#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hyg s ARG 265 N 0.00 4.28 0.57 4.33 0.52 -1.26 -4.98 118.95 122.41 3hyg s ARG 265 Ca 0.00 0.80 -0.21 0.00 -0.52 0.00 0.00 55.73 55.81 3hyg s ARG 265 Cb 0.00 -3.26 -0.04 0.00 0.52 0.00 0.00 34.95 32.17 3hyg s ARG 265 CO 0.00 0.58 1.31 0.00 0.02 0.00 0.00 175.30 177.21 3hyg n ALA 266 N 1.88 1.35 -2.73 2.13 0.00 -1.26 -4.78 120.51 117.10 3hyg n ALA 266 Ca -0.09 0.09 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 3hyg n ALA 266 Cb 0.50 -2.33 -0.16 0.00 0.00 0.00 0.00 19.45 17.47 3hyg n ALA 266 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hyg s ARG 267 N -2.98 1.50 -0.12 0.00 1.81 -0.16 -4.58 118.95 114.42 3hyg s ARG 267 Ca 0.75 -0.57 0.00 0.00 -1.72 0.00 0.00 55.73 54.19 3hyg s ARG 267 Cb -0.41 -1.37 0.02 0.00 -0.45 0.00 0.00 34.95 32.74 3hyg s ARG 267 CO 0.47 0.29 -0.11 -0.65 -0.68 0.00 0.00 175.30 174.61 3hyg s GLN 268 N -0.15 1.88 -0.46 3.54 1.11 0.65 -1.19 119.66 125.04 3hyg s GLN 268 Ca 0.01 -0.40 -0.20 0.00 0.01 0.00 0.00 55.36 54.78 3hyg s GLN 268 Cb -0.09 -1.78 0.04 0.00 -1.01 0.00 0.00 33.01 30.17 3hyg s GLN 268 CO 0.01 -0.21 0.63 0.08 0.01 0.00 0.00 175.29 175.81 3hyg s VAL 269 N 1.46 4.84 -0.33 1.09 1.01 0.48 -4.53 120.40 124.42 3hyg s VAL 269 Ca 0.02 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 3hyg s VAL 269 Cb -0.13 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 32.02 3hyg s VAL 269 CO -0.07 -0.68 1.22 -1.61 0.00 0.00 0.00 175.10 173.96 3hyg s GLU 270 N 2.75 3.92 -0.08 2.72 2.02 -1.26 -1.00 118.70 127.77 3hyg s GLU 270 Ca 0.19 1.09 -0.02 0.00 0.02 0.00 0.00 54.97 56.26 3hyg s GLU 270 Cb -0.16 -3.85 -0.03 0.00 0.10 0.00 0.00 34.13 30.19 3hyg s GLU 270 CO 0.16 -1.12 0.02 -0.51 0.02 0.00 0.00 175.26 173.84 3hyg s LEU 271 N 4.23 3.69 -0.21 1.80 1.43 0.82 0.07 118.68 130.52 3hyg s LEU 271 Ca 0.52 0.17 -0.11 0.00 -1.03 0.00 0.00 54.13 53.69 3hyg s LEU 271 Cb -0.14 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 3hyg s LEU 271 CO 0.22 0.37 0.16 -0.22 0.23 0.00 0.00 176.35 177.12 3hyg s LEU 272 N -1.00 4.18 -0.20 1.79 2.96 -0.31 -0.73 118.68 125.38 3hyg s LEU 272 Ca 0.14 0.23 -0.05 0.00 -0.22 0.00 0.00 54.13 54.23 3hyg s LEU 272 Cb -0.11 -2.14 -0.03 0.00 0.50 0.00 0.00 46.19 44.41 3hyg s LEU 272 CO 0.04 0.13 0.01 -0.76 -1.32 0.00 0.00 176.35 174.45 3hyg s LEU 273 N 0.61 3.34 -0.07 -0.68 1.43 -0.56 -0.84 118.68 121.91 3hyg s LEU 273 Ca 0.09 -0.16 0.05 0.00 -1.03 0.00 0.00 54.13 53.08 3hyg s LEU 273 Cb -0.12 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 3hyg s LEU 273 CO 0.01 0.08 -0.23 -0.69 0.23 0.00 0.00 176.35 175.74 3hyg s VAL 274 N 0.94 1.94 -0.03 -1.59 1.01 0.47 -0.79 120.40 122.34 3hyg s VAL 274 Ca 0.02 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.07 3hyg s VAL 274 Cb -0.14 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 3hyg s VAL 274 CO 0.02 0.54 -0.20 0.00 0.00 0.00 0.00 175.10 175.46 3hyg s ALA 275 N 0.03 1.72 0.84 5.51 0.00 -0.41 -0.06 121.76 129.39 3hyg s ALA 275 Ca -0.08 -0.84 -0.06 0.00 0.00 0.00 0.00 51.96 50.97 3hyg s ALA 275 Cb -0.15 -0.50 0.18 0.00 0.00 0.00 0.00 23.12 22.65 3hyg s ALA 275 CO 0.05 0.37 1.15 0.16 0.00 0.00 0.00 175.76 177.48 3hyg s ASP 276 N -0.24 3.67 0.39 0.00 -4.77 -0.87 -0.80 116.67 114.05 3hyg s ASP 276 Ca 0.02 -0.27 0.06 0.00 -3.30 0.00 0.00 52.55 49.05 3hyg s ASP 276 Cb -0.10 0.13 0.79 0.00 -1.09 0.00 0.00 42.92 42.65 3hyg s ASP 276 CO 0.01 -2.34 2.02 0.00 0.70 0.00 0.00 175.17 175.56 3hyg h ALA 277 N -1.04 1.69 -0.63 2.11 0.00 -1.92 -1.38 119.26 118.09 3hyg h ALA 277 Ca -0.38 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3hyg h ALA 277 Cb 1.24 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3hyg h ALA 277 CO 0.35 0.26 0.34 0.66 0.00 0.00 0.00 179.25 180.85 3hyg h SER 278 N 0.67 0.78 -0.54 0.00 4.64 -1.93 -0.72 113.55 116.45 3hyg h SER 278 Ca 0.22 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 61.40 3hyg h SER 278 Cb 0.04 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 3hyg h SER 278 CO -0.05 0.64 0.04 0.24 -0.87 0.00 0.00 176.83 176.82 3hyg h MET 279 N 0.88 0.92 -0.74 4.77 2.86 -1.57 -1.66 114.93 120.39 3hyg h MET 279 Ca 0.22 -0.27 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 3hyg h MET 279 Cb 0.04 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 3hyg h MET 279 CO -0.04 0.92 0.32 0.00 1.06 0.00 0.00 176.91 179.18 3hyg h ALA 280 N 0.97 0.96 -0.44 6.32 0.00 -1.03 -1.03 119.26 125.01 3hyg h ALA 280 Ca 0.16 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3hyg h ALA 280 Cb 0.48 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3hyg h ALA 280 CO 0.02 0.55 -0.22 0.00 0.00 0.00 0.00 179.25 179.60 3hyg h ARG 281 N 1.05 0.88 -0.16 0.00 3.08 -1.07 0.33 114.38 118.50 3hyg h ARG 281 Ca 0.25 -0.37 -0.05 0.00 0.07 0.00 0.00 59.98 59.89 3hyg h ARG 281 Cb 0.17 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 3hyg h ARG 281 CO -0.03 1.01 -0.08 -0.22 -1.07 0.00 0.00 179.97 179.59 3hyg h LYS 282 N 0.77 0.34 0.00 0.04 1.63 -1.05 -3.37 116.57 114.93 3hyg h LYS 282 Ca 0.10 -0.15 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 3hyg h LYS 282 Cb 0.76 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.38 3hyg h LYS 282 CO 0.06 0.65 -1.57 0.66 -3.45 0.00 0.00 179.45 175.80 3hyg n TYR 283 N -4.63 0.00 -3.11 1.91 4.02 -0.41 -5.06 117.16 109.88 3hyg n TYR 283 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 3hyg n TYR 283 Cb 0.30 -0.31 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 3hyg n TYR 283 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3hyg n GLY 284 N 1.43 3.08 0.00 2.72 0.00 0.11 -1.97 105.19 110.56 3hyg n GLY 284 Ca -0.01 -0.27 0.12 0.00 0.00 0.00 0.00 46.02 45.85 3hyg n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hyg n ARG 285 N 14.00 0.21 0.00 1.61 1.74 -1.26 -2.09 116.66 130.87 3hyg n ARG 285 Ca 0.00 0.07 0.13 0.00 -0.77 0.00 0.00 57.85 57.28 3hyg n ARG 285 Cb 0.00 -1.50 0.78 0.00 -1.02 0.00 0.00 32.46 30.72 3hyg n ARG 285 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hyg n GLY 286 N 0.82 -0.98 0.19 -0.13 0.00 -0.83 -4.45 105.19 99.81 3hyg n GLY 286 Ca 0.09 -0.16 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 3hyg n GLY 286 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hyg h LEU 287 N 0.00 -0.34 -0.64 0.99 5.85 -1.51 -1.95 115.31 117.70 3hyg h LEU 287 Ca 0.00 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.75 3hyg h LEU 287 Cb 0.00 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.07 3hyg h LEU 287 CO 0.00 -0.21 0.37 -0.61 -0.34 0.00 0.00 178.44 177.64 3hyg h GLN 288 N -0.45 0.68 -0.60 1.25 4.15 -1.85 -0.85 115.11 117.44 3hyg h GLN 288 Ca -0.04 -0.04 0.04 0.00 0.77 0.00 0.00 58.65 59.38 3hyg h GLN 288 Cb 0.34 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 27.83 3hyg h GLN 288 CO 0.07 0.45 0.35 1.25 -1.93 0.00 0.00 178.83 179.02 3hyg h HIS 289 N 0.70 0.65 -0.06 3.99 2.76 -1.83 -0.80 115.15 120.56 3hyg h HIS 289 Ca 0.27 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.47 3hyg h HIS 289 Cb 0.12 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 28.87 3hyg h HIS 289 CO -0.07 0.34 0.03 -0.92 -1.30 0.00 0.00 177.93 176.01 3hyg h TYR 290 N 0.67 0.05 -0.57 5.26 3.20 -0.59 -0.64 116.97 124.35 3hyg h TYR 290 Ca 0.26 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.15 3hyg