#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n83 h HIS 262 N 0.00 0.82 -0.44 1.57 3.86 -2.06 -1.18 115.15 117.73 1n83 h HIS 262 Ca 0.00 0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 1n83 h HIS 262 Cb 0.00 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 1n83 h HIS 262 CO 0.00 -0.11 0.02 -0.07 0.86 0.00 0.00 177.93 178.63 1n83 h LEU 263 N 0.38 0.74 -0.94 2.43 3.38 -2.06 -1.90 115.31 117.35 1n83 h LEU 263 Ca 0.66 -0.30 0.07 0.00 0.09 0.00 0.00 57.88 58.40 1n83 h LEU 263 Cb 1.40 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.89 1n83 h LEU 263 CO -0.57 0.86 0.60 -0.08 0.09 0.00 0.00 178.44 179.33 1n83 h GLU 264 N 0.61 1.05 -0.48 1.13 4.81 -1.78 -1.41 114.58 118.51 1n83 h GLU 264 Ca 0.13 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 1n83 h GLU 264 Cb 0.46 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1n83 h GLU 264 CO 0.02 0.69 0.12 0.28 -0.73 0.00 0.00 179.01 179.39 1n83 h VAL 265 N 1.08 1.24 0.00 0.32 2.07 -1.01 -0.97 116.25 118.97 1n83 h VAL 265 Ca 0.41 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 1n83 h VAL 265 Cb 0.18 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1n83 h VAL 265 CO -0.18 0.30 -0.01 -0.07 0.02 0.00 0.00 177.57 177.63 1n83 h LEU 266 N 0.66 0.00 0.00 2.57 3.38 -0.46 -2.87 115.31 118.59 1n83 h LEU 266 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1n83 h LEU 266 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1n83 h LEU 266 CO 0.00 0.01 -1.29 0.49 0.09 0.00 0.00 178.44 177.75 1n83 n PHE 267 N -3.92 0.00 -0.31 1.13 3.01 -0.82 -4.69 117.46 111.85 1n83 n PHE 267 Ca -0.03 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.56 1n83 n PHE 267 Cb 0.09 -0.18 0.27 0.00 -0.01 0.00 0.00 39.48 39.66 1n83 n PHE 267 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1n83 h GLN 268 N 0.00 0.07 0.08 -1.08 4.15 -0.95 0.58 115.11 117.97 1n83 h GLN 268 Ca 0.00 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 1n83 h GLN 268 Cb 0.62 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.29 1n83 h GLN 268 CO 0.00 0.05 -0.04 0.78 -1.93 0.00 0.00 178.83 177.69 1n83 h GLY 269 N 0.07 -0.11 1.09 2.39 0.00 -1.84 -1.29 103.07 103.39 1n83 h GLY 269 Ca 0.56 0.04 0.08 0.00 0.00 0.00 0.00 47.33 48.01 1n83 h GLY 269 CO -0.80 -0.04 0.41 -2.55 0.00 0.00 0.00 176.54 173.56 1n83 h PRO 270 N -0.11 0.53 -0.77 4.80 0.11 -1.88 -1.40 132.00 133.27 1n83 h PRO 270 Ca -0.01 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.09 1n83 h PRO 270 Cb 0.08 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 31.03 1n83 h PRO 270 CO 0.02 0.35 0.50 0.00 -0.21 0.00 0.00 178.00 178.65 1n83 h ALA 271 N 1.67 1.01 -0.47 -0.75 0.00 -0.85 0.79 119.26 120.66 1n83 h ALA 271 Ca 0.28 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1n83 h ALA 271 Cb 0.39 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1n83 h ALA 271 CO -0.08 0.33 0.18 1.49 0.00 0.00 0.00 179.25 181.16 1n83 h GLU 272 N 0.98 0.71 -0.14 0.00 4.57 -0.12 0.24 114.58 120.81 1n83 h GLU 272 Ca 0.30 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.34 1n83 h GLU 272 Cb -0.02 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.45 1n83 h GLU 272 CO -0.10 0.64 0.07 -0.07 -1.18 0.00 0.00 179.01 178.38 1n83 h LEU 273 N 0.62 0.19 -0.58 1.64 3.38 -1.03 -0.80 115.31 118.72 1n83 h LEU 273 Ca 0.16 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1n83 h LEU 273 Cb 0.21 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1n83 h LEU 273 CO -0.01 0.25 0.30 -0.08 0.09 0.00 0.00 178.44 179.00 1n83 h GLU 274 N 0.11 0.83 -0.36 1.13 4.57 -0.67 -0.07 114.58 120.12 1n83 h GLU 274 Ca 0.05 -0.11 0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1n83 h GLU 274 Cb 0.11 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 1n83 h GLU 274 CO -0.01 0.65 0.17 1.25 -1.18 0.00 0.00 179.01 179.89 1n83 h HIS 275 N 0.79 0.31 -0.36 0.92 2.76 -0.27 0.16 115.15 119.46 1n83 h HIS 275 Ca 0.20 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.29 1n83 h HIS 275 Cb 0.08 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 28.93 1n83 h HIS 275 CO -0.01 0.16 -0.18 1.25 -1.30 0.00 0.00 177.93 177.86 1n83 h LEU 276 N 0.35 0.67 -0.22 0.26 5.85 -0.91 -1.19 115.31 120.12 1n83 h LEU 276 Ca 0.15 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 1n83 h LEU 276 Cb 0.08 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1n83 h LEU 276 CO -0.12 0.85 0.06 0.00 -0.34 0.00 0.00 178.44 178.90 1n83 h ALA 277 N 1.20 0.29 -0.56 1.25 0.00 -0.50 -2.49 119.26 118.46 1n83 h ALA 277 Ca 0.10 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1n83 h ALA 277 Cb 0.64 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1n83 h ALA 277 CO 0.04 -0.07 0.11 1.96 0.00 0.00 0.00 179.25 181.29 1n83 h GLN 278 N 0.18 0.88 0.11 0.00 4.20 -0.50 0.06 115.11 120.03 1n83 h GLN 278 Ca 0.07 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1n83 h GLN 278 Cb 0.26 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1n83 h GLN 278 CO -0.00 0.80 -0.05 -0.97 -0.67 0.00 0.00 178.83 177.94 1n83 h ASN 279 N 0.84 -0.12 -0.58 1.46 -1.24 -1.19 -1.17 115.58 113.58 1n83 h ASN 279 Ca 0.18 -0.16 -0.10 0.00 0.71 0.00 0.00 56.30 56.93 1n83 h ASN 279 Cb 0.35 0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.41 1n83 h ASN 279 CO 0.00 0.09 -0.03 0.40 -1.29 0.00 0.00 177.43 176.60 1n83 h ILE 280 N -0.34 1.27 -0.94 2.57 2.04 -1.37 -1.65 117.51 119.10 1n83 h ILE 280 Ca -0.01 -1.18 0.03 0.00 1.00 0.00 0.00 64.86 64.70 1n83 h ILE 280 Cb 0.28 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1n83 h ILE 280 CO 0.02 0.42 0.62 0.28 0.00 0.00 0.00 178.15 179.49 1n83 h SER 281 N 0.93 1.02 -0.31 1.72 0.02 -0.88 -0.52 113.55 115.52 1n83 h SER 281 Ca 0.16 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.97 1n83 h SER 281 Cb 0.59 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.89 1n83 h SER 281 CO 0.04 0.70 -0.30 0.50 -1.14 0.00 0.00 176.83 176.63 1n83 h LYS 282 N 1.19 0.75 -0.89 3.45 3.64 -0.98 -1.22 116.57 122.51 1n83 h LYS 282 Ca 0.37 -0.39 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1n83 h LYS 282 Cb 0.00 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1n83 h LYS 282 CO -0.11 1.02 0.54 0.77 -2.27 0.00 0.00 179.45 179.39 1n83 h SER 283 N 0.51 1.07 0.06 4.20 0.02 -0.76 -0.53 113.55 118.11 1n83 h SER 283 Ca 0.05 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1n83 h SER 283 Cb 0.88 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1n83 h SER 283 CO 0.08 0.82 -0.03 -0.74 -1.14 0.00 0.00 176.83 175.82 1n83 h HIS 284 N 1.22 -0.07 -0.86 3.45 -0.00 -1.02 -2.37 115.15 115.51 1n83 h HIS 284 Ca 0.32 -0.00 0.14 0.00 -0.00 0.00 0.00 60.37 60.83 1n83 h HIS 284 Cb -0.05 0.02 -0.09 0.00 -0.00 0.00 