174.94 176.08 3geb s GLY 501 N 0.69 -0.41 -0.02 6.18 0.00 -1.03 -1.73 107.32 111.01 3geb s GLY 501 Ca -0.05 0.69 0.13 0.00 0.00 0.00 0.00 44.72 45.49 3geb s GLY 501 CO 0.02 1.83 0.31 2.09 0.00 0.00 0.00 173.10 177.35 3geb n ASP 502 N -0.63 1.91 -4.96 1.64 5.75 -1.26 -0.99 116.55 118.01 3geb n ASP 502 Ca -0.06 -0.08 -0.20 0.00 -0.01 0.00 0.00 54.79 54.44 3geb n ASP 502 Cb 0.62 1.52 0.04 0.00 -1.03 0.00 0.00 41.12 42.27 3geb n ASP 502 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3geb s GLY 503 N -3.34 1.85 0.15 6.12 0.00 -1.26 -4.89 107.32 105.95 3geb s GLY 503 Ca -0.04 -1.53 -0.00 0.00 0.00 0.00 0.00 44.72 43.15 3geb s GLY 503 CO 0.53 -1.24 1.34 -0.39 0.00 0.00 0.00 173.10 173.35 3geb h VAL 504 N 0.19 1.46 -0.39 1.40 -1.51 -1.99 -3.13 116.25 112.28 3geb h VAL 504 Ca -0.40 -2.57 0.02 0.00 -1.23 0.00 0.00 66.70 62.52 3geb h VAL 504 Cb 1.29 2.46 -0.03 0.00 -2.13 0.00 0.00 31.29 32.88 3geb h VAL 504 CO 0.48 0.76 0.22 -0.08 -1.23 0.00 0.00 177.57 177.71 3geb h GLU 505 N 0.15 0.43 -0.26 5.19 4.81 -1.99 0.20 114.58 123.11 3geb h GLU 505 Ca -0.06 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 58.96 3geb h GLU 505 Cb 1.54 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.83 3geb h GLU 505 CO 0.15 0.28 -0.57 1.05 -0.73 0.00 0.00 179.01 179.19 3geb h GLU 506 N 0.44 0.85 -0.54 1.92 9.09 -1.99 -2.02 114.58 122.33 3geb h GLU 506 Ca 0.16 -0.56 -0.01 0.00 0.05 0.00 0.00 59.36 58.99 3geb h GLU 506 Cb 0.03 0.08 -0.03 0.00 -1.65 0.00 0.00 28.75 27.18 3geb h GLU 506 CO -0.08 1.19 0.28 1.49 0.05 0.00 0.00 179.01 181.94 3geb h GLU 507 N 0.62 0.77 -0.54 1.06 4.81 -1.43 0.11 114.58 119.98 3geb h GLU 507 Ca 0.00 -0.10 -0.11 0.00 -0.13 0.00 0.00 59.36 59.02 3geb h GLU 507 Cb 1.19 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 3geb h GLU 507 CO 0.13 0.61 -0.09 0.37 -0.73 0.00 0.00 179.01 179.30 3geb h GLN 508 N 0.73 1.00 0.00 1.92 5.75 -0.61 -1.76 115.11 122.14 3geb h GLN 508 Ca 0.19 -0.36 -0.07 0.00 -0.15 0.00 0.00 58.65 58.26 3geb h GLN 508 Cb 0.08 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 3geb h GLN 508 CO -0.03 1.04 -0.35 0.78 -2.65 0.00 0.00 178.83 177.62 3geb h GLY 509 N 0.95 0.00 1.32 2.39 0.00 -1.17 -1.98 103.07 104.59 3geb h GLY 509 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.28 3geb h GLY 509 CO 0.04 0.00 -0.66 0.00 0.00 0.00 0.00 176.54 175.93 3geb h ALA 510 N 1.65 0.49 -0.02 3.60 0.00 -0.61 -2.96 119.26 121.43 3geb h ALA 510 Ca -0.00 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 3geb h ALA 510 Cb 0.88 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3geb h ALA 510 CO 0.05 0.70 -0.01 0.87 0.00 0.00 0.00 179.25 180.86 3geb h LYS 511 N 0.50 0.03 -0.37 0.00 1.57 -1.04 0.27 116.57 117.54 3geb h LYS 511 Ca -0.02 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3geb h LYS 511 Cb 1.25 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 3geb h LYS 511 CO 0.13 0.45 0.25 0.87 -0.57 0.00 0.00 179.45 180.58 3geb h LYS 512 N -0.39 0.21 -0.45 3.15 1.57 -1.43 0.65 116.57 119.88 3geb h LYS 512 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3geb h LYS 512 Cb 0.44 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.70 3geb h LYS 512 CO 0.00 0.14 0.00 0.72 -0.57 0.00 0.00 179.45 179.74 3geb n HIS 513 N -4.47 0.59 -3.68 -1.35 8.25 -1.12 -4.97 115.22 108.47 3geb n HIS 513 Ca 0.05 -0.30 -0.25 0.00 -0.26 0.00 0.00 57.72 56.96 3geb n