h TYR 290 Cb 0.09 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 3hyg h TYR 290 CO -0.07 0.03 0.36 -0.07 -1.64 0.00 0.00 178.16 176.77 3hyg h LEU 291 N 0.06 0.61 -1.17 2.82 3.38 -0.78 -0.78 115.31 119.45 3hyg h LEU 291 Ca 0.02 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 3hyg h LEU 291 Cb 0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3hyg h LEU 291 CO -0.02 0.43 -0.18 -0.07 0.09 0.00 0.00 178.44 178.70 3hyg h LEU 292 N 0.73 0.35 -0.31 1.67 3.38 -1.00 -1.41 115.31 118.71 3hyg h LEU 292 Ca 0.22 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3hyg h LEU 292 Cb -0.03 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3hyg h LEU 292 CO -0.08 0.55 0.15 0.74 0.09 0.00 0.00 178.44 179.89 3hyg h THR 293 N 0.33 1.16 -0.51 0.22 2.02 -0.47 0.35 112.91 116.01 3hyg h THR 293 Ca 0.06 -0.45 0.05 0.00 0.77 0.00 0.00 66.41 66.84 3hyg h THR 293 Cb 0.51 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.76 3hyg h THR 293 CO 0.03 0.16 0.26 -0.07 0.37 0.00 0.00 175.52 176.27 3hyg h LEU 294 N 0.37 0.36 -0.95 2.58 3.38 -0.82 -0.99 115.31 119.24 3hyg h LEU 294 Ca 0.11 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 3hyg h LEU 294 Cb 0.12 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3hyg h LEU 294 CO -0.01 0.25 0.14 0.00 0.09 0.00 0.00 178.44 178.90 3hyg h ALA 295 N 1.28 1.14 -0.62 1.53 0.00 -1.03 -1.21 119.26 120.35 3hyg h ALA 295 Ca 0.23 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3hyg h ALA 295 Cb 0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3hyg h ALA 295 CO -0.16 0.58 0.22 1.03 0.00 0.00 0.00 179.25 180.92 3hyg h SER 296 N 0.87 0.87 -0.16 0.00 0.87 -0.44 0.12 113.55 115.68 3hyg h SER 296 Ca 0.19 -0.19 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 3hyg h SER 296 Cb 0.32 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 3hyg h SER 296 CO 0.00 0.82 -0.03 0.40 -0.53 0.00 0.00 176.83 177.50 3hyg h ILE 297 N 0.87 1.28 -0.89 2.23 2.04 -0.98 -0.95 117.51 121.10 3hyg h ILE 297 Ca 0.20 -0.95 0.03 0.00 1.00 0.00 0.00 64.86 65.15 3hyg h ILE 297 Cb 0.24 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 3hyg h ILE 297 CO -0.01 0.28 0.58 0.00 0.00 0.00 0.00 178.15 179.00 3hyg h ALA 298 N 0.74 1.17 -0.69 1.87 0.00 -1.13 -1.19 119.26 120.02 3hyg h ALA 298 Ca 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hyg h ALA 298 Cb 0.44 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3hyg h ALA 298 CO 0.01 0.44 0.41 -0.97 0.00 0.00 0.00 179.25 179.15 3hyg h ASN 299 N 1.13 0.84 -0.84 0.00 -0.73 -0.58 -0.97 115.58 114.42 3hyg h ASN 299 Ca 0.35 -0.07 -0.01 0.00 1.87 0.00 0.00 56.30 58.45 3hyg h ASN 299 Cb -0.01 -0.21 -0.04 0.00 0.27 0.00 0.00 38.32 38.33 3hyg h ASN 299 CO -0.11 0.66 0.48 -0.09 -0.37 0.00 0.00 177.43 177.99 3hyg h ARG 300 N 0.94 1.16 -0.51 6.67 2.43 -0.34 -1.30 114.38 123.43 3hyg h ARG 300 Ca 0.25 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 3hyg h ARG 300 Cb -0.02 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.27 3hyg h ARG 300 CO -0.05 0.83 0.23 -0.07 -1.51 0.00 0.00 179.97 179.41 3hyg h LEU 301 N 1.17 0.68 -2.28 3.80 3.38 -0.81 -2.33 115.31 118.93 3hyg h LEU 301 Ca 0.30 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 3hyg h LEU 301 Cb -0.00 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 3hyg h LEU 301 CO -0.05 0.63 -0.03 1.88 0.09 0.00 0.00 178.44 180.95 3hyg h TYR 302 N 0.68 0.00 0.00 1.13 -1.99 -0.53 -2.32 116.97 113.94 3hyg h TYR 302 Ca 0.17 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.90 3hyg h TYR 302 Cb 0.14 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.87 3hyg h TYR 302 CO -0.00 0.03 -0.10 0.43 -0.00 0.00 0.00 178.16 178.53 3hyg n SER 303 N -3.30 0.28 -4.75 3.88 7.64 -0.55 -4.42 113.62 112.40 3hyg n SER 303 Ca -0.02 0.40 -0.41 0.00 1.01 0.00 0.00 58.87 59.85 3hyg n SER 303 Cb 0.18 -0.44 -0.02 0.00 -1.01 0.00 0.00 64.21 62.92 3hyg n SER 303 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3hyg s HIS 304 N -3.03 2.97 0.57 1.43 5.04 -0.88 -4.89 115.29 116.51 3hyg s HIS 304 Ca 0.12 1.10 0.28 0.00 -1.54 0.00 0.00 55.06 55.02 3hyg s HIS 304 Cb 0.17 -3.83 1.53 0.00 0.04 0.00 0.00 32.58 30.50 3hyg s HIS 304 CO 0.58 -2.59 2.02 0.00 -2.34 0.00 0.00 174.74 172.40 3hyg h ALA 305 N 4.49 2.08 0.00 1.58 0.00 -1.90 -2.27 119.26 123.24 3hyg h ALA 305 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3hyg h ALA 305 Cb 1.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hyg h ALA 305 CO 0.74 -0.49 0.00 0.66 0.00 0.00 0.00 179.25 180.16 3hyg h SER 306 N 0.00 0.00 1.63 0.00 4.64 -1.91 -0.53 113.55 117.38 3hyg h SER 306 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3hyg h SER 306 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 3hyg h SER 306 CO -0.00 0.00 -0.07 -0.29 -0.87 0.00 0.00 176.83 175.60 3hyg h ILE 307 N 0.00 0.00 -1.14 0.95 2.10 -1.72 -3.42 117.51 114.28 3hyg h ILE 307 Ca 0.00 -0.70 -0.42 0.00 1.08 0.00 0.00 64.86 64.82 3hyg h ILE 307 Cb 0.05 1.66 -0.16 0.00 -1.09 0.00 0.00 36.82 37.28 3hyg h ILE 307 CO 0.00 0.00 -0.39 -0.62 -1.08 0.00 0.00 178.15 176.06 3hyg n GLU 308 N -2.59 -1.47 -3.90 2.19 1.02 -0.21 -4.54 120.64 111.15 3hyg n GLU 308 Ca 0.05 1.20 -0.08 0.00 -0.02 0.00 0.00 57.16 58.30 3hyg n GLU 308 Cb 0.47 -5.60 -0.08 0.00 -0.02 0.00 0.00 31.44 26.22 3hyg n GLU 308 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3hyg s ASN 309 N -2.70 0.18 -0.52 1.62 -0.87 -1.26 -4.99 114.94 106.40 3hyg s ASN 309 Ca 0.00 -0.71 -0.16 0.00 -1.57 0.00 0.00 52.86 50.42 3hyg s ASN 309 Cb 0.00 0.32 0.10 0.00 -0.02 0.00 0.00 41.25 41.65 3hyg s ASN 309 CO 0.00 -0.71 0.49 -2.28 -2.57 0.00 0.00 177.10 172.03 3hyg s HIS 310 N -3.87 3.22 -0.07 2.20 2.46 -1.26 -4.98 115.29 112.99 3hyg s HIS 310 Ca 0.05 -1.10 0.01 0.00 0.47 0.00 0.00 55.06 54.49 3hyg s HIS 310 Cb 0.05 -3.59 0.02 0.00 -0.13 0.00 0.00 32.58 28.94 3hyg s HIS 310 CO -0.11 -0.97 -0.07 0.42 -2.47 0.00 0.00 174.74 171.55 3hyg s ILE 311 N 1.75 0.80 0.09 0.89 1.01 -1.26 -0.99 121.20 123.49 3hyg s ILE 311 Ca 0.05 -0.24 0.07 0.00 0.00 0.00 0.00 60.65 60.52 3hyg s ILE 311 Cb -0.27 -0.80 -0.03 0.00 0.01 0.00 0.00 42.46 41.36 3hyg s ILE 311 CO 0.05 0.30 -0.18 -0.13 0.00 0.00 0.00 174.94 174.98 3hyg s ARG 312 N 1.10 1.01 -0.16 2.79 1.81 -0.33 -4.14 118.95 121.03 3hyg s ARG 312 Ca -0.07 -1.07 -0.06 0.00 -1.72 0.00 0.00 55.73 52.81 3hyg s ARG 312 Cb -0.14 -1.17 -0.04 0.00 -0.45 0.00 0.00 34.95 33.15 3hyg s ARG 312 CO -0.01 0.27 0.05 -0.51 -0.68 0.00 0.00 175.30 174.42 3hyg s LEU 313 N -1.81 3.76 -0.16 2.53 1.43 -1.26 -0.38 118.68 122.78 3hyg s LEU 313 Ca 0.03 0.10 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 3hyg s LEU 313 Cb -0.10 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 44.22 3hyg s LEU 313 CO 0.03 0.23 -0.15 0.00 0.23 0.00 0.00 176.35 176.69 3hyg s ALA 314 N 0.05 1.97 -0.22 4.21 0.00 -0.17 -4.90 121.76 122.69 3hyg s ALA 314 Ca 0.05 -0.99 -0.27 0.00 0.00 0.00 0.00 51.96 50.74 3hyg s ALA 314 Cb -0.12 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 21.90 3hyg s ALA 314 CO 0.01 -0.41 0.93 0.08 0.00 0.00 0.00 175.76 176.37 3hyg s VAL 315 N 1.44 4.77 -0.63 0.00 1.01 -1.26 -0.13 120.40 125.60 3hyg s VAL 315 Ca 0.04 1.79 0.13 0.00 0.00 0.00 0.00 61.98 63.95 3hyg s VAL 315 Cb -0.13 -4.21 -0.14 0.00 0.00 0.00 0.00 36.38 31.90 3hyg s VAL 315 CO -0.11 -0.11 0.56 