0.00 27.41 27.29 1n83 h HIS 284 CO 0.00 0.14 0.46 1.25 -0.00 0.00 0.00 177.93 179.78 1n83 h LEU 285 N -0.27 0.59 -0.15 0.26 5.85 -0.70 -1.58 115.31 119.30 1n83 h LEU 285 Ca -0.01 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1n83 h LEU 285 Cb 0.24 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.25 1n83 h LEU 285 CO 0.01 0.26 -0.09 -0.62 -0.34 0.00 0.00 178.44 177.66 1n83 n GLU 286 N -4.83 0.57 -0.14 1.25 1.02 -0.25 -3.62 120.64 114.63 1n83 n GLU 286 Ca 0.17 -0.15 0.08 0.00 -0.02 0.00 0.00 57.16 57.23 1n83 n GLU 286 Cb 0.42 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.45 1n83 n GLU 286 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1n83 n THR 287 N -1.08 1.50 -4.41 2.62 -2.24 -0.63 -4.98 114.28 105.06 1n83 n THR 287 Ca 0.14 -1.80 -0.34 0.00 -2.27 0.00 0.00 64.05 59.78 1n83 n THR 287 Cb 0.27 -0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.33 1n83 n THR 287 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n83 h GLN 289 N 5.74 0.96 -5.43 0.00 4.15 -1.93 -3.45 115.11 115.15 1n83 h GLN 289 Ca -0.44 -0.17 -0.42 0.00 0.77 0.00 0.00 58.65 58.40 1n83 h GLN 289 Cb 1.19 -0.16 -0.20 0.00 0.21 0.00 0.00 27.48 28.52 1n83 h GLN 289 CO 0.57 0.79 -0.77 0.71 -1.93 0.00 0.00 178.83 178.21 1n83 s TYR 290 N -5.41 1.34 0.55 3.99 1.51 -1.26 -5.14 117.35 112.95 1n83 s TYR 290 Ca -0.11 -0.51 -0.18 0.00 -1.01 0.00 0.00 57.07 55.26 1n83 s TYR 290 Cb 0.16 -0.73 -0.05 0.00 -0.11 0.00 0.00 41.96 41.23 1n83 s TYR 290 CO 0.81 0.11 1.09 -0.51 -1.11 0.00 0.00 175.55 175.94 1n83 s LEU 291 N -2.13 3.68 0.15 -1.29 1.43 -1.26 -4.91 118.68 114.35 1n83 s LEU 291 Ca 0.04 2.02 -0.17 0.00 -1.03 0.00 0.00 54.13 54.99 1n83 s LEU 291 Cb -0.07 -4.56 0.06 0.00 0.03 0.00 0.00 46.19 41.65 1n83 s LEU 291 CO 0.03 -1.15 1.69 -0.09 0.23 0.00 0.00 176.35 177.06 1n83 h ARG 292 N 0.99 0.04 -0.97 1.70 9.65 -2.00 -1.77 114.38 122.01 1n83 h ARG 292 Ca -0.49 -0.00 0.06 0.00 -1.10 0.00 0.00 59.98 58.45 1n83 h ARG 292 Cb 1.24 -0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 29.75 1n83 h ARG 292 CO 0.57 0.03 0.62 0.93 2.80 0.00 0.00 179.97 184.92 1n83 h GLU 293 N 0.05 1.10 -0.45 0.20 3.07 -1.94 -1.21 114.58 115.40 1n83 h GLU 293 Ca 0.16 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.94 1n83 h GLU 293 Cb 0.24 -0.25 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 1n83 h GLU 293 CO -0.31 0.73 0.22 0.93 -1.40 0.00 0.00 179.01 179.18 1n83 h GLU 294 N 1.14 0.65 -0.60 2.33 5.08 -1.71 -1.49 114.58 119.97 1n83 h GLU 294 Ca 0.42 -0.09 -0.09 0.00 -1.00 0.00 0.00 59.36 58.60 1n83 h GLU 294 Cb 0.16 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1n83 h GLU 294 CO -0.17 0.54 0.03 -0.07 -1.00 0.00 0.00 179.01 178.35 1n83 h LEU 295 N 0.59 1.01 -1.09 1.33 3.38 -0.84 -3.01 115.31 116.68 1n83 h LEU 295 Ca 0.16 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 1n83 h LEU 295 Cb 0.11 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1n83 h LEU 295 CO -0.02 1.06 -0.32 1.56 0.09 0.00 0.00 178.44 180.80 1n83 h GLN 296 N 0.94 0.23 0.00 1.13 4.20 -1.01 -2.98 115.11 117.62 1n83 h GLN 296 Ca 0.18 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.76 1n83 h GLN 296 Cb 0.51 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 1n83 h GLN 296 CO 0.02 0.53 -0.16 1.96 -0.67 0.00 0.00 178.83 180.52 1n83 h GLN 297 N 0.20 0.00 -0.29 1.46 4.20 -1.14 -3.08 115.11 116.47 1n83 h GLN 297 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1n83 h GLN 297 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1n83 h GLN 297 CO 0.05 0.16 0.00 0.44 -0.67 0.00 0.00 178.83 178.81 1n83 n ILE 298 N -3.46 1.93 0.23 2.54 -5.35 -1.13 -4.62 119.36 109.50 1n83 n ILE 298 Ca -0.01 -1.63 0.15 0.00 -0.27 0.00 0.00 62.75 61.00 1n83 n ILE 298 Cb 0.33 -0.04 0.82 0.00 -1.74 0.00 0.00 39.64 39.01 1n83 n ILE 298 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1n83 h THR 299 N 1.90 0.58 0.00 7.28 1.35 -1.55 0.00 112.91 122.47 1n83 h THR 299 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1n83 h THR 299 Cb 1.25 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1n83 h THR 299 CO 0.16 0.00 0.00 4.11 -0.25 0.00 0.00 175.52 179.54 1n83 h TRP 300 N 0.00 0.00 -0.07 4.73 5.08 -1.86 -3.37 115.95 120.46 1n83 h TRP 300 Ca 0.06 0.00 -0.70 0.00 1.08 0.00 0.00 58.89 59.33 1n83 h TRP 300 Cb 0.29 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 26.42 1n83 h TRP 300 CO 0.00 0.00 3.00 1.04 -1.28 0.00 0.00 178.44 181.20 1n83 n GLN 301 N -2.96 2.77 -2.52 0.12 6.02 -0.01 -4.93 117.38 115.87 1n83 n GLN 301 Ca 0.00 -2.60 -0.28 0.00 -0.01 0.00 0.00 57.00 54.11 1n83 n GLN 301 Cb 0.24 -3.28 -0.00 0.00 1.02 0.00 0.00 30.24 28.22 1n83 n GLN 301 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1n83 s THR 302 N 3.46 4.86 0.36 5.09 -4.23 -1.26 -1.53 115.64 122.39 1n83 s THR 302 Ca 0.48 0.36 -0.28 0.00 -1.18 0.00 0.00 61.69 61.07 1n83 s THR 302 Cb 0.13 -3.85 -0.11 0.00 1.34 0.00 0.00 72.50 70.01 1n83 s THR 302 CO -0.06 -0.88 1.50 -0.36 -0.54 0.00 0.00 174.62 174.29 1n83 s PHE 303 N -2.79 2.62 0.61 3.99 0.40 -0.94 -4.79 117.98 117.08 1n83 s PHE 303 Ca 0.49 1.10 -0.17 0.00 -0.60 0.00 0.00 56.93 57.76 1n83 s PHE 303 Cb -0.10 -4.03 -0.02 0.00 0.51 0.00 0.00 43.02 39.37 1n83 s PHE 303 CO 0.45 -3.09 1.12 -0.51 0.70 0.00 0.00 175.22 173.89 1n83 s LEU 304 N -1.82 3.52 0.32 -0.37 1.43 -1.26 -4.78 118.68 115.72 1n83 s LEU 304 Ca 0.54 2.06 0.07 0.00 -1.03 0.00 0.00 54.13 55.78 1n83 s LEU 304 Cb -0.47 -4.56 0.78 0.00 0.03 0.00 0.00 46.19 41.97 1n83 s LEU 304 CO 0.61 -1.47 1.78 -0.61 0.23 0.00 0.00 176.35 176.89 1n83 h GLN 305 N 0.47 0.70 -0.40 1.70 5.75 -2.00 0.11 115.11 121.45 1n83 h GLN 305 Ca -0.48 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 57.89 1n83 h GLN 305 Cb 1.25 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.63 1n83 h GLN 305 CO 0.55 0.47 -0.12 0.93 -2.65 0.00 0.00 178.83 178.01 1n83 h GLU 306 N 0.73 0.71 -0.49 1.69 5.08 -1.99 -1.41 114.58 118.90 1n83 h GLU 306 Ca 0.57 -0.23 -0.09 0.00 -1.00 0.00 0.00 59.36 58.61 1n83 h GLU 306 Cb 0.94 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1n83 h GLU 306 CO -0.36 0.80 -0.05 0.93 -1.00 0.00 0.00 179.01 179.34 1n83 h GLU 307 N 0.64 0.89 -0.43 2.33 5.08 -1.22 -0.55 114.58 121.33 1n83 h GLU 307 Ca 0.11 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1n83 h GLU 307 Cb 0.57 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1n83 h GLU 307 CO 0.04 0.95 0.25 0.82 -1.00 0.00 0.00 179.01 180.06 1n83 h ILE 308 N 0.74 1.14 -0.95 3.13 2.04 -0.81 -1.61 117.51 121.19 1n83 h ILE 308 Ca 0.13 -0.35 0.03 0.00 1.00 0.00 0.00 64.86 65.68 1n83 h ILE 308 Cb 0.58 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 1n83 h ILE 308 CO 0.03 0.15 0.62 -0.33 0.00 0.00 0.00 178.15 178.63 1n83 h GLU 309 N 0.56 1.18 -0.68 2.37 5.08 -1.08 -0.87 114.58 121.14 1n83 h GLU 309 Ca 0.15 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1n83 h GLU 309 Cb 0.02 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 28.97 1n83 h GLU 309 CO -0.03 0.78 0.31 -0.97 -1.00 0.00 0.00 179.01 178.10 1n83 h ASN 310 N 1.21 0.90 -0.61 1.42 -1.24 -0.42 -0.18 115.58 116.67 1n83 h ASN 310 Ca 0.37 -0.15 -0.09 0.00 0.71 0.00 0.00 56.30 57.14 1n83 h ASN 310 Cb -0.02 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.78 1n83 h ASN 310 CO -0.11 0.80 0.02 1.88 -1.29 0.00 0.00 177.43 178.73 1n83 h TYR 311 N 0.94 1.17 0.00 0.67 -1.99 -0.53 -2.64 116.97 114.59 1n83 h TYR 311 Ca 0.23 -0.19 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 1n83 h TYR 311 Cb 0.15 -0.31 -0.01 0.00 2.00 0.00 0.00 36.73 38.57 1n83 h TYR 311 CO 0.01 1.02 -0.24 1.96 -0.00 0.00 0.00 178.16 180.91 1n83 h GLN 312 N 0.99 0.00 0.00 4.88 4.20 -0.69 -1.98 115.11 122.50 1n83 h GLN 312 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1n83 h GLN 312 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1n83 h GLN 312 CO 0.03 0.24 0.00 0.09 -0.67 0.00 0.00 178.83 178.51 1n83 n ASN 313 N -3.83 0.45 -4.77 1.46 3.02 -0.12 -4.63 115.26 106.83 1n83 n ASN 313 Ca -0.02 0.55 -0.37 0.00 -0.03 0.00 0.00 54.58 54.71 1n83 n ASN 313 Cb 0.33 -0.67 -0.02 0.00 -0.61 0.00 0.00 39.78 38.81 1n83 n ASN 313 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1n83 s LYS 314 N -3.08 3.95 0.66 3.52 1.02 -0.75 -4.99 119.74 120.07 1n83 s LYS 314 Ca 0.11 1.75 -0.15 0.00 0.02 0.00 0.00 55.97 57.70 1n83 s LYS 314 Cb 0.14 -2.54 -0.00 0.00 -0.52 0.00 0.00 37.83 34.91 1n83 s LYS 314 CO 0.53 -0.38 1.11 -0.65 -0.92 0.00 0.00 175.35 175.03 1n83 s GLN 315 N -2.50 2.80 0.21 1.68 -1.52 -1.26 -4.76 119.66 114.31 1n83 s GLN 315 Ca 0.60 1.39 -0.11 0.00 -1.95 0.00 0.00 55.36 55.29 1n83 s GLN 315 Cb -0.28 -1.95 0.29 0.00 -0.22 0.00 0.00 33.01 30.85 1n83 s GLN 315 CO 0.35 -1.25 1.67 -0.09 -0.25 0.00 0.00 175.29 175.72 1n83 h ARG 316 N 0.03 0.13 0.00 2.91 2.43 -1.95 -0.64 114.38 117.29 1n83 h ARG 316 Ca -0.47 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 58.61 1n83 h ARG 316 Cb 1.25 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 1n83 h ARG 316 CO 0.54 0.09 -0.40 1.05 -1.51 0.00 0.00 179.97 179.73 1n83 h GLU 317 N 0.14 0.00 -0.04 0.20 9.09 -1.92 -0.68 114.58 121.36 1n83 h GLU 317 Ca 0.32 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.71 1n83 h GLU 317 Cb 0.51 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.61 1n83 h GLU 317 CO -0.50 0.40 -0.04 0.28 0.05 0.00 0.00 179.01 179.20 1n83 h VAL 318 N 0.00 1.37 -0.79 -1.06 2.07 -1.53 -0.55 116.25 115.77 1n83 h VAL 318 Ca -0.00 -1.18 -0.04 0.00 0.82 0.00 0.00 66.70 66.29 1n83 h VAL 318 Cb 0.74 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.55 1n83 h VAL 318 CO 0.05 0.32 0.32 -0.03 0.02 0.00 0.00 177.57 178.25 1n83 h MET 319 N -0.34 1.17 -0.26 1.57 1.85 -1.03 -1.82 114.93 116.07 1n83 h MET 319 Ca 0.01 -0.21 0.00 0.00 -0.61 0.00 0.00 59.70 58.89 1n83 h MET 319 Cb 0.54 -0.19 -0.01 0.00 0.43 0.00 0.00 31.60 32.36 1n83 h MET 319 CO 0.01 0.95 0.16 -1.49 -0.40 0.00 0.00 176.91 176.14 1n83 h TRP 320 N 1.15 0.33 -0.83 1.39 4.06 -1.08 -1.33 115.95 119.64 1n83 h TRP 320 Ca 0.26 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.19 1n83 h TRP 320 Cb 0.21 -0.11 -0.04 0.00 -1.00 0.00 0.00 29.16 28.22 1n83 h TRP 320 CO 0.02 0.23 0.43 0.37 -3.56 0.00 0.00 178.44 175.93 1n83 h GLN 321 N 0.34 1.17 -0.29 0.49 -0.00 -0.73 -0.14 115.11 115.95 1n83 h GLN 321 Ca 0.09 -0.15 -0.02 0.00 -0.00 0.00 0.00 58.65 58.57 1n83 h GLN 321 Cb -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 27.48 27.23 1n83 h GLN 321 CO -0.02 0.87 0.08 1.25 0.00 0.00 0.00 178.83 181.02 1n83 h LEU 322 N 1.16 0.43 -1.15 -2.39 5.85 -1.11 -0.66 115.31 117.45 1n83 h LEU 322 Ca 0.29 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1n83 h LEU 322 Cb 0.06 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1n83 h LEU 322 CO -0.04 0.53 0.23 0.00 -0.34 0.00 0.00 178.44 178.82 1n83 h ALA 324 N 1.44 0.73 -0.31 0.00 0.00 -0.65 0.26 119.26 120.72 1n83 h ALA 324 Ca 0.20 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1n83 h ALA 324 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1n83 h ALA 324 CO -0.02 0.60 0.21 0.82 0.00 0.00 0.00 179.25 180.86 1n83 h ILE 325 N 0.86 1.08 -0.30 0.00 2.04 -0.52 -1.08 117.51 119.59 1n83 h ILE 325 Ca 0.14 -0.15 -0.14 0.00 1.00 0.00 0.00 64.86 65.71 1n83 h ILE 325 Cb 0.61 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1n83 h ILE 325 CO 0.04 0.08 -0.38 0.11 0.00 0.00 0.00 178.15 178.00 1n83 h LYS 326 N 0.42 0.69 -0.59 2.37 1.79 -0.94 -1.81 116.57 118.50 1n83 h LYS 326 Ca 0.11 -0.35 -0.02 0.00 -2.18 0.00 0.00 60.65 58.22 1n83 h LYS 326 Cb -0.04 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.58 1n83 h LYS 326 CO -0.02 0.96 0.31 0.82 -1.08 0.00 0.00 179.45 180.43 1n83 h ILE 327 N 0.57 1.20 -0.85 1.86 2.04 -0.85 -2.66 117.51 118.82 1n83 h ILE 327 Ca 0.05 -0.53 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 1n83 h ILE 327 Cb 0.90 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 1n83 h ILE 327 CO 0.08 0.22 0.41 0.74 0.00 0.00 0.00 178.15 179.60 1n83 h THR 328 N 0.81 1.26 -0.53 -0.27 2.02 -0.85 0.39 112.91 115.74 1n83 h THR 328 Ca 0.21 -0.74 0.04 0.00 0.77 0.00 0.00 66.41 66.69 1n83 h THR 328 Cb 0.07 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.61 1n83 h THR 328 CO -0.03 0.32 0.28 -0.33 0.37 0.00 0.00 175.52 176.12 1n83 h GLU 329 N 1.22 0.53 -0.67 6.66 5.08 -1.12 -1.08 114.58 125.19 1n83 h GLU 329 Ca 0.29 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.55 1n83 h GLU 329 Cb 0.12 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1n83 h GLU 329 CO -0.04 0.35 0.14 0.00 -1.00 0.00 0.00 179.01 178.46 1n83 h ALA 330 N 1.27 0.97 -0.81 3.43 0.00 -1.01 -2.87 119.26 120.24 1n83 h ALA 330 Ca 0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1n83 h ALA 330 Cb 0.12 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1n83 h ALA 330 CO -0.15 0.65 0.42 0.82 0.00 0.00 0.00 179.25 181.00 1n83 h ILE 331 N 1.02 1.25 -0.79 0.00 2.04 -0.31 -2.27 117.51 118.46 1n83 h ILE 331 Ca 0.21 -0.65 0.16 0.00 1.00 0.00 0.00 64.86 65.58 1n83 h ILE 331 Cb 0.40 0.18 -0.10 0.00 -0.74 0.00 0.00 36.82 36.56 1n83 h ILE 331 CO 0.01 0.28 0.32 1.56 0.00 0.00 0.00 178.15 180.32 1n83 h GLN 332 N 1.14 0.43 -0.67 2.37 4.20 -0.99 0.18 115.11 121.78 1n83 h GLN 332 Ca 0.28 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.90 1n83 h GLN 332 Cb 0.07 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1n83 h GLN 332 CO -0.04 0.28 0.13 