HIS 513 Cb 0.29 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.43 3geb n HIS 513 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3geb n ASN 514 N 1.32 -3.34 -4.33 0.41 3.02 0.22 -5.01 115.26 107.55 3geb n ASN 514 Ca 0.20 -0.91 -0.32 0.00 -0.03 0.00 0.00 54.58 53.51 3geb n ASN 514 Cb 0.55 -3.77 -0.15 0.00 -0.61 0.00 0.00 39.78 35.80 3geb n ASN 514 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3geb s MET 515 N -5.88 2.86 0.27 3.52 -1.94 0.86 -5.02 119.30 113.97 3geb s MET 515 Ca 0.25 -0.79 -0.30 0.00 -1.71 0.00 0.00 55.69 53.13 3geb s MET 515 Cb -0.08 -2.36 -0.14 0.00 2.01 0.00 0.00 34.83 34.27 3geb s MET 515 CO 0.83 0.35 1.23 -0.35 -0.01 0.00 0.00 175.02 177.08 3geb n PRO 516 N 3.07 1.76 -4.85 2.03 -0.04 -1.22 -4.52 135.00 131.23 3geb n PRO 516 Ca -0.18 0.62 -0.33 0.00 -0.04 0.00 0.00 63.50 63.57 3geb n PRO 516 Cb 0.52 -2.16 -0.14 0.00 -0.04 0.00 0.00 33.50 31.69 3geb n PRO 516 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3geb s PHE 517 N -0.64 2.76 -0.34 0.54 5.36 -1.26 -0.63 117.98 123.77 3geb s PHE 517 Ca 0.63 -0.57 -0.01 0.00 -0.96 0.00 0.00 56.93 56.02 3geb s PHE 517 Cb -0.67 -1.78 0.08 0.00 -0.34 0.00 0.00 43.02 40.31 3geb s PHE 517 CO 0.56 -0.14 0.06 -0.46 -1.46 0.00 0.00 175.22 173.78 3geb s TRP 518 N 0.11 3.45 0.26 10.12 -0.11 0.26 -4.94 118.94 128.10 3geb s TRP 518 Ca -0.07 -2.28 -0.29 0.00 1.22 0.00 0.00 56.10 54.68 3geb s TRP 518 Cb -0.15 -2.57 -0.09 0.00 -1.50 0.00 0.00 33.47 29.16 3geb s TRP 518 CO 0.05 -0.89 0.95 0.50 -4.62 0.00 0.00 176.95 172.94 3geb s ARG 519 N 1.14 4.78 -0.15 5.86 3.52 -1.26 -2.47 118.95 130.37 3geb s ARG 519 Ca 0.01 1.46 0.02 0.00 -0.13 0.00 0.00 55.73 57.09 3geb s ARG 519 Cb -0.21 -3.15 0.01 0.00 -1.56 0.00 0.00 34.95 30.05 3geb s ARG 519 CO -0.04 0.45 -0.20 0.42 -0.81 0.00 0.00 175.30 175.12 3geb s ILE 520 N -1.30 1.98 0.00 4.11 1.01 -0.16 -4.90 121.20 121.94 3geb s ILE 520 Ca 0.44 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.17 3geb s ILE 520 Cb -0.24 -1.77 0.00 0.00 0.01 0.00 0.00 42.46 40.46 3geb s ILE 520 CO 0.30 0.53 0.33 -1.54 0.00 0.00 0.00 174.94 174.57 3geb n SER 521 N 4.30 0.00 -3.74 3.58 3.41 -1.26 -4.05 113.62 115.87 3geb n SER 521 Ca -0.20 -1.00 -0.04 0.00 -0.26 0.00 0.00 58.87 57.37 3geb n SER 521 Cb 0.51 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 3geb n SER 521 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3geb h HIS 523 N 2.00 0.14 -0.32 0.00 -0.00 -1.99 -2.42 115.15 112.56 3geb h HIS 523 Ca -0.24 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.10 3geb h HIS 523 Cb 1.23 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.41 28.58 3geb h HIS 523 CO 0.37 0.09 0.04 0.00 -0.00 0.00 0.00 177.93 178.43 3geb h ALA 524 N 1.93 1.47 -0.40 2.45 0.00 -1.99 -1.91 119.26 120.81 3geb h ALA 524 Ca 0.04 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3geb h ALA 524 Cb -0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3geb h ALA 524 CO -0.01 0.38 -0.20 -0.44 0.00 0.00 0.00 179.25 178.98 3geb h ASP 525 N 0.46 0.79 -0.47 0.00 3.32 -1.79 -0.91 116.42 117.82 3geb h ASP 525 Ca 0.11 -0.28 -0.10 0.00 0.02 0.00 0.00 57.03 56.78 3geb h ASP 525 Cb 0.25 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 3geb h ASP 525 CO 0.00 0.98 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.34 3geb h LEU 526 N 0.69 0.91 -0.69 1.55 3.38 -1.50 -1.72 115.31 117.92 3geb h LEU 526 Ca 