1.33 0.00 0.00 0.00 175.10 176.77 3hyg n VAL 316 N 5.20 0.00 -3.61 2.92 0.24 0.09 -0.53 118.33 122.63 3hyg n VAL 316 Ca 0.08 -0.19 -0.12 0.00 -2.04 0.00 0.00 64.34 62.07 3hyg n VAL 316 Cb 0.47 1.00 -0.07 0.00 -1.47 0.00 0.00 33.84 33.78 3hyg n VAL 316 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3hyg s LYS 317 N -2.22 0.68 -0.05 7.34 2.20 -1.15 -4.85 119.74 121.69 3hyg s LYS 317 Ca 0.05 0.62 0.02 0.00 -0.36 0.00 0.00 55.97 56.30 3hyg s LYS 317 Cb 0.10 0.33 0.01 0.00 -1.51 0.00 0.00 37.83 36.76 3hyg s LYS 317 CO 0.53 -0.12 -0.10 0.08 -0.36 0.00 0.00 175.35 175.39 3hyg s VAL 318 N -0.06 0.89 -0.07 4.02 1.01 -1.26 -1.49 120.40 123.43 3hyg s VAL 318 Ca 0.00 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.63 3hyg s VAL 318 Cb -0.04 -0.82 0.01 0.00 0.00 0.00 0.00 36.38 35.53 3hyg s VAL 318 CO -0.01 0.29 -0.12 -0.69 0.00 0.00 0.00 175.10 174.57 3hyg s VAL 319 N 0.52 1.14 -0.21 2.92 1.01 0.03 -4.98 120.40 120.84 3hyg s VAL 319 Ca -0.09 -0.47 -0.06 0.00 0.00 0.00 0.00 61.98 61.36 3hyg s VAL 319 Cb -0.13 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 3hyg s VAL 319 CO 0.02 0.36 0.04 -0.69 0.00 0.00 0.00 175.10 174.82 3hyg s VAL 320 N 0.81 4.29 0.35 2.92 1.01 -1.26 -1.28 120.40 127.24 3hyg s VAL 320 Ca -0.12 -0.20 -0.16 0.00 0.00 0.00 0.00 61.98 61.51 3hyg s VAL 320 Cb -0.15 -2.95 -0.09 0.00 0.00 0.00 0.00 36.38 33.18 3hyg s VAL 320 CO 0.02 0.41 0.78 -0.76 0.00 0.00 0.00 175.10 175.55 3hyg s LEU 321 N 0.95 4.02 0.00 3.92 1.43 0.02 -4.97 118.68 124.05 3hyg s LEU 321 Ca 0.03 1.35 0.00 0.00 -1.03 0.00 0.00 54.13 54.47 3hyg s LEU 321 Cb -0.14 -4.17 0.00 0.00 0.03 0.00 0.00 46.19 41.91 3hyg s LEU 321 CO 0.02 -0.25 0.00 0.61 0.23 0.00 0.00 176.35 176.96 3hyg n GLY 322 N -0.49 2.60 0.51 -3.19 0.00 -1.26 -3.86 105.19 99.50 3hyg n GLY 322 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3hyg n GLY 322 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hyg n ASP 323 N 0.00 1.02 -3.32 1.61 10.43 -1.26 -3.96 116.55 121.07 3hyg n ASP 323 Ca 0.00 -1.92 -0.31 0.00 2.57 0.00 0.00 54.79 55.13 3hyg n ASP 323 Cb 0.00 -0.48 -0.02 0.00 1.84 0.00 0.00 41.12 42.45 3hyg n ASP 323 CO 0.00 0.00 0.00 2.29 -1.07 0.00 0.00 177.20 178.42 3hyg n LYS 324 N 0.03 2.38 -1.93 -1.24 2.85 -1.26 -4.42 118.16 114.57 3hyg n LYS 324 Ca 0.00 -1.76 -0.17 0.00 -1.05 0.00 0.00 58.31 55.33 3hyg n LYS 324 Cb 0.25 -2.67 -0.04 0.00 -0.65 0.00 0.00 35.03 31.92 3hyg n LYS 324 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 3hyg n ASP 325 N 4.77 -4.71 -2.72 -5.58 5.68 -1.26 -2.87 116.55 109.86 3hyg n ASP 325 Ca 0.53 0.26 -0.01 0.00 -0.50 0.00 0.00 54.79 55.07 3hyg n ASP 325 Cb 0.22 -4.10 0.00 0.00 -1.14 0.00 0.00 41.12 36.10 3hyg n ASP 325 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 3hyg n LYS 326 N -2.50 -1.12 -0.26 0.11 4.81 -1.25 -4.93 118.16 113.01 3hyg n LYS 326 Ca -0.18 1.34 0.06 0.00 -0.87 0.00 0.00 58.31 58.66 3hyg n LYS 326 Cb 0.60 -4.89 0.19 0.00 0.02 0.00 0.00 35.03 30.95 3hyg n LYS 326 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3hyg h SER 327 N 0.47 -0.10 -5.06 3.14 0.87 -1.73 -3.43 113.55 107.72 3hyg h SER 327 Ca 0.00 0.17 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 3hyg h SER 327 Cb 0.98 0.25 -0.16 0.00 -0.44 0.00 0.00 62.40 63.03 3hyg h SER 327 CO 0.23 -0.10 -0.18 -1.48 -0.53 0.00 0.00 176.83 174.78 3hyg s LEU 328 N -10.66 0.66 -0.23 2.23 0.05 -1.26 -5.06 118.68 104.42 3hyg s LEU 328 Ca -0.13 -0.16 -0.10 0.00 0.05 0.00 0.00 54.13 53.79 3hyg s LEU 328 Cb 0.22 1.55 -0.05 0.00 -2.05 0.00 0.00 46.19 45.86 3hyg s LEU 328 CO 0.76 -0.67 0.15 -1.61 -0.55 0.00 0.00 176.35 174.42 3hyg s GLU 329 N -2.76 4.10 -0.26 1.48 2.02 -1.26 -5.07 118.70 116.96 3hyg s GLU 329 Ca -0.03 -0.26 -0.13 0.00 0.02 0.00 0.00 54.97 54.57 3hyg s GLU 329 Cb -0.00 -3.49 -0.04 0.00 0.10 0.00 0.00 34.13 30.69 3hyg s GLU 329 CO -0.05 0.14 0.28 0.08 0.02 0.00 0.00 175.26 175.74 3hyg s VAL 330 N 0.83 5.25 0.40 2.63 1.01 -1.26 -4.82 120.40 124.44 3hyg s VAL 330 Ca 0.08 0.40 0.07 0.00 0.00 0.00 0.00 61.98 62.53 3hyg s VAL 330 Cb -0.13 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.56 3hyg s VAL 330 CO 0.02 0.23 0.01 -0.94 0.00 0.00 0.00 175.10 174.42 3hyg s SER 331 N 1.50 3.91 0.36 3.32 1.04 -1.26 -5.03 113.70 117.54 3hyg s SER 331 Ca 0.12 -1.32 0.27 0.00 0.48 0.00 0.00 55.95 55.50 3hyg s SER 331 Cb -0.15 -0.40 1.00 0.00 0.10 0.00 0.00 66.02 66.56 3hyg s SER 331 CO 0.09 -0.43 1.79 0.11 0.98 0.00 0.00 173.24 175.79 3hyg h LYS 332 N 1.77 0.00 -6.39 4.02 1.57 -1.96 -3.41 116.57 112.17 3hyg h LYS 332 Ca -0.44 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 57.80 3hyg h LYS 332 Cb 1.24 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.49 3hyg h LYS 332 CO 0.79 0.00 1.11 1.21 -0.57 0.00 0.00 179.45 181.99 3hyg s ASN 333 N -4.94 6.10 0.22 0.86 3.84 -1.26 0.11 114.94 119.87 3hyg s ASN 333 Ca 0.05 0.34 -0.07 0.00 0.21 0.00 0.00 52.86 53.39 3hyg s ASN 333 Cb 0.09 -2.54 0.20 0.00 -0.55 0.00 0.00 41.25 38.44 3hyg s ASN 333 CO 0.50 -1.72 1.79 0.00 -2.79 0.00 0.00 177.10 174.89 3hyg h ALA 334 N 11.26 1.08 -0.57 1.71 0.00 -1.35 -1.27 119.26 130.11 3hyg h ALA 334 Ca -0.27 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.34 3hyg h ALA 334 Cb 1.10 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3hyg h ALA 334 CO 1.17 0.66 -0.07 0.00 0.00 0.00 0.00 179.25 181.01 3hyg h ALA 335 N 1.20 0.79 -0.18 0.00 0.00 -1.90 0.88 119.26 120.05 3hyg h ALA 335 Ca 0.26 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 3hyg h ALA 335 Cb 0.21 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3hyg h ALA 335 CO -0.02 0.68 -0.46 1.15 0.00 0.00 0.00 179.25 180.60 3hyg h THR 336 N 0.95 1.33 -0.83 0.00 2.02 -1.90 -0.11 112.91 114.37 3hyg h THR 336 Ca 0.15 -1.70 0.06 0.00 0.77 0.00 0.00 66.41 65.69 3hyg h THR 336 Cb 0.64 1.94 -0.06 0.00 -1.74 0.00 0.00 68.15 68.92 3hyg h THR 336 CO 0.04 0.53 0.51 0.74 0.37 0.00 0.00 175.52 177.71 3hyg h THR 337 N 0.29 1.03 -0.17 3.16 2.02 -1.13 -0.21 112.91 117.90 3hyg h THR 337 Ca -0.01 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 3hyg h THR 337 Cb 1.07 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 3hyg h THR 337 CO 0.10 0.17 0.10 0.25 0.37 0.00 0.00 175.52 176.51 3hyg h LEU 338 N 0.93 0.21 -0.36 2.58 5.85 -0.73 0.96 115.31 124.75 3hyg h LEU 338 Ca 0.37 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 59.08 3hyg h LEU 338 Cb 0.18 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 3hyg h LEU 338 CO -0.18 0.20 0.05 0.50 -0.34 0.00 0.00 178.44 178.68 3hyg h LYS 339 N 0.19 0.16 -0.18 1.25 3.64 -0.19 0.16 116.57 121.60 3hyg h LYS 339 Ca 0.06 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.25 3hyg h LYS 339 Cb 0.04 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3hyg h LYS 339 CO -0.01 0.10 -0.62 -0.91 -2.27 0.00 0.00 179.45 175.74 3hyg h ASN 340 N 0.16 0.71 -0.57 4.20 2.35 -0.97 -2.48 115.58 118.98 3hyg h ASN 340 Ca 0.17 -0.41 -0.07 0.00 -0.55 0.00 0.00 56.30 55.44 3hyg h ASN 340 Cb 0.22 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3hyg h ASN 340 CO -0.25 1.16 0.09 0.15 -1.65 0.00 0.00 177.43 176.93 3hyg h PHE 341 N 0.47 1.02 -0.79 1.19 3.57 -0.55 -1.36 116.94 120.49 3hyg h PHE 341 Ca -0.01 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.36 3hyg h PHE 341 Cb 1.19 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.62 