1.88 -0.67 0.00 0.00 178.83 180.42 1n83 h TYR 333 N 0.44 1.13 -0.47 2.96 -1.99 -1.41 -2.44 116.97 115.19 1n83 h TYR 333 Ca 0.44 -0.14 -0.08 0.00 2.00 0.00 0.00 58.73 60.96 1n83 h TYR 333 Cb 0.71 -0.32 -0.02 0.00 2.00 0.00 0.00 36.73 39.10 1n83 h TYR 333 CO -0.16 0.94 -0.02 0.28 -0.00 0.00 0.00 178.16 179.19 1n83 h VAL 334 N 1.02 1.24 -0.76 -2.88 2.07 -0.51 -1.31 116.25 115.12 1n83 h VAL 334 Ca 0.21 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 1n83 h VAL 334 Cb 0.40 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1n83 h VAL 334 CO 0.01 0.36 0.43 0.58 0.02 0.00 0.00 177.57 178.97 1n83 h VAL 335 N 0.73 1.23 -0.50 2.57 2.07 -0.36 0.36 116.25 122.35 1n83 h VAL 335 Ca 0.14 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 1n83 h VAL 335 Cb 0.48 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1n83 h VAL 335 CO 0.02 0.25 0.13 -0.33 0.02 0.00 0.00 177.57 177.66 1n83 h GLU 336 N 1.05 0.75 0.16 1.57 4.39 -0.96 -1.50 114.58 120.03 1n83 h GLU 336 Ca 0.27 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.83 1n83 h GLU 336 Cb 0.01 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 1n83 h GLU 336 CO -0.05 0.67 -0.07 0.35 -1.16 0.00 0.00 179.01 178.75 1n83 h PHE 337 N 0.73 -0.19 -0.72 4.33 3.57 -0.52 -3.10 116.94 121.03 1n83 h PHE 337 Ca 0.17 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.79 1n83 h PHE 337 Cb 0.25 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 38.96 1n83 h PHE 337 CO 0.01 0.03 0.29 0.00 -2.23 0.00 0.00 178.31 176.41 1n83 h ALA 338 N 0.42 0.99 -0.13 2.41 0.00 -0.60 -0.56 119.26 121.80 1n83 h ALA 338 Ca -0.02 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1n83 h ALA 338 Cb 0.31 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1n83 h ALA 338 CO 0.04 -0.19 0.12 0.87 0.00 0.00 0.00 179.25 180.09 1n83 h LYS 339 N 0.45 0.00 -0.01 0.00 1.57 -1.21 -1.09 116.57 116.28 1n83 h LYS 339 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1n83 h LYS 339 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1n83 h LYS 339 CO -0.37 0.00 -0.36 0.54 -0.57 0.00 0.00 179.45 178.69 1n83 n ARG 340 N -4.00 0.76 -2.45 3.15 1.74 -0.23 -4.62 116.66 111.00 1n83 n ARG 340 Ca 0.00 -0.50 -0.42 0.00 -0.77 0.00 0.00 57.85 56.16 1n83 n ARG 340 Cb 0.24 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 1n83 n ARG 340 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1n83 s ILE 341 N -2.58 4.23 0.19 0.55 1.01 -0.42 -4.94 121.20 119.25 1n83 s ILE 341 Ca 0.21 1.56 -0.32 0.00 0.00 0.00 0.00 60.65 62.11 1n83 s ILE 341 Cb 0.19 -4.00 -0.11 0.00 0.01 0.00 0.00 42.46 38.54 1n83 s ILE 341 CO 0.57 0.01 1.63 -1.81 0.00 0.00 0.00 174.94 175.33 1n83 s ASP 342 N 1.45 6.50 0.00 3.58 1.01 -1.26 -1.59 116.67 126.37 1n83 s ASP 342 Ca 0.56 2.73 0.00 0.00 0.71 0.00 0.00 52.55 56.55 1n83 s ASP 342 Cb -0.25 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.08 1n83 s ASP 342 CO 0.23 -0.88 0.00 0.61 0.21 0.00 0.00 175.17 175.33 1n83 n GLY 343 N 3.73 2.72 0.13 0.21 0.00 -1.26 -4.95 105.19 105.78 1n83 n GLY 343 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 1n83 n GLY 343 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1n83 h PHE 344 N 0.00 0.36 0.00 1.61 3.57 -1.58 -2.49 116.94 118.41 1n83 h PHE 344 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1n83 h PHE 344 Cb 0.00 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.63 1n83 h PHE 344 CO 0.00 0.37 0.00 0.52 -2.23 0.00 0.00 178.31 176.97 1n83 h MET 345 N 0.24 0.00 0.00 1.11 2.86 -1.82 -2.65 114.93 114.67 1n83 h MET 345 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1n83 h MET 345 Cb 0.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1n83 h MET 345 CO -0.01 0.00 0.00 0.93 1.06 0.00 0.00 176.91 178.89 1n83 h GLU 346 N 0.00 0.00 -7.19 1.72 5.08 -1.82 -3.46 114.58 108.92 1n83 h GLU 346 Ca 0.00 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.86 1n83 h GLU 346 Cb 0.46 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.78 1n83 h GLU 346 CO 0.00 0.00 0.38 -0.51 -1.00 0.00 0.00 179.01 177.88 1n83 s LEU 347 N -5.55 3.49 0.67 1.33 1.43 -1.00 -4.99 118.68 114.06 1n83 s LEU 347 Ca 0.08 1.91 -0.17 0.00 -1.03 0.00 0.00 54.13 54.92 1n83 s LEU 347 Cb 0.08 -4.54 0.01 0.00 0.03 0.00 0.00 46.19 41.76 1n83 s LEU 347 CO 0.63 -1.32 1.25 0.00 0.23 0.00 0.00 176.35 177.14 1n83 h GLN 349 N 0.27 0.75 -0.55 0.00 4.15 -1.94 -1.16 115.11 116.64 1n83 h GLN 349 Ca -0.50 -0.05 0.08 0.00 0.77 0.00 0.00 58.65 58.95 1n83 h GLN 349 Cb 1.32 -0.17 -0.06 0.00 0.21 0.00 0.00 27.48 28.78 1n83 h GLN 349 CO 0.52 0.50 0.20 -0.91 -1.93 0.00 0.00 178.83 177.21 1n83 h ASN 350 N 0.77 0.21 0.39 -0.69 -0.26 -1.99 -0.87 115.58 113.13 1n83 h ASN 350 Ca 0.45 0.07 -0.20 0.00 -0.56 0.00 0.00 56.30 56.06 1n83 h ASN 350 Cb 0.63 0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 37.93 1n83 h ASN 350 CO -0.21 0.14 -0.84 0.44 -1.06 0.00 0.00 177.43 175.90 1n83 h ASP 351 N 0.39 0.42 -0.68 5.81 3.32 -1.60 -1.53 116.42 122.54 1n83 h ASP 351 Ca 0.27 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1n83 h ASP 351 Cb 0.30 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1n83 h ASP 351 CO -0.27 1.09 0.38 1.56 -1.72 0.00 0.00 179.24 180.28 1n83 h GLN 352 N 0.20 0.94 -0.28 3.56 4.20 -0.86 -0.12 115.11 122.75 1n83 h GLN 352 Ca -0.05 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.50 1n83 h GLN 352 Cb 1.45 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 1n83 h GLN 352 CO 0.14 0.69 -0.03 0.82 -0.67 0.00 0.00 178.83 179.78 1n83 h ILE 353 N 0.92 1.27 -0.43 2.54 2.04 -1.08 -1.26 117.51 121.51 1n83 h ILE 353 Ca 0.24 -1.00 0.03 0.00 1.00 0.00 0.00 64.86 65.13 1n83 h ILE 353 Cb 0.02 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 1n83 h ILE 353 CO -0.04 0.32 0.22 0.58 0.00 0.00 0.00 178.15 179.23 1n83 h VAL 354 N 0.30 0.98 -0.71 1.67 2.07 -0.98 0.16 116.25 119.73 1n83 h VAL 354 Ca 0.08 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1n83 h VAL 354 Cb 0.48 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1n83 h VAL 354 CO 0.02 0.08 0.24 -0.07 0.02 0.00 0.00 177.57 177.86 1n83 h LEU 355 N 0.44 1.03 -0.26 2.57 3.38 -0.89 -1.99 115.31 119.60 1n83 h LEU 355 Ca 0.18 -0.20 -0.20 0.00 0.09 0.00 0.00 57.88 57.75 1n83 h LEU 355 Cb 0.08 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1n83 h LEU 355 CO -0.12 0.95 -0.65 -0.07 0.09 0.00 0.00 178.44 178.64 1n83 h LEU 356 N 1.04 0.93 -0.75 1.67 3.38 -0.90 0.53 115.31 121.21 1n83 h LEU 356 Ca 0.23 -0.55 0.02 0.00 0.09 0.00 0.00 57.88 57.68 1n83 h LEU 356 Cb 0.28 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1n83 h LEU 356 CO -0.01 1.34 0.49 0.11 0.09 0.00 0.00 178.44 180.46 1n83 h LYS 357 N 0.60 0.94 0.22 1.13 1.57 -0.50 -0.95 116.57 