0.10 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.72 3geb h LEU 526 Cb 0.71 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 3geb h LEU 526 CO 0.05 1.05 0.45 -0.33 0.09 0.00 0.00 178.44 179.75 3geb h GLU 527 N 0.75 0.92 -0.58 1.13 5.08 -1.07 -0.98 114.58 119.83 3geb h GLU 527 Ca 0.12 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3geb h GLU 527 Cb 0.64 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 3geb h GLU 527 CO 0.04 0.62 0.19 0.00 -1.00 0.00 0.00 179.01 178.86 3geb h ALA 528 N 1.25 0.75 -0.21 3.43 0.00 -0.99 -1.46 119.26 122.04 3geb h ALA 528 Ca 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3geb h ALA 528 Cb -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3geb h ALA 528 CO -0.05 0.41 0.08 1.25 0.00 0.00 0.00 179.25 180.94 3geb h LEU 529 N 0.81 0.29 -1.00 0.00 5.85 -0.98 -2.24 115.31 118.04 3geb h LEU 529 Ca 0.19 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.80 3geb h LEU 529 Cb 0.27 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.16 3geb h LEU 529 CO -0.01 0.39 0.64 -0.09 -0.34 0.00 0.00 178.44 179.04 3geb h ARG 530 N 0.18 1.12 -0.75 1.25 2.43 -1.03 -1.21 114.38 116.36 3geb h ARG 530 Ca 0.07 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 3geb h ARG 530 Cb 0.19 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 3geb h ARG 530 CO -0.00 0.74 0.27 1.25 -1.51 0.00 0.00 179.97 180.71 3geb h HIS 531 N 1.15 1.18 -0.40 2.20 2.76 -0.96 -2.38 115.15 118.70 3geb h HIS 531 Ca 0.44 -0.10 -0.11 0.00 -2.20 0.00 0.00 60.37 58.40 3geb h HIS 531 Cb 0.21 -0.35 -0.02 0.00 1.55 0.00 0.00 27.41 28.81 3geb h HIS 531 CO -0.00 0.91 -0.19 0.00 -1.30 0.00 0.00 177.93 177.35 3geb h ALA 532 N 1.14 0.92 0.00 5.26 0.00 -0.88 -2.83 119.26 122.86 3geb h ALA 532 Ca 0.25 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3geb h ALA 532 Cb 0.26 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3geb h ALA 532 CO -0.01 0.62 -0.09 -0.07 0.00 0.00 0.00 179.25 179.70 3geb h LEU 533 N 0.68 0.00 -0.37 0.00 3.38 -0.77 -2.94 115.31 115.29 3geb h LEU 533 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3geb h LEU 533 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3geb h LEU 533 CO 0.05 0.09 -0.48 -1.84 0.09 0.00 0.00 178.44 176.35 3geb n GLU 534 N -4.33 0.54 0.05 1.13 0.28 -0.94 -4.18 120.64 113.19 3geb n GLU 534 Ca -0.03 -0.37 0.11 0.00 -0.16 0.00 0.00 57.16 56.71 3geb n GLU 534 Cb 0.17 -1.49 -0.05 0.00 1.43 0.00 0.00 31.44 31.49 3geb n GLU 534 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3geb n LEU 535 N -0.90 0.52 -4.81 -1.84 4.77 -1.11 -4.95 117.00 108.68 3geb n LEU 535 Ca 0.09 0.15 -0.36 0.00 -0.03 0.00 0.00 56.01 55.85 3geb n LEU 535 Cb 0.36 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.34 3geb n LEU 535 CO 0.32 -0.08 -0.20 -0.70 -1.33 0.00 0.00 177.39 175.39 3geb s GLU 536 N -3.38 3.47 -0.16 3.23 2.12 -1.23 -5.09 118.70 117.66 3geb s GLU 536 Ca -0.02 -0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.10 3geb s GLU 536 Cb 0.12 -3.14 0.03 0.00 0.26 0.00 0.00 34.13 31.40 3geb s GLU 536 CO 0.83 0.68 -0.11 0.71 -0.54 0.00 0.00 175.26 176.83 3geb s TYR 537 N -0.75 2.05 -2.39 5.30 1.51 -1.26 -5.02 117.35 116.79 3geb s TYR 537 Ca 0.13 -1.21 0.19 0.00 -1.01 0.00 0.00 57.07 55.17 3geb s TYR 537 Cb -0.12 -1.51 0.15 0.00 -0.11 0.00 0.00 41.96 40.38 3geb s TYR 537 CO 0.03 -0.65 1.11 1.28 -1.11 0.00 0.00 175.55 176.20