3hyg h PHE 341 CO 0.06 0.89 0.52 0.00 -2.23 0.00 0.00 178.31 177.55 3hyg h LYS 343 N 1.07 0.37 -0.40 0.00 1.57 -1.22 -2.42 116.57 115.54 3hyg h LYS 343 Ca 0.29 -0.20 0.03 0.00 -1.87 0.00 0.00 60.65 58.90 3hyg h LYS 343 Cb -0.12 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 3hyg h LYS 343 CO -0.06 0.76 0.18 2.35 -0.57 0.00 0.00 179.45 182.11 3hyg h TRP 344 N 0.00 0.34 -0.06 -1.35 7.01 -0.74 -1.31 115.95 119.84 3hyg h TRP 344 Ca 0.02 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 60.92 3hyg h TRP 344 Cb 0.70 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.65 3hyg h TRP 344 CO 0.09 0.17 -0.52 -0.56 -2.79 0.00 0.00 178.44 174.83 3hyg h GLN 345 N 0.38 0.15 -0.34 2.65 -0.00 -0.82 -2.00 115.11 115.12 3hyg h GLN 345 Ca 0.17 -0.09 -0.07 0.00 -0.00 0.00 0.00 58.65 58.67 3hyg h GLN 345 Cb 0.10 0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 27.57 3hyg h GLN 345 CO -0.13 0.63 -0.05 1.25 -0.00 0.00 0.00 178.83 180.53 3hyg h HIS 346 N 0.12 0.71 -0.04 0.06 2.76 -1.08 -1.90 115.15 115.77 3hyg h HIS 346 Ca 0.00 -0.14 -0.01 0.00 -2.20 0.00 0.00 60.37 58.02 3hyg h HIS 346 Cb 0.95 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 29.73 3hyg h HIS 346 CO 0.01 0.78 -0.01 0.37 -1.30 0.00 0.00 177.93 177.79 3hyg h GLN 347 N 0.43 0.06 -0.01 5.26 5.75 -0.87 -2.49 115.11 123.23 3hyg h GLN 347 Ca 0.09 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 3hyg h GLN 347 Cb 0.53 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.07 3hyg h GLN 347 CO 0.03 0.07 -0.26 0.72 -2.65 0.00 0.00 178.83 176.74 3hyg n HIS 348 N -4.49 0.00 -2.46 3.99 8.25 -0.79 -4.94 115.22 114.78 3hyg n HIS 348 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.11 3hyg n HIS 348 Cb 0.12 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 3hyg n HIS 348 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3hyg s ASN 349 N -2.35 6.47 -0.37 0.41 3.84 -0.73 -5.02 114.94 117.19 3hyg s ASN 349 Ca 0.25 1.72 -0.18 0.00 0.21 0.00 0.00 52.86 54.86 3hyg s ASN 349 Cb 0.19 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.36 3hyg s ASN 349 CO 0.48 -0.69 0.50 -1.10 -2.79 0.00 0.00 177.10 173.50 3hyg s GLN 350 N -3.69 3.47 0.48 0.43 -1.52 -1.26 -5.03 119.66 112.55 3hyg s GLN 350 Ca 0.62 -0.33 -0.21 0.00 -1.95 0.00 0.00 55.36 53.49 3hyg s GLN 350 Cb -0.12 -3.86 -0.08 0.00 -0.22 0.00 0.00 33.01 28.73 3hyg s GLN 350 CO 0.26 -0.72 1.07 -0.51 -0.25 0.00 0.00 175.29 175.14 3hyg s LEU 351 N 2.36 3.89 0.00 2.90 1.43 -1.26 -4.26 118.68 123.74 3hyg s LEU 351 Ca 0.17 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.30 3hyg s LEU 351 Cb -0.16 -4.47 0.00 0.00 0.03 0.00 0.00 46.19 41.59 3hyg s LEU 351 CO 0.14 -0.83 0.00 0.61 0.23 0.00 0.00 176.35 176.50 3hyg n GLY 352 N -0.00 0.28 0.15 -3.19 0.00 -1.26 -4.80 105.19 96.36 3hyg n GLY 352 Ca 0.09 -1.04 0.12 0.00 0.00 0.00 0.00 46.02 45.19 3hyg n GLY 352 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hyg n ASP 353 N 0.00 0.69 0.22 1.61 -0.08 -1.26 -2.05 116.55 115.69 3hyg n ASP 353 Ca 0.00 0.70 0.10 0.00 -1.51 0.00 0.00 54.79 54.08 3hyg n ASP 353 Cb 0.00 -0.83 0.47 0.00 2.34 0.00 0.00 41.12 43.10 3hyg n ASP 353 CO 0.00 0.00 0.00 -2.24 0.12 0.00 0.00 177.20 175.08 3hyg h ASP 354 N 0.00 0.00 -3.48 1.67 2.03 -1.95 -3.45 116.42 111.23 3hyg h ASP 354 Ca 0.00 0.00 -0.53 0.00 -0.73 0.00 0.00 57.03 55.77 3hyg h ASP 354 Cb 0.30 0.00 0.06 0.00 -0.83 0.00 0.00 39.33 38.85 3hyg h ASP 354 CO 0.00 0.22 0.72 -2.28 -1.03 0.00 0.00 179.24 176.87 3hyg s HIS 355 N -3.68 3.05 0.34 4.15 2.46 -0.87 -4.90 115.29 115.84 3hyg s HIS 355 Ca 0.00 1.13 0.10 0.00 0.47 0.00 0.00 55.06 56.76 3hyg s HIS 355 Cb 0.10 -3.77 0.85 0.00 -0.13 0.00 0.00 32.58 29.64 3hyg s HIS 355 CO 0.63 -2.41 1.80 0.93 -2.47 0.00 0.00 174.74 173.23 3hyg h GLU 356 N 4.75 0.63 -0.50 2.88 5.08 -1.90 -1.61 114.58 123.91 3hyg h GLU 356 Ca -0.46 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 57.72 3hyg h GLU 356 Cb 1.22 -0.14 -0.08 0.00 0.50 0.00 0.00 28.75 30.24 3hyg h GLU 356 CO 0.75 0.42 0.11 0.39 -1.00 0.00 0.00 179.01 179.68 3hyg n GLU 357 N -4.67 3.00 -2.61 2.33 1.02 -1.26 -4.68 120.64 113.77 3hyg n GLU 357 Ca 0.22 -3.03 -0.42 0.00 -0.02 0.00 0.00 57.16 53.91 3hyg n GLU 357 Cb 0.61 -2.00 -0.03 0.00 -0.02 0.00 0.00 31.44 30.00 3hyg n GLU 357 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3hyg s HIS 358 N -3.01 3.52 0.06 -0.32 2.46 -0.61 -3.98 115.29 113.41 3hyg s HIS 358 Ca 0.49 1.53 0.05 0.00 0.47 0.00 0.00 55.06 57.59 3hyg s HIS 358 Cb 0.40 -3.24 -0.04 0.00 -0.13 0.00 0.00 32.58 29.58 3hyg s HIS 358 CO 0.09 -0.49 -0.04 1.52 -2.47 0.00 0.00 174.74 173.36 3hyg s TYR 359 N 1.42 2.92 -0.11 3.88 -0.85 -1.26 -4.92 117.35 118.43 3hyg s TYR 359 Ca 0.53 -0.05 0.15 0.00 -0.52 0.00 0.00 57.07 57.18 3hyg s TYR 359 Cb -0.22 -1.54 -0.07 0.00 0.38 0.00 0.00 41.96 40.50 3hyg s TYR 359 CO 0.25 0.44 1.10 -0.44 -1.52 0.00 0.00 175.55 175.38 3hyg h ASP 360 N 3.80 0.00 -4.64 -0.18 3.32 -0.71 -3.47 116.42 114.53 3hyg h ASP 360 Ca -0.48 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.44 3hyg h ASP 360 Cb 1.17 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.50 3hyg h ASP 360 CO 0.57 0.60 -0.30 0.00 -1.72 0.00 0.00 179.24 178.39 3hyg s ALA 361 N -2.91 -0.78 -0.05 3.45 0.00 -0.94 -4.70 121.76 115.84 3hyg s ALA 361 Ca 0.00 0.49 0.05 0.00 0.00 0.00 0.00 51.96 52.50 3hyg s ALA 361 Cb 0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.09 3hyg s ALA 361 CO 0.79 -0.23 -0.20 0.00 0.00 0.00 0.00 175.76 176.12 3hyg s ALA 362 N -0.87 1.75 -0.14 0.00 0.00 -0.65 -1.16 121.76 120.69 3hyg s ALA 362 Ca -0.10 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.06 3hyg s ALA 362 Cb -0.04 -0.56 0.02 0.00 0.00 0.00 0.00 23.12 22.54 3hyg s ALA 362 CO 0.03 0.33 -0.17 0.42 0.00 0.00 0.00 175.76 176.37 3hyg s ILE 363 N -0.06 1.75 -0.18 0.00 -1.09 -0.02 -1.29 121.20 120.31 3hyg s ILE 363 Ca -0.03 -0.77 -0.11 0.00 -2.23 0.00 0.00 60.65 57.51 3hyg s ILE 363 Cb -0.12 -1.60 -0.05 0.00 -1.58 0.00 0.00 42.46 39.11 3hyg s ILE 363 CO 0.02 0.49 0.18 -0.22 -1.23 0.00 0.00 174.94 174.19 3hyg s LEU 364 N 1.17 4.23 -0.12 2.97 2.96 -0.07 -0.40 118.68 129.42 3hyg s LEU 364 Ca -0.01 0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 54.20 3hyg s LEU 364 Cb -0.14 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.34 3hyg s LEU 364 CO -0.07 0.16 -0.03 -0.36 -1.32 0.00 0.00 176.35 174.73 3hyg s PHE 365 N 0.34 3.04 0.04 5.38 0.40 0.91 -0.14 117.98 127.95 3hyg s PHE 365 Ca 0.11 -0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.32 3hyg s PHE 365 Cb -0.12 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.51 3hyg s PHE 365 CO 0.00 0.15 -0.04 -0.08 0.70 0.00 0.00 175.22 175.95 3hyg s THR 366 N -0.15 0.26 -0.74 0.64 -1.32 -0.37 -2.05 115.64 111.90 3hyg s THR 366 Ca 0.03 -1.38 0.25 0.00 -1.21 0.00 0.00 61.69 59.39 3hyg s THR 366 Cb -0.13 -0.93 0.16 0.00 -1.51 0.00 0.00 72.50 70.09 3hyg s THR 366 CO 0.02 -0.72 1.56 0.54 -2.21 0.00 0.00 174.62 173.82 3hyg n ARG 367 N 0.84 0.23 -1.70 7.08 5.12 -1.26 -0.14 116.66 126.83 3hyg n ARG 367 Ca -0.19 0.12 -0.42 0.00 -1.93 0.00 0.00 57.85 55.43 3hyg n ARG 367 Cb 0.58 -1.70 -0.00 0.00 -1.16 0.00 0.00 32.46 30.18 3hyg n ARG 367 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3hyg n GLU 368 N -2.06 2.08 -2.33 5.56 -0.58 -1.26 -4.81 120.64 