119.57 1n83 h LYS 357 Ca -0.01 -0.06 -0.32 0.00 -1.87 0.00 0.00 60.65 58.38 1n83 h LYS 357 Cb 1.26 -0.21 0.03 0.00 0.08 0.00 0.00 32.23 33.39 1n83 h LYS 357 CO 0.14 0.62 -1.42 0.00 -0.57 0.00 0.00 179.45 178.22 1n83 h ALA 358 N 1.30 -0.11 0.00 3.86 0.00 -1.37 -3.41 119.26 119.54 1n83 h ALA 358 Ca 0.29 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1n83 h ALA 358 Cb -0.04 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1n83 h ALA 358 CO -0.09 0.73 -1.29 0.41 0.00 0.00 0.00 179.25 179.01 1n83 n GLY 359 N 1.64 -0.63 0.12 0.00 0.00 0.17 -4.40 105.19 102.09 1n83 n GLY 359 Ca -0.15 -0.42 -0.08 0.00 0.00 0.00 0.00 46.02 45.37 1n83 n GLY 359 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1n83 h SER 360 N 0.00 0.09 0.48 1.61 4.64 -1.32 -1.01 113.55 118.04 1n83 h SER 360 Ca 0.00 0.03 -0.09 0.00 -0.47 0.00 0.00 61.79 61.26 1n83 h SER 360 Cb 0.58 0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1n83 h SER 360 CO 0.00 0.08 -0.42 0.25 -0.87 0.00 0.00 176.83 175.87 1n83 h LEU 361 N 0.19 0.00 -0.54 5.97 5.85 -1.80 -1.71 115.31 123.27 1n83 h LEU 361 Ca 0.11 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1n83 h LEU 361 Cb 0.08 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1n83 h LEU 361 CO -0.11 0.42 0.31 -0.33 -0.34 0.00 0.00 178.44 178.39 1n83 h GLU 362 N 0.00 0.75 -0.32 1.25 5.08 -1.57 -0.79 114.58 118.98 1n83 h GLU 362 Ca -0.00 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.17 1n83 h GLU 362 Cb 0.78 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1n83 h GLU 362 CO 0.05 0.57 -0.25 0.28 -1.00 0.00 0.00 179.01 178.67 1n83 h VAL 363 N 0.73 1.27 -0.52 3.13 2.07 -0.86 -1.41 116.25 120.66 1n83 h VAL 363 Ca 0.19 -1.33 0.03 0.00 0.82 0.00 0.00 66.70 66.42 1n83 h VAL 363 Cb 0.03 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1n83 h VAL 363 CO -0.03 0.43 0.30 0.58 0.02 0.00 0.00 177.57 178.87 1n83 h VAL 364 N 0.56 1.02 0.00 2.57 2.07 -0.79 0.19 116.25 121.87 1n83 h VAL 364 Ca 0.08 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.33 1n83 h VAL 364 Cb 0.72 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1n83 h VAL 364 CO 0.06 0.11 -0.33 -0.26 0.02 0.00 0.00 177.57 177.16 1n83 h PHE 365 N 0.58 0.00 -0.05 1.57 0.04 -0.69 0.41 116.94 118.81 1n83 h PHE 365 Ca 0.22 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.95 1n83 h PHE 365 Cb 0.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.22 1n83 h PHE 365 CO -0.08 0.33 -0.13 0.82 -0.60 0.00 0.00 178.31 178.65 1n83 h ILE 366 N 0.00 1.44 -0.01 -0.55 2.04 -0.65 -3.12 117.51 116.66 1n83 h ILE 366 Ca -0.00 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.35 1n83 h ILE 366 Cb 0.81 2.32 -0.00 0.00 -0.74 0.00 0.00 36.82 39.22 1n83 h ILE 366 CO 0.04 0.42 0.01 0.03 0.00 0.00 0.00 178.15 178.65 1n83 h ARG 367 N -0.36 0.00 -0.77 2.37 3.08 -0.32 -1.94 114.38 116.44 1n83 h ARG 367 Ca -0.00 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.19 1n83 h ARG 367 Cb 0.74 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.74 1n83 h ARG 367 CO 0.03 0.00 0.51 1.98 -1.07 0.00 0.00 179.97 181.42 1n83 h MET 368 N 0.00 0.48 0.00 0.04 4.05 -0.85 -1.36 114.93 117.28 1n83 h MET 368 Ca 0.01 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1n83 h MET 368 Cb 0.03 -0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 30.73 1n83 h MET 368 CO -0.00 0.31 -0.01 0.00 0.23 0.00 0.00 176.91 177.45 1n83 h ARG 370 N 0.00 0.00 -0.27 0.00 3.08 -1.44 -3.23 114.38 112.52 1n83 h ARG 370 Ca -0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 1n83 h ARG 370 Cb 0.08 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 29.98 1n83 h ARG 370 CO 0.00 0.16 -0.58 0.00 -1.07 0.00 0.00 179.97 178.48 1n83 n ALA 371 N -2.15 4.16 -3.40 0.04 0.00 0.55 -4.61 120.51 115.10 1n83 n ALA 371 Ca 0.02 -3.46 -0.24 0.00 0.00 0.00 0.00 53.44 49.75 1n83 n ALA 371 Cb 0.51 -0.37 -0.16 0.00 0.00 0.00 0.00 19.45 19.43 1n83 n ALA 371 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1n83 s PHE 372 N -3.36 1.42 -0.52 0.00 5.36 -0.97 -0.92 117.98 118.99 1n83 s PHE 372 Ca 0.43 -0.50 -0.16 0.00 -0.96 0.00 0.00 56.93 55.73 1n83 s PHE 372 Cb 0.39 -1.04 0.10 0.00 -0.34 0.00 0.00 43.02 42.13 1n83 s PHE 372 CO -0.03 -0.26 0.50 0.34 -1.46 0.00 0.00 175.22 174.32 1n83 s ASP 373 N 0.60 6.18 0.18 6.13 -1.08 0.37 -4.94 116.67 124.11 1n83 s ASP 373 Ca -0.13 -1.53 -0.07 0.00 -0.52 0.00 0.00 52.55 50.30 1n83 s ASP 373 Cb -0.15 -2.22 0.07 0.00 -1.46 0.00 0.00 42.92 39.16 1n83 s ASP 373 CO 0.03 -0.83 1.53 -1.28 0.52 0.00 0.00 175.17 175.14 1n83 h SER 374 N 8.89 0.83 -0.62 -0.34 0.87 -1.93 0.65 113.55 121.91 1n83 h SER 374 Ca -0.29 -0.38 0.05 0.00 -1.23 0.00 0.00 61.79 59.94 1n83 h SER 374 Cb 1.10 -0.23 -0.04 0.00 -0.44 0.00 0.00 62.40 62.79 1n83 h SER 374 CO 0.99 1.12 0.41 1.56 -0.53 0.00 0.00 176.83 180.38 1n83 h GLN 375 N 0.64 0.64 -0.02 2.24 4.20 -1.97 -3.04 115.11 117.79 1n83 h GLN 375 Ca 0.05 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1n83 h GLN 375 Cb 0.95 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.58 1n83 h GLN 375 CO 0.09 0.42 0.00 0.09 -0.67 0.00 0.00 178.83 178.76 1n83 n ASN 376 N -4.47 1.91 -3.39 1.46 3.02 -1.12 -5.01 115.26 107.65 1n83 n ASN 376 Ca 0.08 -1.46 -0.18 0.00 -0.03 0.00 0.00 54.58 52.99 1n83 n ASN 376 Cb 0.19 -0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.43 1n83 n ASN 376 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1n83 n ASN 377 N 0.60 -4.76 -4.15 6.41 5.15 0.18 -4.98 115.26 113.71 1n83 n ASN 377 Ca 0.06 -0.73 -0.12 0.00 -0.60 0.00 0.00 54.58 53.19 1n83 n ASN 377 Cb 0.27 -4.87 -0.10 0.00 -0.53 0.00 0.00 39.78 34.55 1n83 n ASN 377 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1n83 s THR 378 N -3.42 0.72 -0.00 -0.44 -4.23 -0.96 -4.32 115.64 102.99 1n83 s THR 378 Ca 0.30 -1.72 0.03 0.00 -1.18 0.00 0.00 61.69 59.12 1n83 s THR 378 Cb -0.05 -1.42 -0.01 0.00 1.34 0.00 0.00 72.50 72.36 1n83 s THR 378 CO 0.76 -0.72 -0.10 0.54 -0.54 0.00 0.00 174.62 174.56 1n83 s VAL 379 N -2.97 0.77 -0.11 2.29 0.11 0.06 -0.47 120.40 120.07 1n83 s VAL 379 Ca 0.07 -0.48 -0.29 0.00 -2.93 0.00 0.00 61.98 58.35 1n83 s VAL 379 Cb 0.01 -0.66 -0.04 0.00 -1.53 0.00 0.00 36.38 34.16 1n83 s VAL 379 CO -0.03 0.18 1.63 -0.47 -3.33 0.00 0.00 175.10 173.08 1n83 s TYR 380 N -0.31 2.06 -0.20 1.54 5.04 -0.09 -0.12 117.35 125.26 1n83 s TYR 380 Ca 0.03 0.36 -0.09 0.00 -2.44 0.00 0.00 57.07 54.93 1n83 s TYR 380 Cb -0.04 -3.90 0.08 0.00 0.35 0.00 0.00 41.96 38.44 1n83 s TYR 380 CO -0.00 -3.44 0.46 0.12 -1.34 0.00 0.00 175.55 171.34 1n83 s PHE 381 N 4.43 -0.78 -1.45 4.97 5.36 0.47 -4.92 117.98 126.06 1n83 s PHE 381 Ca 0.72 1.54 -0.09 0.00 -0.96 0.00 0.00 56.93 58.14 1n83 s PHE 381 Cb -0.30 0.35 