117.23 3hyg n GLU 368 Ca 0.05 0.73 -0.40 0.00 -0.42 0.00 0.00 57.16 57.12 3hyg n GLU 368 Cb 0.42 -2.35 -0.03 0.00 -0.57 0.00 0.00 31.44 28.91 3hyg n GLU 368 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3hyg s ASP 369 N -0.37 5.79 0.31 1.62 2.15 -1.26 -4.74 116.67 120.17 3hyg s ASP 369 Ca 0.57 -0.07 -0.28 0.00 0.43 0.00 0.00 52.55 53.20 3hyg s ASP 369 Cb -0.55 -2.55 -0.09 0.00 -0.30 0.00 0.00 42.92 39.43 3hyg s ASP 369 CO 0.61 -2.05 1.07 -0.76 -0.17 0.00 0.00 175.17 173.87 3hyg s LEU 370 N 7.12 4.45 -0.05 -1.34 1.43 -1.26 -4.60 118.68 124.44 3hyg s LEU 370 Ca 0.50 2.17 0.05 0.00 -1.03 0.00 0.00 54.13 55.81 3hyg s LEU 370 Cb -0.10 -3.78 -0.00 0.00 0.03 0.00 0.00 46.19 42.33 3hyg s LEU 370 CO 0.18 -0.20 -0.20 0.00 0.23 0.00 0.00 176.35 176.36 3hyg n GLY 372 N 3.13 2.83 0.36 0.00 0.00 -0.28 -1.10 105.19 110.12 3hyg n GLY 372 Ca -0.18 -2.04 0.08 0.00 0.00 0.00 0.00 46.02 43.88 3hyg n GLY 372 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 3hyg h HIS 373 N 0.01 0.71 0.00 1.61 2.07 -2.01 -3.30 115.15 114.24 3hyg h HIS 373 Ca 0.00 0.02 -0.17 0.00 -2.85 0.00 0.00 60.37 57.37 3hyg h HIS 373 Cb 0.00 -0.23 -0.03 0.00 2.57 0.00 0.00 27.41 29.72 3hyg h HIS 373 CO 0.00 0.35 -1.63 1.58 -3.07 0.00 0.00 177.93 175.16 3hyg n HIS 374 N -4.49 0.00 -3.49 6.12 -0.00 -1.26 -5.11 115.22 106.99 3hyg n HIS 374 Ca 0.12 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.72 3hyg n HIS 374 Cb 0.30 -0.44 -0.02 0.00 -0.00 0.00 0.00 29.99 29.83 3hyg n HIS 374 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 3hyg s SER 375 N -4.62 -0.49 0.00 0.26 0.15 -1.24 -5.03 113.70 102.73 3hyg s SER 375 Ca -0.10 -0.11 0.18 0.00 0.70 0.00 0.00 55.95 56.62 3hyg s SER 375 Cb 0.03 0.59 0.75 0.00 -1.71 0.00 0.00 66.02 65.68 3hyg s SER 375 CO 0.31 -0.98 1.52 0.00 1.20 0.00 0.00 173.24 175.29 3hyg h ASP 377 N 1.53 0.00 -2.40 0.00 3.32 -1.96 -3.44 116.42 113.47 3hyg h ASP 377 Ca 0.00 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 3hyg h ASP 377 Cb 0.34 0.00 0.10 0.00 0.22 0.00 0.00 39.33 39.99 3hyg h ASP 377 CO 0.00 0.00 0.20 0.41 -1.72 0.00 0.00 179.24 178.13 3hyg n THR 378 N -3.86 1.71 0.24 0.35 -1.04 -1.25 -4.93 114.28 105.50 3hyg n THR 378 Ca -0.03 -0.43 0.03 0.00 -2.04 0.00 0.00 64.05 61.58 3hyg n THR 378 Cb 0.09 -1.01 0.00 0.00 -1.82 0.00 0.00 70.33 67.59 3hyg n THR 378 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3hyg n LEU 379 N 1.43 1.03 -3.60 -4.42 4.77 -1.26 -4.43 117.00 110.50 3hyg n LEU 379 Ca 0.11 -0.82 -0.03 0.00 -0.03 0.00 0.00 56.01 55.24 3hyg n LEU 379 Cb 0.31 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.38 3hyg n LEU 379 CO 0.60 0.22 0.99 -0.83 -1.33 0.00 0.00 177.39 177.05 3hyg s GLY 380 N -0.85 -0.34 -0.08 -0.72 0.00 -1.26 -0.04 107.32 104.03 3hyg s GLY 380 Ca 0.05 1.21 -0.18 0.00 0.00 0.00 0.00 44.72 45.80 3hyg s GLY 380 CO 0.12 0.36 0.42 -0.29 0.00 0.00 0.00 173.10 173.72 3hyg s MET 381 N -2.50 0.67 -0.05 2.90 1.75 -0.59 -5.00 119.30 116.48 3hyg s MET 381 Ca 0.11 0.20 -0.30 0.00 -1.25 0.00 0.00 55.69 54.45 3hyg s MET 381 Cb 0.01 0.31 0.08 0.00 2.84 0.00 0.00 34.83 38.07 3hyg s MET 381 CO -0.04 -0.16 0.74 0.00 -0.65 0.00 0.00 175.02 174.91 3hyg s ALA 382 N -0.68 -1.79 0.85 4.11 0.00 -1.26 -1.47 121.76 121.53 3hyg s ALA 382 Ca -0.08 1.28 -0.11 0.00 0.00 0.00 0.00 51.96 53.05 3hyg s ALA 382 Cb -0.04 -0.03 0.11 0.00 0.00 0.00 0.00 23.12 23.16 3hyg s ALA 382 CO 0.04 -0.41 1.10 -0.51 0.00 0.00 0.00 175.76 175.97 3hyg s ASP 383 N -1.37 3.75 -0.26 0.00 1.01 -1.26 -4.87 116.67 113.67 3hyg s ASP 383 Ca -0.07 1.74 -0.12 0.00 0.71 0.00 0.00 52.55 54.80 3hyg s ASP 383 Cb -0.00 -2.39 -0.05 0.00 1.01 0.00 0.00 42.92 41.49 3hyg s ASP 383 CO 0.05 -2.50 0.24 -0.69 0.21 0.00 0.00 175.17 172.48 3hyg s VAL 384 N -2.86 5.29 0.00 -1.27 1.01 -1.26 -3.11 120.40 118.20 3hyg s VAL 384 Ca 0.63 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.92 3hyg s VAL 384 Cb -0.19 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.62 3hyg s VAL 384 CO 0.57 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.54 3hyg n GLY 385 N 4.61 0.74 1.45 4.51 0.00 0.73 -4.85 105.19 112.38 3hyg n GLY 385 Ca -0.13 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.97 3hyg n GLY 385 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hyg n THR 386 N -2.43 1.74 0.24 2.61 -2.24 -1.08 -4.59 114.28 108.53 3hyg n THR 386 Ca 0.00 -1.02 0.17 0.00 -2.27 0.00 0.00 64.05 60.93 3hyg n THR 386 Cb 0.00 -0.06 0.88 0.00 -2.10 0.00 0.00 70.33 69.04 3hyg n THR 386 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 3hyg h ILE 387 N 3.35 0.43 -0.25 2.28 2.10 -1.64 -0.34 117.51 123.44 3hyg h ILE 387 Ca 0.00 0.00 -0.04 0.00 1.08 0.00 0.00 64.86 65.90 3hyg h ILE 387 Cb 1.39 0.88 -0.02 0.00 -1.09 0.00 0.00 36.82 37.97 3hyg h ILE 387 CO 0.26 0.00 -0.01 0.00 -1.08 0.00 0.00 178.15 177.32 3hyg s SER 389 N -2.16 5.47 0.42 0.00 0.01 -0.14 -4.97 113.70 112.33 3hyg s SER 389 Ca 0.42 -2.49 0.21 0.00 1.31 0.00 0.00 55.95 55.40 3hyg s SER 389 Cb 0.35 -1.91 1.18 0.00 0.21 0.00 0.00 66.02 65.85 3hyg s SER 389 CO 0.06 -0.49 1.77 -0.65 0.41 0.00 0.00 173.24 174.35 3hyg h PRO 390 N 7.58 0.31 0.00 12.44 0.11 -1.85 0.43 132.00 151.02 3hyg h PRO 390 Ca -0.06 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 3hyg h PRO 390 Cb 1.00 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 3hyg h PRO 390 CO 0.74 0.21 -0.08 1.05 -0.21 0.00 0.00 178.00 179.70 3hyg h GLU 391 N 0.32 0.00 0.00 1.05 9.09 -1.92 -3.25 114.58 119.87 3hyg h GLU 391 Ca 0.60 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.01 3hyg h GLU 391 Cb 1.66 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.76 3hyg h GLU 391 CO -0.26 0.08 -0.06 0.54 0.05 0.00 0.00 179.01 179.36 3hyg n ARG 392 N -3.20 1.62 -2.99 1.06 5.12 0.03 -4.60 116.66 113.70 3hyg n ARG 392 Ca 0.01 -1.79 -0.44 0.00 -1.93 0.00 0.00 57.85 53.70 3hyg n ARG 392 Cb 0.37 -1.10 -0.01 0.00 -1.16 0.00 0.00 32.46 30.57 3hyg n ARG 392 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3hyg s SER 393 N -1.68 6.98 -0.04 0.55 0.15 -0.55 -4.69 113.70 114.42 3hyg s SER 393 Ca 0.13 -2.81 -0.29 0.00 0.70 0.00 0.00 55.95 53.68 3hyg s SER 393 Cb 0.12 -2.38 0.07 0.00 -1.71 0.00 0.00 66.02 62.12 3hyg s SER 393 CO 0.01 -0.77 0.65 0.00 1.20 0.00 0.00 173.24 174.33 3hyg s ALA 395 N -1.28 -0.38 -0.01 0.00 0.00 -0.41 -4.33 121.76 115.36 3hyg s ALA 395 Ca -0.11 -0.13 0.07 0.00 0.00 0.00 0.00 51.96 51.79 3hyg s ALA 395 Cb -0.00 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 3hyg s ALA 395 CO 0.09 -0.25 -0.22 0.14 0.00 0.00 0.00 175.76 175.52 3hyg s VAL 396 N -1.70 2.44 -0.06 0.00 -7.23 -0.54 -0.89 120.40 112.42 3hyg s VAL 396 Ca -0.12 -1.