0.05 0.00 -0.34 0.00 0.00 43.02 42.78 1n83 s PHE 381 CO 0.28 -0.44 0.74 -3.47 -1.46 0.00 0.00 175.22 170.87 1n83 n ASP 382 N 4.84 -5.02 0.00 6.13 2.03 -1.26 -2.77 116.55 120.49 1n83 n ASP 382 Ca -0.16 -0.49 0.00 0.00 0.52 0.00 0.00 54.79 54.66 1n83 n ASP 382 Cb 0.53 -4.05 0.00 0.00 -0.72 0.00 0.00 41.12 36.87 1n83 n ASP 382 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1n83 n GLY 383 N -1.51 2.45 3.47 0.27 0.00 -1.26 -5.03 105.19 103.56 1n83 n GLY 383 Ca -0.02 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 1n83 n GLY 383 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n83 s LYS 384 N 0.00 1.79 -0.16 1.61 1.02 -1.12 -5.07 119.74 117.81 1n83 s LYS 384 Ca 0.00 -2.06 -0.25 0.00 0.02 0.00 0.00 55.97 53.68 1n83 s LYS 384 Cb 0.00 -0.61 -0.02 0.00 -0.52 0.00 0.00 37.83 36.69 1n83 s LYS 384 CO 0.00 -0.39 0.82 0.71 -0.92 0.00 0.00 175.35 175.57 1n83 s TYR 385 N -3.31 3.43 -0.16 3.18 1.51 -0.58 -0.39 117.35 121.03 1n83 s TYR 385 Ca 0.29 1.25 -0.05 0.00 -1.01 0.00 0.00 57.07 57.55 1n83 s TYR 385 Cb 0.05 -3.00 -0.03 0.00 -0.11 0.00 0.00 41.96 38.87 1n83 s TYR 385 CO 0.15 -0.22 0.01 0.00 -1.11 0.00 0.00 175.55 174.37 1n83 s ALA 386 N 2.08 3.19 0.81 3.71 0.00 0.83 -2.21 121.76 130.17 1n83 s ALA 386 Ca 0.38 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.43 1n83 s ALA 386 Cb -0.17 -1.69 0.08 0.00 0.00 0.00 0.00 23.12 21.34 1n83 s ALA 386 CO 0.13 0.24 1.15 -1.54 0.00 0.00 0.00 175.76 175.74 1n83 s SER 387 N 0.23 4.49 0.55 0.00 1.04 -1.26 -0.76 113.70 117.98 1n83 s SER 387 Ca 0.00 0.93 0.27 0.00 0.48 0.00 0.00 55.95 57.62 1n83 s SER 387 Cb -0.13 -1.51 1.44 0.00 0.10 0.00 0.00 66.02 65.92 1n83 s SER 387 CO 0.02 -1.93 1.99 -0.65 0.98 0.00 0.00 173.24 173.64 1n83 h PRO 388 N -1.07 0.00 -0.04 4.02 0.11 -1.97 -2.06 132.00 131.00 1n83 h PRO 388 Ca -0.47 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.65 1n83 h PRO 388 Cb 1.31 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 1n83 h PRO 388 CO 0.64 0.00 0.03 -0.44 -0.21 0.00 0.00 178.00 178.02 1n83 h ASP 389 N 0.00 0.00 0.11 -2.05 3.32 -1.96 -1.63 116.42 114.21 1n83 h ASP 389 Ca 0.24 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 1n83 h ASP 389 Cb 1.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.57 1n83 h ASP 389 CO -0.00 0.00 -0.06 0.58 -1.72 0.00 0.00 179.24 178.04 1n83 h VAL 390 N 0.00 0.71 -0.47 -1.35 2.07 -1.69 -2.62 116.25 112.90 1n83 h VAL 390 Ca 0.02 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1n83 h VAL 390 Cb 0.08 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1n83 h VAL 390 CO -0.00 0.05 0.00 0.49 0.02 0.00 0.00 177.57 178.13 1n83 n PHE 391 N -3.99 0.61 -0.29 1.57 3.01 -0.61 -4.48 117.46 113.27 1n83 n PHE 391 Ca -0.03 -0.30 0.12 0.00 1.01 0.00 0.00 57.45 58.25 1n83 n PHE 391 Cb 0.14 0.00 0.28 0.00 -0.01 0.00 0.00 39.48 39.89 1n83 n PHE 391 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1n83 h LYS 392 N 4.43 0.23 0.00 -1.08 3.64 -1.54 -1.81 116.57 120.45 1n83 h LYS 392 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1n83 h LYS 392 Cb 0.98 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1n83 h LYS 392 CO 0.00 0.16 0.00 0.77 -2.27 0.00 0.00 179.45 178.11 1n83 h SER 393 N 0.24 0.00 0.18 4.20 0.02 -1.82 -1.91 113.55 114.47 1n83 h SER 393 Ca 0.54 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.46 1n83 h SER 393 Cb 1.05 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.59 1n83 h SER 393 CO -0.62 0.00 -0.12 -0.07 -1.14 0.00 0.00 176.83 174.88 1n83 h LEU 394 N 0.00 0.00 -0.19 5.07 3.38 -1.60 -3.33 115.31 118.64 1n83 h LEU 394 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1n83 h LEU 394 Cb 0.05 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.83 1n83 h LEU 394 CO 0.00 0.12 -0.25 0.61 0.09 0.00 0.00 178.44 179.01 1n83 n GLY 395 N -1.03 0.25 2.61 0.83 0.00 -0.72 -4.97 105.19 102.16 1n83 n GLY 395 Ca -0.02 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 1n83 n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n83 h GLU 397 N 2.84 0.51 -0.64 0.00 4.39 -1.92 -0.35 114.58 119.42 1n83 h GLU 397 Ca 0.01 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 1n83 h GLU 397 Cb 1.13 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.64 1n83 h GLU 397 CO 0.57 0.34 0.29 -0.44 -1.16 0.00 0.00 179.01 178.60 1n83 h ASP 398 N 0.53 0.86 -0.31 1.42 3.32 -1.99 0.52 116.42 120.77 1n83 h ASP 398 Ca 0.32 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.17 1n83 h ASP 398 Cb 0.34 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1n83 h ASP 398 CO -0.26 0.77 0.01 0.15 -1.72 0.00 0.00 179.24 178.19 1n83 h PHE 399 N 0.89 0.59 -0.67 4.55 3.57 -1.76 -0.95 116.94 123.16 1n83 h PHE 399 Ca 0.22 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1n83 h PHE 399 Cb 0.16 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1n83 h PHE 399 CO 0.01 0.66 0.42 0.82 -2.23 0.00 0.00 178.31 177.99 1n83 h ILE 400 N 0.35 1.19 -0.86 1.41 1.08 -0.93 0.84 117.51 120.59 1n83 h ILE 400 Ca 0.09 -0.38 0.05 0.00 -0.39 0.00 0.00 64.86 64.23 1n83 h ILE 400 Cb 0.42 0.23 -0.06 0.00 -3.07 0.00 0.00 36.82 34.35 1n83 h ILE 400 CO 0.01 0.19 0.54 0.77 -0.69 0.00 0.00 178.15 178.97 1n83 h SER 401 N 0.91 0.86 -0.23 1.72 4.64 -0.63 -1.28 113.55 119.53 1n83 h SER 401 Ca 0.24 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.57 1n83 h SER 401 Cb -0.06 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 1n83 h SER 401 CO -0.05 0.56 0.12 0.15 -0.87 0.00 0.00 176.83 176.74 1n83 h PHE 402 N 1.00 0.34 -0.27 4.77 3.57 -0.32 0.17 116.94 126.20 1n83 h PHE 402 Ca 0.37 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.89 1n83 h PHE 402 Cb 0.13 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1n83 h PHE 402 CO -0.03 0.32 0.06 0.28 -2.23 0.00 0.00 178.31 176.71 1n83 h VAL 403 N 0.25 0.88 -0.21 1.41 2.07 -0.23 0.25 116.25 120.67 1n83 h VAL 403 Ca 0.08 -0.06 -0.13 0.00 0.82 0.00 0.00 66.70 67.41 1n83 h VAL 403 Cb 0.11 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1n83 h VAL 403 CO -0.01 0.03 -0.43 -0.26 0.02 0.00 0.00 177.57 176.92 1n83 h PHE 404 N 0.16 0.61 -0.65 1.57 -1.00 -1.09 0.01 116.94 116.55 1n83 h PHE 404 Ca 0.12 -0.18 -0.03 0.00 2.81 0.00 0.00 57.97 60.69 1n83 h PHE 404 Cb 0.12 -0.13 -0.03 0.00 3.61 0.00 0.00 35.95 39.52 1n83 h PHE 404 CO -0.16 0.85 0.29 1.49 -1.61 0.00 0.00 178.31 179.18 1n83 h GLU 405 N 0.42 0.95 -0.50 1.51 4.81 -0.61 0.12 114.58 121.27 1n83 h GLU 405 Ca 0.03 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1n83 h GLU 405 Cb 0.92 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 1n83 h GLU 405 CO 0.08 0.78 0.27 0.35 -0.73 0.00 0.00 179.01 179.76 1n83 h PHE 406 N 0.91 0.69 -0.25 0.92 3.57 -0.48 0.58 116.94 122.89 