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.98 3hyg s VAL 396 Cb -0.06 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 34.98 3hyg s VAL 396 CO 0.00 0.50 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.62 3hyg s ILE 397 N -0.73 0.64 -0.42 -0.62 -1.09 0.81 -1.55 121.20 118.24 3hyg s ILE 397 Ca 0.11 -0.12 -0.26 0.00 -2.23 0.00 0.00 60.65 58.15 3hyg s ILE 397 Cb -0.10 -0.68 0.02 0.00 -1.58 0.00 0.00 42.46 40.12 3hyg s ILE 397 CO 0.01 0.27 0.94 -0.70 -1.23 0.00 0.00 174.94 174.23 3hyg s GLU 398 N 1.30 3.68 -0.48 2.79 2.12 0.94 -1.24 118.70 127.80 3hyg s GLU 398 Ca -0.05 0.37 -0.29 0.00 0.36 0.00 0.00 54.97 55.36 3hyg s GLU 398 Cb -0.14 -3.87 0.02 0.00 0.26 0.00 0.00 34.13 30.40 3hyg s GLU 398 CO -0.02 -1.12 1.29 0.34 -0.54 0.00 0.00 175.26 175.21 3hyg s ASP 399 N 2.12 6.42 0.00 -1.70 2.15 0.79 -4.83 116.67 121.62 3hyg s ASP 399 Ca 0.38 0.52 0.25 0.00 0.43 0.00 0.00 52.55 54.13 3hyg s ASP 399 Cb -0.11 -2.55 0.45 0.00 -0.30 0.00 0.00 42.92 40.42 3hyg s ASP 399 CO 0.24 -1.42 1.37 -0.90 -0.17 0.00 0.00 175.17 174.28 3hyg n ASP 400 N 8.56 1.27 0.00 -0.34 5.75 -1.26 -4.64 116.55 125.88 3hyg n ASP 400 Ca 0.13 -1.02 0.00 0.00 -0.01 0.00 0.00 54.79 53.89 3hyg n ASP 400 Cb 0.49 0.30 0.00 0.00 -1.03 0.00 0.00 41.12 40.88 3hyg n ASP 400 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hyg n GLY 401 N 1.39 0.63 0.00 6.12 0.00 -1.26 -4.79 105.19 107.28 3hyg n GLY 401 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3hyg n GLY 401 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3hyg n LEU 402 N 0.00 1.21 -0.05 0.99 -0.00 -1.26 -4.91 117.00 112.98 3hyg n LEU 402 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 56.02 3hyg n LEU 402 Cb 0.04 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.48 3hyg n LEU 402 CO 0.00 0.20 0.42 1.41 -0.00 0.00 0.00 177.39 179.42 3hyg n HIS 403 N -1.96 0.00 -0.16 1.47 8.25 -1.26 -4.87 115.22 116.68 3hyg n HIS 403 Ca 0.00 -0.39 0.04 0.00 -0.26 0.00 0.00 57.72 57.11 3hyg n HIS 403 Cb 0.38 -0.05 0.33 0.00 1.12 0.00 0.00 29.99 31.77 3hyg n HIS 403 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hyg h ALA 404 N 0.00 1.63 -0.45 -1.41 0.00 -1.91 -1.19 119.26 115.94 3hyg h ALA 404 Ca 0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 3hyg h ALA 404 Cb 0.77 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3hyg h ALA 404 CO 0.00 0.29 -0.07 0.00 0.00 0.00 0.00 179.25 179.47 3hyg h ALA 405 N 1.61 1.04 -0.49 0.00 0.00 -1.89 0.23 119.26 119.75 3hyg h ALA 405 Ca 0.28 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3hyg h ALA 405 Cb 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3hyg h ALA 405 CO -0.08 0.59 0.16 0.74 0.00 0.00 0.00 179.25 180.65 3hyg h PHE 406 N 0.72 0.79 -0.64 0.00 0.05 -1.63 -1.66 116.94 114.56 3hyg h PHE 406 Ca 0.13 -0.08 0.00 0.00 3.82 0.00 0.00 57.97 61.84 3hyg h PHE 406 Cb 0.53 -0.23 -0.03 0.00 2.00 0.00 0.00 35.95 38.22 3hyg h PHE 406 CO 0.03 0.69 0.41 1.15 -0.18 0.00 0.00 178.31 180.40 3hyg h THR 407 N 0.66 1.17 -0.23 -1.55 2.02 -0.90 -0.01 112.91 114.07 3hyg h THR 407 Ca 0.16 -0.33 0.02 0.00 0.77 0.00 0.00 66.41 67.03 3hyg h THR 407 Cb 0.27 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 3hyg h THR 407 CO -0.01 0.17 0.09 0.58 0.37 0.00 0.00 175.52 176.72 3hyg h VAL 408 N 0.86 0.96 -0.74 3.16 2.07 -0.84 -0.08 116.25 121.65 3hyg h VAL 408 Ca 0.23 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.68 3hyg h VAL 408 Cb -0.08 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 3hyg h VAL 408 CO -0.05 0.04 0.47 0.00 0.02 0.00 0.00 177.57 178.05 3hyg h ALA 409 N 1.13 0.95 -0.22 1.67 0.00 -0.86 -1.05 119.26 120.87 3hyg h ALA 409 Ca 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3hyg h ALA 409 Cb 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3hyg h ALA 409 CO -0.09 0.39 0.10 1.25 0.00 0.00 0.00 179.25 180.91 3hyg h HIS 410 N 1.01 0.32 -0.35 0.00 6.17 -0.70 -0.17 115.15 121.43 3hyg h HIS 410 Ca 0.27 -0.02 -0.15 0.00 0.71 0.00 0.00 60.37 61.18 3hyg h HIS 410 Cb -0.07 -0.10 -0.01 0.00 2.52 0.00 0.00 27.41 29.76 3hyg h HIS 410 CO -0.01 0.32 -0.38 0.93 0.71 0.00 0.00 177.93 179.50 3hyg h GLU 411 N 0.22 0.84 -0.60 5.26 4.39 -0.77 -1.86 114.58 122.06 3hyg h GLU 411 Ca 0.07 -0.43 -0.00 0.00 0.34 0.00 0.00 59.36 59.34 3hyg h GLU 411 Cb 0.12 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 3hyg h GLU 411 CO -0.01 1.07 0.37 0.82 -1.16 0.00 0.00 179.01 180.11 3hyg h ILE 412 N 0.69 1.17 -0.37 3.13 2.04 -1.17 -1.92 117.51 121.07 3hyg h ILE 412 Ca 0.06 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.63 3hyg h ILE 412 Cb 0.95 0.30 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 3hyg h ILE 412 CO 0.09 0.17 0.07 1.23 0.00 0.00 0.00 178.15 179.70 3hyg h GLY 413 N 0.85 0.43 0.65 5.37 0.00 -0.26 -0.31 103.07 109.80 3hyg h GLY 413 Ca 0.22 -0.02 0.06 0.00 0.00 0.00 0.00 47.33 47.59 3hyg h GLY 413 CO -0.04 -0.04 0.27 0.45 0.00 0.00 0.00 176.54 177.18 3hyg h HIS 414 N 0.19 0.49 -0.69 5.60 3.86 -0.77 -1.44 115.15 122.40 3hyg h HIS 414 Ca 0.18 0.02 0.10 0.00 -1.16 0.00 0.00 60.37 59.51 3hyg h HIS 414 Cb 0.21 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.50 3hyg h HIS 414 CO -0.20 0.22 0.45 -0.07 0.86 0.00 0.00 177.93 179.19 3hyg h LEU 415 N 0.51 0.50 -0.97 2.43 3.38 -0.55 0.29 115.31 120.91 3hyg h LEU 415 Ca 0.25 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3hyg h LEU 415 Cb 0.19 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3hyg h LEU 415 CO -0.19 0.30 0.00 0.18 0.09 0.00 0.00 178.44 178.82 3hyg n LEU 416 N -4.48 1.24 0.00 1.67 4.77 -0.22 -1.76 117.00 118.21 3hyg n LEU 416 Ca 0.11 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 3hyg n LEU 416 Cb 0.34 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3hyg n LEU 416 CO 0.33 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3hyg n GLY 417 N 0.34 0.75 3.75 -0.72 0.00 0.35 -4.72 105.19 104.94 3hyg n GLY 417 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3hyg n GLY 417 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hyg s LEU 418 N 0.00 4.57 0.64 0.99 1.43 -0.63 -4.78 118.68 120.90 3hyg s LEU 418 Ca 0.00 1.74 -0.01 0.00 -1.03 0.00 0.00 54.13 54.83 3hyg s LEU 418 Cb 0.00 -3.45 0.07 0.00 0.03 0.00 0.00 46.19 42.84 3hyg s LEU 418 CO 0.00 0.10 0.89 -0.44 0.23 0.00 0.00 176.35 177.14 3hyg s SER 419 N -0.72 4.87 0.46 2.29 0.01 -1.26 -4.29 113.70 115.06 3hyg s SER 419 Ca 0.40 -0.03 -0.23 0.00 1.31 0.00 0.00 55.95 57.41 3hyg s SER 419 Cb -0.24 -0.65 -0.07 0.00 0.21 0.00 0.00 66.02 65.27 3hyg s SER 419 CO 0.28 -1.47 1.15 -1.00 0.41 0.00 0.00 173.24 172.61 3hyg s HIS 420 N -2.99 2.91 0.42 2.43 0.09 -1.26 -4.91 115.29 111.98 3hyg s HIS 420 Ca 0.61 1.55 0.15 0.00 -0.00 0.00 0.00 55.06 57.36 3hyg s HIS 420 Cb -0.09 -3.35 0.95 0.00 -0.00 0.00 0.00 32.58 30.09 3hyg s HIS 420 CO 0.42 -1.42 1.95 -0.44 -0.00 0.00 0.00 174.74 175.24 3hyg h ASP 421 N 2.06 0.00 -0.37 1.40 3.32 -1.43 -2.47 116.42 118.94 3hyg h ASP 421 Ca -0.49 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.54 3hyg h ASP 421 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 3hyg h ASP 421 CO 0.60 0.23 0.02 -0.90 -1.72 0.00 0.00 179.24 177.48 3hyg n ASP 422 N -4.21 3.88 -4.88 6.45 5.75 -1.26 -4.28 116.55 118.00 3hyg n ASP 422 Ca -0.02 -2.59 -0.29 0.00 -0.01 0.00 0.00 54.79 51.87 3hyg n ASP 422 Cb 0.29 -0.62 -0.02 0.00 -1.03 0.00 0.00 41.12 39.74 3hyg n ASP 422 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3hyg s SER 423 N -0.47 6.40 0.34 -1.12 1.04 -0.93 -4.97 113.70 113.99 3hyg s SER 423 Ca 0.33 1.13 0.05 0.00 0.48 0.00 0.00 55.95 57.94 3hyg s SER 423 Cb 0.26 -2.33 0.68 0.00 0.10 0.00 0.00 66.02 64.73 3hyg s SER 423 CO 0.10 -0.54 1.93 0.50 0.98 0.00 0.00 173.24 176.21 3hyg h LYS 424 N 0.66 0.81 -0.24 4.02 1.63 -1.92 -1.45 116.57 120.08 3hyg h LYS 424 Ca -0.47 -0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.33 3hyg h LYS 424 Cb 1.19 -0.18 -0.05 0.00 -0.60 0.00 0.00 32.23 32.59 3hyg h LYS 424 CO 0.63 0.54 -0.07 0.35 -3.45 0.00 0.00 