1n83 h PHE 406 Ca 0.22 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.76 1n83 h PHE 406 Cb 0.16 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.61 1n83 h PHE 406 CO 0.01 0.52 -0.15 0.78 -2.23 0.00 0.00 178.31 177.24 1n83 h GLY 407 N 0.67 0.04 1.00 2.40 0.00 -0.46 0.19 103.07 106.92 1n83 h GLY 407 Ca 0.18 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.69 1n83 h GLY 407 CO -0.03 -0.16 0.41 1.70 0.00 0.00 0.00 176.54 178.46 1n83 h LYS 408 N -0.12 0.87 -0.05 4.80 3.64 -0.69 0.41 116.57 125.42 1n83 h LYS 408 Ca 0.14 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1n83 h LYS 408 Cb 0.33 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1n83 h LYS 408 CO -0.33 0.60 0.03 1.03 -2.27 0.00 0.00 179.45 178.51 1n83 h SER 409 N 0.88 0.07 -0.59 4.20 0.87 -0.37 0.24 113.55 118.84 1n83 h SER 409 Ca 0.23 -0.08 -0.10 0.00 -1.23 0.00 0.00 61.79 60.61 1n83 h SER 409 Cb -0.06 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 61.86 1n83 h SER 409 CO -0.05 0.13 -0.04 0.25 -0.53 0.00 0.00 176.83 176.59 1n83 h LEU 410 N 0.00 1.06 -1.62 2.23 5.85 -0.84 -2.76 115.31 119.24 1n83 h LEU 410 Ca 0.02 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.44 1n83 h LEU 410 Cb 0.07 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 1n83 h LEU 410 CO -0.00 1.13 0.30 0.00 -0.34 0.00 0.00 178.44 179.52 1n83 h SER 412 N 0.51 0.00 0.65 0.00 4.64 -0.64 -1.41 113.55 117.31 1n83 h SER 412 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1n83 h SER 412 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1n83 h SER 412 CO -0.04 0.00 -0.70 0.23 -0.87 0.00 0.00 176.83 175.44 1n83 n MET 413 N -2.65 0.22 -3.70 4.77 2.00 -0.89 -4.99 117.12 111.87 1n83 n MET 413 Ca -0.02 0.04 -0.30 0.00 0.00 0.00 0.00 57.70 57.42 1n83 n MET 413 Cb 0.08 -1.61 0.04 0.00 0.00 0.00 0.00 33.22 31.72 1n83 n MET 413 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 1n83 n HIS 414 N -1.92 -1.89 -2.32 2.03 8.25 -0.53 -4.91 115.22 113.92 1n83 n HIS 414 Ca 0.03 0.53 -0.41 0.00 -0.26 0.00 0.00 57.72 57.61 1n83 n HIS 414 Cb 0.41 -3.57 -0.03 0.00 1.12 0.00 0.00 29.99 27.92 1n83 n HIS 414 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1n83 s LEU 415 N -6.51 4.46 0.76 2.41 1.43 -1.26 -5.04 118.68 114.93 1n83 s LEU 415 Ca 0.38 2.35 -0.12 0.00 -1.03 0.00 0.00 54.13 55.71 1n83 s LEU 415 Cb -0.13 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.52 1n83 s LEU 415 CO 0.86 -0.38 1.12 0.42 0.23 0.00 0.00 176.35 178.60 1n83 s THR 416 N -0.44 2.89 0.21 5.49 -4.23 -1.26 -4.85 115.64 113.45 1n83 s THR 416 Ca 0.51 0.29 -0.09 0.00 -1.18 0.00 0.00 61.69 61.22 1n83 s THR 416 Cb -0.34 -3.23 0.15 0.00 1.34 0.00 0.00 72.50 70.42 1n83 s THR 416 CO 0.41 -0.38 1.80 -0.33 -0.54 0.00 0.00 174.62 175.58 1n83 h GLU 417 N -0.90 0.66 -0.49 3.99 4.39 -1.99 0.41 114.58 120.65 1n83 h GLU 417 Ca -0.46 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.13 1n83 h GLU 417 Cb 1.28 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.76 1n83 h GLU 417 CO 0.64 0.44 0.01 -0.44 -1.16 0.00 0.00 179.01 178.50 1n83 h ASP 418 N 0.68 0.78 -0.57 1.42 3.32 -1.93 0.31 116.42 120.44 1n83 h ASP 418 Ca 0.31 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 57.10 1n83 h ASP 418 Cb 0.22 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1n83 h ASP 418 CO -0.20 0.84 0.08 -0.33 -1.72 0.00 0.00 179.24 177.91 1n83 h GLU 419 N 0.76 0.95 -0.60 3.56 5.08 -1.68 -0.98 114.58 121.66 1n83 h GLU 419 Ca 0.15 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1n83 h GLU 419 Cb 0.45 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1n83 h GLU 419 CO 0.02 0.92 0.14 0.82 -1.00 0.00 0.00 179.01 179.91 1n83 h ILE 420 N 0.84 1.25 0.04 3.13 2.04 -0.59 -0.62 117.51 123.60 1n83 h ILE 420 Ca 0.17 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 65.13 1n83 h ILE 420 Cb 0.44 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1n83 h ILE 420 CO 0.01 0.34 -0.13 0.00 0.00 0.00 0.00 178.15 178.38 1n83 h ALA 421 N 1.04 -0.18 -0.22 1.87 0.00 -0.58 0.67 119.26 121.85 1n83 h ALA 421 Ca 0.19 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 1n83 h ALA 421 Cb 0.36 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1n83 h ALA 421 CO 0.00 -0.63 -0.34 -0.07 0.00 0.00 0.00 179.25 178.20 1n83 h LEU 422 N -0.24 0.49 -0.34 0.00 3.38 -1.08 -1.32 115.31 116.20 1n83 h LEU 422 Ca 0.03 -0.20 -0.18 0.00 0.09 0.00 0.00 57.88 57.62 1n83 h LEU 422 Cb 0.28 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1n83 h LEU 422 CO -0.10 0.81 -0.57 0.15 0.09 0.00 0.00 178.44 178.82 1n83 h PHE 423 N 0.41 1.01 -0.46 1.13 3.57 -0.92 -0.74 116.94 120.94 1n83 h PHE 423 Ca 0.05 -0.36 0.01 0.00 3.53 0.00 0.00 57.97 61.19 1n83 h PHE 423 Cb 0.80 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 1n83 h PHE 423 CO 0.03 1.17 0.30 0.77 -2.23 0.00 0.00 178.31 178.35 1n83 h SER 424 N 0.61 0.52 0.25 0.41 0.02 -0.72 -1.18 113.55 113.45 1n83 h SER 424 Ca 0.01 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1n83 h SER 424 Cb 1.16 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 1n83 h SER 424 CO 0.12 0.38 -0.33 0.00 -1.14 0.00 0.00 176.83 175.86 1n83 h ALA 425 N 1.17 1.33 -0.02 3.77 0.00 -1.09 -2.23 119.26 122.19 1n83 h ALA 425 Ca 0.17 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1n83 h ALA 425 Cb -0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1n83 h ALA 425 CO -0.04 0.47 0.00 0.35 0.00 0.00 0.00 179.25 180.04 1n83 h PHE 426 N 0.11 0.04 0.00 0.00 3.57 -0.50 -2.21 116.94 117.96 1n83 h PHE 426 Ca 0.01 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1n83 h PHE 426 Cb 0.64 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 1n83 h PHE 426 CO 0.01 0.30 -0.07 -0.39 -2.23 0.00 0.00 178.31 175.93 1n83 h VAL 427 N -0.23 0.14 -0.02 1.41 -1.51 -1.14 -3.06 116.25 111.84 1n83 h VAL 427 Ca 0.01 -0.87 -0.08 0.00 -1.23 0.00 0.00 66.70 64.52 1n83 h VAL 427 Cb 0.28 1.77 0.01 0.00 -2.13 0.00 0.00 31.29 31.22 1n83 h VAL 427 CO 0.00 0.06 -0.30 0.25 -1.23 0.00 0.00 177.57 176.36 1n83 h LEU 428 N 0.00 0.30 -5.33 4.19 5.85 -1.36 -3.33 115.31 115.63 1n83 h LEU 428 Ca -0.00 -0.72 -0.68 0.00 0.84 0.00 0.00 57.88 57.31 1n83 h LEU 428 Cb 0.77 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.62 1n83 h LEU 428 CO 0.01 0.98 2.49 0.23 -0.34 0.00 0.00 178.44 181.80 1n83 n MET 429 N -4.46 4.10 -3.26 1.25 2.81 -0.83 -4.88 117.12 111.84 1n83 n MET 429 Ca -0.09 -2.97 -0.40 0.00 -1.81 0.00 0.00 57.70 52.43 1n83 n MET 429 Cb 0.51 -2.61 -0.08 0.00 -0.71 0.00 0.00 33.22 30.34 1n83 n MET 429 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1n83 s SER 430 N 0.87 6.41 0.00 7.83 0.01 -1.25 -4.35 113.70 123.22 1n83 s SER 430 Ca 0.59 0.49 0.28 0.00 1.31 0.00 0.00 