179.45 177.45 3hyg h PHE 425 N 0.84 -0.14 -0.39 1.91 3.57 -1.94 0.20 116.94 120.98 3hyg h PHE 425 Ca 0.35 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.80 3hyg h PHE 425 Cb 0.29 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 3hyg h PHE 425 CO -0.00 -0.11 -0.04 0.00 -2.23 0.00 0.00 178.31 175.92 3hyg h GLU 427 N 0.54 1.15 0.00 0.00 4.81 -0.85 -1.80 114.58 118.44 3hyg h GLU 427 Ca 0.11 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3hyg h GLU 427 Cb 0.54 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 3hyg h GLU 427 CO 0.03 0.81 -0.13 0.93 -0.73 0.00 0.00 179.01 179.91 3hyg h GLU 428 N 1.17 0.00 0.22 1.92 5.08 -0.58 0.60 114.58 122.98 3hyg h GLU 428 Ca 0.31 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.34 3hyg h GLU 428 Cb -0.06 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.22 3hyg h GLU 428 CO -0.06 0.13 -1.50 1.15 -1.00 0.00 0.00 179.01 177.73 3hyg h THR 429 N 0.00 1.24 0.00 1.13 2.02 -0.89 -3.40 112.91 113.02 3hyg h THR 429 Ca -0.00 -2.73 0.00 0.00 0.77 0.00 0.00 66.41 64.45 3hyg h THR 429 Cb 0.82 2.97 0.00 0.00 -1.74 0.00 0.00 68.15 70.20 3hyg h THR 429 CO 0.02 0.83 -0.88 0.49 0.37 0.00 0.00 175.52 176.35 3hyg n PHE 430 N -3.65 0.00 -0.48 3.16 3.01 -0.72 -5.01 117.46 113.76 3hyg n PHE 430 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.29 3hyg n PHE 430 Cb 1.09 -0.09 0.00 0.00 -0.01 0.00 0.00 39.48 40.47 3hyg n PHE 430 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hyg n GLY 431 N 1.71 0.82 3.84 1.37 0.00 0.21 -4.99 105.19 108.14 3hyg n GLY 431 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3hyg n GLY 431 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hyg s SER 432 N -3.00 -0.15 0.10 1.61 1.04 -1.21 -4.97 113.70 107.12 3hyg s SER 432 Ca 0.00 -0.83 0.07 0.00 0.48 0.00 0.00 55.95 55.67 3hyg s SER 432 Cb 0.00 0.77 -0.03 0.00 0.10 0.00 0.00 66.02 66.86 3hyg s SER 432 CO 0.00 -1.48 -0.17 0.42 0.98 0.00 0.00 173.24 172.99 3hyg s THR 433 N -3.23 1.47 -0.15 2.02 -4.23 -1.26 -3.99 115.64 106.27 3hyg s THR 433 Ca 0.13 -1.54 -0.04 0.00 -1.18 0.00 0.00 61.69 59.05 3hyg s THR 433 Cb -0.06 -1.43 -0.03 0.00 1.34 0.00 0.00 72.50 72.32 3hyg s THR 433 CO 0.09 -0.20 -0.00 -1.61 -0.54 0.00 0.00 174.62 172.35 3hyg s GLU 434 N -2.09 3.66 0.50 3.99 2.02 -1.26 -5.07 118.70 120.46 3hyg s GLU 434 Ca 0.05 -0.45 0.05 0.00 0.02 0.00 0.00 54.97 54.64 3hyg s GLU 434 Cb -0.09 -2.98 0.03 0.00 0.10 0.00 0.00 34.13 31.19 3hyg s GLU 434 CO 0.04 0.32 0.69 -0.51 0.02 0.00 0.00 175.26 175.82 3hyg s ASP 435 N 0.18 5.39 -1.17 -0.19 1.01 -1.26 -4.60 116.67 116.04 3hyg s ASP 435 Ca 0.00 -0.28 0.00 0.00 0.71 0.00 0.00 52.55 52.99 3hyg s ASP 435 Cb -0.13 -0.65 0.00 0.00 1.01 0.00 0.00 42.92 43.15 3hyg s ASP 435 CO 0.02 -1.02 0.00 0.29 0.21 0.00 0.00 175.17 174.67 3hyg n LYS 436 N -2.13 -0.89 -4.34 8.23 5.02 -1.26 -4.97 118.16 117.82 3hyg n LYS 436 Ca 0.09 0.78 -0.25 0.00 -2.02 0.00 0.00 58.31 56.91 3hyg n LYS 436 Cb 0.60 -4.86 -0.09 0.00 -0.02 0.00 0.00 35.03 30.66 3hyg n LYS 436 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3hyg s ARG 437 N -3.70 2.07 0.47 1.97 1.81 -1.26 -1.64 118.95 118.67 3hyg s ARG 437 Ca 0.00 -1.77 0.18 0.00 -1.72 0.00 0.00 55.73 52.42 3hyg s ARG 437 Cb 0.00 -1.91 1.13 0.00 -0.45 0.00 0.00 34.95 33.71 3hyg s ARG 437 CO 0.00 0.11 2.01 -0.07 -0.68 0.00 0.00 175.30 176.67 3hyg h LEU 438 N 1.79 0.00 -1.52 2.53 3.38 -1.32 -2.26 115.31 117.91 3hyg h LEU 438 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3hyg h LEU 438 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3hyg h LEU 438 CO 0.68 0.18 0.00 0.23 0.09 0.00 0.00 178.44 179.61 3hyg n MET 439 N -4.10 2.03 -1.77 1.13 2.81 -1.26 -4.66 117.12 111.31 3hyg n MET 439 Ca -0.02 -1.40 -0.41 0.00 -1.81 0.00 0.00 57.70 54.06 3hyg n MET 439 Cb 0.25 -1.38 0.00 0.00 -0.71 0.00 0.00 33.22 31.39 3hyg n MET 439 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3hyg n SER 440 N 0.57 3.67 0.27 7.83 2.88 -0.85 -1.07 113.62 126.91 3hyg n SER 440 Ca 0.13 1.22 0.13 0.00 -1.33 0.00 0.00 58.87 59.02 3hyg n SER 440 Cb 0.38 -1.61 0.75 0.00 -0.75 0.00 0.00 64.21 62.98 3hyg n SER 440 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 3hyg h SER 441 N 2.84 0.00 -3.37 -3.46 4.64 -1.91 -3.43 113.55 108.87 3hyg h SER 441 Ca -0.50 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.32 3hyg h SER 441 Cb 1.25 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.99 3hyg h SER 441 CO 0.63 0.10 -0.80 0.27 -0.87 0.00 0.00 176.83 176.17 3hyg s ILE 442 N -4.23 0.98 -0.93 0.95 -0.00 -1.26 -5.07 121.20 111.63 3hyg s ILE 442 Ca -0.03 -0.35 -0.29 0.00 -0.00 0.00 0.00 60.65 59.98 3hyg s ILE 442 Cb 0.13 -0.94 -0.21 0.00 -0.00 0.00 0.00 42.46 41.45 3hyg s ILE 442 CO 0.58 0.33 2.62 -0.11 -0.00 0.00 0.00 174.94 178.36 3hyg n LEU 443 N 4.15 0.43 0.00 0.37 0.00 -1.26 -4.92 117.00 115.77 3hyg n LEU 443 Ca -0.20 0.02 0.00 0.00 0.00 0.00 0.00 56.01 55.83 3hyg n LEU 443 Cb 0.51 -0.98 0.00 0.00 0.00 0.00 0.00 43.42 42.95 3hyg n LEU 443 CO 0.23 -0.90 0.00 0.35 0.00 0.00 0.00 177.39 177.07 3hyg n THR 444 N 7.44 0.00 -1.69 1.96 -2.24 -1.26 -5.10 114.28 113.38 3hyg n THR 444 Ca 0.62 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 62.10 3hyg n THR 444 Cb 0.11 -1.05 0.04 0.00 -2.10 0.00 0.00 70.33 67.33 3hyg n THR 444 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3hyg s SER 445 N -1.00 5.54 -0.17 3.42 1.04 -1.26 -5.05 113.70 116.22 3hyg s SER 445 Ca 0.00 1.47 -0.03 0.00 0.48 0.00 0.00 55.95 57.86 3hyg s SER 445 Cb 0.00 -2.37 -0.02 0.00 0.10 0.00 0.00 66.02 63.72 3hyg s SER 445 CO 0.00 -1.32 -0.04 -0.63 0.98 0.00 0.00 173.24 172.23 3hyg s ILE 446 N -3.13 3.69 -0.44 -1.02 -1.09 -1.26 -4.29 121.20 113.66 3hyg s ILE 446 Ca 0.57 -0.42 -0.28 0.00 -2.23 0.00 0.00 60.65 58.30 3hyg s ILE 446 Cb -0.13 -2.63 -0.01 0.00 -1.58 0.00 0.00 42.46 38.11 3hyg s ILE 446 CO 0.54 0.47 1.66 -0.62 -1.23 0.00 0.00 174.94 175.76 3hyg s ASP 447 N 0.71 5.91 0.45 3.58 -1.08 -0.65 -4.89 116.67 120.70 3hyg s ASP 447 Ca -0.02 0.84 0.12 0.00 -0.52 0.00 0.00 52.55 52.97 3hyg s ASP 447 Cb -0.15 -2.53 1.03 0.00 -1.46 0.00 0.00 42.92 39.82 3hyg s ASP 447 CO 0.02 -1.77 2.04 0.00 0.52 0.00 0.00 175.17 175.98 3hyg h ALA 448 N 12.48 1.93 0.00 3.66 0.00 -1.97 -1.09 119.26 134.26 3hyg h ALA 448 Ca -0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3hyg h ALA 448 Cb 1.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3hyg h ALA 448 CO 1.10 0.00 -0.02 0.66 0.00 0.00 0.00 179.25 181.00 3hyg h SER 449 N 0.36 0.00 -1.01 0.00 4.64 -2.00 -3.38 113.55 112.16 3hyg h SER 449 Ca 0.18 -0.01 -0.31 0.00 -0.47 0.00 0.00 61.79 61.18 3hyg h SER 449 Cb 0.24 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.11 3hyg h SER 449 CO -0.04 0.00 -0.66 1.17 -0.87 0.00 0.00 176.83 176.43 3hyg n LYS 450 N -2.30 0.60 0.09 4.77 4.81 -0.55 -4.92 118.16 120.66 3hyg n LYS 450 Ca 0.05 -2.29 0.11 0.00 -0.87 0.00 0.00 58.31 55.32 3hyg n LYS 450 Cb 0.44 -1.46 0.45 0.00 0.02 0.00 0.00 35.03 34.48 3hyg n LYS 450 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3hyg n PRO 451 N 2.23 0.16 -5.24 1.64 -0.04 -0.53 -4.44 135.00 128.78 3hyg n PRO 451 Ca 0.17 0.32 -0.31 0.00 -0.04 0.00 0.00 63.50 63.64 3hyg n PRO 451 Cb 0.57 -1.76 -0.15 0.00 -0.04 0.00 0.00 33.50 32.11 3hyg n PRO 451 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3hyg s TRP 452 N -3.19 2.40 0.75 0.54 0.52 -1.26 -0.80 118.94 117.89 3hyg s TRP 452 Ca 0.07 -0.39 -0.11 0.00 0.02 0.00 0.00 56.10 55.68 3hyg s TRP 452 Cb 0.11 -1.52 0.04 0.00 -1.15 0.00 0.00 33.47 30.94 3hyg s TRP 452 CO 0.42 -0.00 1.09 -1.54 0.02 0.00 0.00 176.95 176.94 3hyg s SER 453 N -0.63 4.96 0.29 2.95 1.04 -1.26 -4.82 113.70 116.23 3hyg s SER 453 Ca 0.10 1.26 -0.00 0.00 0.48 0.00 0.00 55.95 57.79 3hyg s SER 453 Cb -0.10 -2.03 0.44 0.00 0.10 0.00 0.00 66.02 64.43 3hyg s SER 453 CO -0.01 -1.67 1.84 0.50 0.98 0.00 0.00 173.24 174.89 3hyg h LYS 454 N -0.88 0.78 -0.73 4.02 1.63 -1.99 -1.34 116.57 118.06 3hyg h LYS 454 Ca -0.46 -0.15 0.02 0.00 -0.85 0.00 0.00 60.65 59.20 3hyg h LYS 454 Cb 1.26 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 32.73 3hyg h LYS 454 CO 0.61 0.71 0.47 0.00 -3.45 0.00 0.00 179.45 177.79 3hyg h THR 456 N 0.95 0.95 -0.59 0.00 2.02 -1.81 -1.34 112.91 113.10 3hyg h THR 456 Ca 0.28 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.20 3hyg h THR 456 Cb -0.06 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 3hyg h THR 456 CO -0.08 0.06 0.31 0.77 0.37 0.00 0.00 175.52 176.95 3hyg h SER 457 N -0.27 0.74 -0.78 4.18 4.64 -1.00 -0.08 113.55 121.00 3hyg h SER 457 Ca -0.02 -0.11 -0.02 0.00 -0.47 0.00 0.00 61.79 61.17 3hyg h SER 457 Cb 0.22 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.08 3hyg h SER 457 CO 0.03 0.64 0.39 0.00 -0.87 0.00 0.00 176.83 177.02 3hyg h ALA 458 N 1.14 1.00 -0.27 5.18 0.00 -1.14 -2.24 119.26 122.92 3hyg h ALA 458 Ca 0.20 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3hyg h ALA 458 Cb 0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3hyg h ALA 458 CO -0.03 0.54 -0.26 1.15 0.00 0.00 0.00 179.25 180.65 3hyg h THR 459 N 1.09 1.31 -0.41 0.00 2.02 -0.73 -2.28 112.91 113.89 3hyg h THR 459 Ca 0.27 -1.42 0.04 0.00 0.77 0.00 0.00 66.41 66.07 3hyg h THR 459 Cb 0.09 1.61 -0.04 0.00 -1.74 0.00 0.00 68.15 68.07 3hyg h THR 459 CO -0.04 0.45 0.17 0.40 0.37 0.00 0.00 175.52 176.87 3hyg h ILE 460 N 0.38 0.91 -0.39 3.11 2.04 -0.99 -0.48 117.51 122.10 3hyg h ILE 460 Ca 0.04 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.80 3hyg h ILE 460 Cb 0.82 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 3hyg h ILE 460 CO 0.07 0.06 0.24 0.74 0.00 0.00 0.00 178.15 179.26 3hyg h THR 461 N 0.34 1.07 -0.67 -0.27 2.02 -1.26 -0.98 112.91 113.17 3hyg h THR 461 Ca 0.19 -0.17 -0.06 0.00 0.77 0.00 0.00 66.41 67.13 3hyg h THR 461 Cb 0.15 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 3hyg h THR 461 CO -0.17 0.09 0.17 -0.33 0.37 0.00 0.00 175.52 175.65 3hyg h GLU 462 N 0.49 1.07 -0.33 6.66 5.08 -1.17 -0.85 114.58 125.53 3hyg h GLU 462 Ca 0.15 -0.25 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3hyg h GLU 462 Cb -0.03 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 3hyg h GLU 462 CO -0.05 0.95 0.21 0.35 -1.00 0.00 0.00 179.01 179.47 3hyg h PHE 463 N 0.99 0.40 -0.33 4.33 3.57 -0.63 0.22 116.94 125.49 3hyg h PHE 463 Ca 0.21 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.62 3hyg h PHE 463 Cb 0.36 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 3hyg h PHE 463 CO 0.03 0.24 -0.17 -0.07 -2.23 0.00 0.00 178.31 176.11 3hyg h LEU 464 N 0.43 0.73 -1.30 0.59 3.38 -1.10 -2.31 115.31 115.73 3hyg h LEU 464 Ca 0.13 -0.41 0.03 0.00 0.09 0.00 0.00 57.88 57.71 3hyg h LEU 464 Cb -0.03 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 3hyg h LEU 464 CO -0.04 0.98 0.49 -0.78 0.09 0.00 0.00 178.44 179.18 3hyg h ASP 465 N 0.47 0.80 0.36 -0.43 3.58 -0.92 -1.68 116.42 118.60 3hyg h ASP 465 Ca 0.07 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.51 3hyg h ASP 465 Cb 0.71 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.57 3hyg h ASP 465 CO 0.05 0.56 0.00 0.47 -2.88 0.00 0.00 179.24 177.44 3hyg n ASP 466 N -4.44 0.00 0.00 2.28 8.00 0.76 -4.89 116.55 118.25 3hyg n ASP 466 Ca 0.09 -0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.45 3hyg n ASP 466 Cb 0.09 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 3hyg n ASP 466 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hyg n GLY 467 N 0.61 0.68 0.50 0.44 0.00 -0.63 -4.97 105.19 101.81 3hyg n GLY 467 Ca 0.12 -0.63 0.13 0.00 0.00 0.00 0.00 46.02 45.63 3hyg n GLY 467 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3hyg n HIS 468 N -2.61 0.00 -1.52 1.61 8.25 -0.88 -3.99 115.22 116.09 3hyg n HIS 468 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.49 3hyg n HIS 468 Cb 0.03 -0.04 0.20 0.00 1.12 0.00 0.00 29.99 31.31 3hyg n HIS 468 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hyg n GLY 469 N 1.29 5.05 0.24 -1.41 0.00 -1.26 -4.23 105.19 104.86 3hyg n GLY 469 Ca 0.15 -1.27 0.09 0.00 0.00 0.00 0.00 46.02 44.99 3hyg n GLY 469 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3hyg h ASN 470 N 0.95 0.00 0.24 1.61 2.35 -1.91 -1.82 115.58 117.00 3hyg h ASN 470 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3hyg h ASN 470 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.56 3hyg h ASN 470 CO 0.11 0.20 0.00 0.00 -1.65 0.00 0.00 177.43 176.09 3hyg n LEU 472 N -1.16 3.06 0.07 0.00 4.77 -0.68 -4.44 117.00 118.62 3hyg n LEU 472 Ca 0.14 -1.24 -0.06 0.00 -0.03 0.00 0.00 56.01 54.81 3hyg n LEU 472 Cb 0.14 -0.17 -0.08 0.00 -2.33 0.00 0.00 43.42 40.98 3hyg n LEU 472 CO 0.16 0.62 0.19 -0.07 -1.33 0.00 0.00 177.39 176.95 3hyg h LEU 473 N 4.18 0.00-10.43 2.23 3.38 -1.64 0.19 115.31 113.21 3hyg h LEU 473 Ca 0.00 -0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.47 3hyg h LEU 473 Cb 0.91 -0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.73 3hyg h LEU 473 CO 0.00 0.95 0.36 1.51 0.09 0.00 0.00 178.44 181.35 3hyg s ASP 474 N -6.73 5.73 0.05 -0.43 -4.77 -1.26 -4.84 116.67 104.42 3hyg s ASP 474 Ca 0.01 1.14 -0.05 0.00 -3.30 0.00 0.00 52.55 50.34 3hyg s ASP 474 Cb 0.10 -2.06 -0.05 0.00 -1.09 0.00 0.00 42.92 39.82 3hyg s ASP 474 CO 0.81 -1.13 0.29 -0.76 0.70 0.00 0.00 175.17 175.09 3hyg s LEU 475 N -5.22 4.34 0.43 2.11 1.43 -1.26 -4.58 118.68 115.94 3hyg s LEU 475 Ca 0.56 0.54 -0.25 0.00 -1.03 0.00 0.00 54.13 53.95 3hyg s LEU 475 Cb -0.11 -2.89 -0.08 0.00 0.03 0.00 0.00 46.19 43.14 3hyg s LEU 475 CO 0.51 0.19 1.28 -2.16 0.23 0.00 0.00 176.35 176.40 3hyg s PRO 476 N -2.10 3.82 0.17 1.29 0.04 -1.26 -4.93 135.00 132.03 3hyg s PRO 476 Ca 0.32 2.09 -0.02 0.00 0.04 0.00 0.00 61.00 63.44 3hyg s PRO 476 Cb -0.13 -2.62 0.04 0.00 0.04 0.00 0.00 34.50 31.83 3hyg s PRO 476 CO 0.20 -0.60 1.43 0.00 0.04 0.00 0.00 177.00 178.07 3hyg h ARG 477 N 2.39 0.42 -1.01 4.56 3.08 -1.91 -3.41 114.38 118.51 3hyg h ARG 477 Ca -0.50 -0.35 -0.38 0.00 0.07 0.00 0.00 59.98 58.83 3hyg h ARG 477 Cb 1.25 0.07 -0.27 0.00 0.08 0.00 0.00 29.97 31.11 3hyg h ARG 477 CO 0.61 0.99 -0.81 1.17 -1.07 0.00 0.00 179.97 180.86 3hyg n LYS 478 N -3.84 0.86 -1.62 0.04 4.81 -1.26 -5.12 118.16 112.03 3hyg n LYS 478 Ca -0.04 -2.56 -0.54 0.00 -0.87 0.00 0.00 58.31 54.29 3hyg n LYS 478 Cb 0.71 -1.35 -0.06 0.00 0.02 0.00 0.00 35.03 34.34 3hyg n LYS 478 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3hyg n GLN 479 N 0.96 1.06 0.00 1.64 6.02 -1.26 -4.74 117.38 121.06 3hyg n GLN 479 Ca 0.15 0.39 0.13 0.00 -0.01 0.00 0.00 57.00 57.66 3hyg n GLN 479 Cb 0.63 -2.03 0.36 0.00 1.02 0.00 0.00 30.24 30.22 3hyg n GLN 479 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16