55.95 58.62 1n83 s SER 430 Cb 0.21 -2.27 1.33 0.00 0.21 0.00 0.00 66.02 65.50 1n83 s SER 430 CO -0.09 -0.27 1.94 0.00 0.41 0.00 0.00 173.24 175.22 1n83 n ALA 431 N 5.50 2.34 0.18 1.44 0.00 -1.26 -3.57 120.51 125.14 1n83 n ALA 431 Ca -0.05 -0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.39 1n83 n ALA 431 Cb 0.50 -1.45 0.27 0.00 0.00 0.00 0.00 19.45 18.76 1n83 n ALA 431 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1n83 n ASP 432 N -1.36 3.37 -4.78 0.00 3.85 -1.26 -4.86 116.55 111.51 1n83 n ASP 432 Ca 0.11 -1.97 -0.41 0.00 -0.71 0.00 0.00 54.79 51.81 1n83 n ASP 432 Cb 0.26 -0.33 -0.00 0.00 -1.35 0.00 0.00 41.12 39.69 1n83 n ASP 432 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 1n83 s ARG 433 N -1.33 4.11 0.47 0.11 1.81 -1.23 -4.93 118.95 117.95 1n83 s ARG 433 Ca 0.41 2.55 -0.24 0.00 -1.72 0.00 0.00 55.73 56.73 1n83 s ARG 433 Cb 0.23 -2.96 -0.07 0.00 -0.45 0.00 0.00 34.95 31.69 1n83 s ARG 433 CO 0.31 -0.53 1.42 -1.12 -0.68 0.00 0.00 175.30 174.70 1n83 s SER 434 N -0.17 5.72 0.00 0.23 0.01 -1.26 -3.42 113.70 114.81 1n83 s SER 434 Ca 0.53 2.91 0.00 0.00 1.31 0.00 0.00 55.95 60.70 1n83 s SER 434 Cb -0.46 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.12 1n83 s SER 434 CO 0.63 -1.28 0.00 0.79 0.41 0.00 0.00 173.24 173.78 1n83 n TRP 435 N -0.39 0.00 -2.29 2.43 5.03 -1.26 -5.00 117.44 115.96 1n83 n TRP 435 Ca 0.06 0.00 -0.39 0.00 3.03 0.00 0.00 57.50 60.20 1n83 n TRP 435 Cb 0.42 -0.24 -0.02 0.00 -1.03 0.00 0.00 31.31 30.44 1n83 n TRP 435 CO 0.00 0.00 0.00 -0.51 -0.03 0.00 0.00 177.69 177.15 1n83 s LEU 436 N 0.00 4.27 -0.21 -0.99 1.43 -1.22 -4.92 118.68 117.05 1n83 s LEU 436 Ca 0.00 2.38 -0.18 0.00 -1.03 0.00 0.00 54.13 55.30 1n83 s LEU 436 Cb 0.00 -3.92 -0.15 0.00 0.03 0.00 0.00 46.19 42.15 1n83 s LEU 436 CO 0.00 -0.59 0.06 0.00 0.23 0.00 0.00 176.35 176.05 1n83 n GLN 437 N 0.32 0.55 -1.91 1.70 6.02 -1.26 -4.58 117.38 118.21 1n83 n GLN 437 Ca 0.03 0.52 -0.36 0.00 -0.01 0.00 0.00 57.00 57.18 1n83 n GLN 437 Cb 0.46 -1.70 -0.01 0.00 1.02 0.00 0.00 30.24 30.01 1n83 n GLN 437 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1n83 n GLU 438 N -4.44 3.69 -0.23 -1.09 1.02 -1.26 -4.76 120.64 113.56 1n83 n GLU 438 Ca -0.30 -3.28 -0.01 0.00 -0.02 0.00 0.00 57.16 53.55 1n83 n GLU 438 Cb 0.63 -2.38 0.10 0.00 -0.02 0.00 0.00 31.44 29.78 1n83 n GLU 438 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1n83 h LYS 439 N 3.73 0.67 -0.48 3.49 1.57 -1.89 -2.06 116.57 121.60 1n83 h LYS 439 Ca 0.55 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 59.25 1n83 h LYS 439 Cb 0.41 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1n83 h LYS 439 CO 1.21 0.44 0.14 0.28 -0.57 0.00 0.00 179.45 180.95 1n83 h VAL 440 N 0.69 1.23 -0.39 0.50 2.07 -1.94 0.13 116.25 118.54 1n83 h VAL 440 Ca 0.31 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1n83 h VAL 440 Cb 0.20 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1n83 h VAL 440 CO -0.19 0.28 0.17 0.50 0.02 0.00 0.00 177.57 178.35 1n83 h LYS 441 N 0.64 0.57 -0.52 1.57 3.64 -1.90 -2.08 116.57 118.50 1n83 h LYS 441 Ca 0.15 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1n83 h LYS 441 Cb 0.29 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1n83 h LYS 441 CO -0.00 0.53 0.21 0.82 -2.27 0.00 0.00 179.45 178.74 1n83 h ILE 442 N 0.49 1.21 -0.68 2.00 2.04 -1.19 -2.03 117.51 119.35 1n83 h ILE 442 Ca 0.13 -0.66 0.07 0.00 1.00 0.00 0.00 64.86 65.40 1n83 h ILE 442 Cb 0.16 0.67 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 1n83 h ILE 442 CO -0.01 0.25 0.37 -0.08 0.00 0.00 0.00 178.15 178.68 1n83 h GLU 443 N 0.70 0.65 -0.74 2.37 4.57 -0.80 0.64 114.58 121.97 1n83 h GLU 443 Ca 0.17 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.26 1n83 h GLU 443 Cb 0.19 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.60 1n83 h GLU 443 CO -0.02 0.43 0.25 0.87 -1.18 0.00 0.00 179.01 179.37 1n83 h LYS 444 N 0.67 1.14 -0.57 1.92 1.79 -1.00 -0.61 116.57 119.91 1n83 h LYS 444 Ca 0.31 -0.23 -0.07 0.00 -2.18 0.00 0.00 60.65 58.48 1n83 h LYS 444 Cb 0.22 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 1n83 h LYS 444 CO -0.20 0.96 0.09 -0.07 -1.08 0.00 0.00 179.45 179.15 1n83 h LEU 445 N 1.09 0.91 -0.80 2.94 3.38 -0.65 -2.49 115.31 119.70 1n83 h LEU 445 Ca 0.24 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1n83 h LEU 445 Cb 0.28 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1n83 h LEU 445 CO -0.01 0.94 0.14 -0.61 0.09 0.00 0.00 178.44 178.98 1n83 h GLN 446 N 0.85 1.04 -0.44 1.13 4.15 -0.47 -1.77 115.11 119.60 1n83 h GLN 446 Ca 0.17 -0.25 0.03 0.00 0.77 0.00 0.00 58.65 59.37 1n83 h GLN 446 Cb 0.41 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 1n83 h GLN 446 CO 0.01 0.93 0.24 1.96 -1.93 0.00 0.00 178.83 180.05 1n83 h GLN 447 N 0.98 0.48 -0.76 1.69 4.20 -0.95 0.24 115.11 121.00 1n83 h GLN 447 Ca 0.20 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 1n83 h GLN 447 Cb 0.38 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.02 1n83 h GLN 447 CO 0.01 0.32 0.41 0.87 -0.67 0.00 0.00 178.83 179.76 1n83 h LYS 448 N 0.49 1.06 -0.64 1.46 1.57 -1.15 -1.63 116.57 117.72 1n83 h LYS 448 Ca 0.18 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1n83 h LYS 448 Cb 0.04 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 1n83 h LYS 448 CO -0.10 0.79 0.19 0.82 -0.57 0.00 0.00 179.45 180.57 1n83 h ILE 449 N 1.05 1.25 -0.88 1.86 2.04 -0.65 -2.22 117.51 119.95 1n83 h ILE 449 Ca 0.27 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 1n83 h ILE 449 Cb 0.04 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 1n83 h ILE 449 CO -0.04 0.33 0.51 -0.61 0.00 0.00 0.00 178.15 178.35 1n83 h GLN 450 N 0.93 1.21 -0.61 2.37 4.15 -0.13 0.21 115.11 123.24 1n83 h GLN 450 Ca 0.21 -0.12 -0.06 0.00 0.77 0.00 0.00 58.65 59.45 1n83 h GLN 450 Cb 0.31 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 1n83 h GLN 450 CO -0.00 0.86 0.14 -0.07 -1.93 0.00 0.00 178.83 177.83 1n83 h LEU 451 N 1.22 0.93 -0.68 -2.39 3.38 -1.06 0.59 115.31 117.31 1n83 h LEU 451 Ca 0.31 -0.24 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 1n83 h LEU 451 Cb -0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1n83 h LEU 451 CO -0.06 0.93 -0.36 0.00 0.09 0.00 0.00 178.44 179.05 1n83 h ALA 452 N 1.04 0.85 -0.31 1.53 0.00 -0.85 0.15 119.26 121.67 1n83 h ALA 452 Ca 0.19 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1n83 h ALA 452 Cb 0.36 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1n83 h ALA 452 CO 0.00 0.64 0.09 1.25 0.00 0.00 0.00 179.25 181.23 1n83 h LEU 453 N 0.53 0.47 -0.73 0.00 5.85 -0.26 0.37 115.31 121.54 1n83 h LEU 453 Ca 0.05 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 1n83 h LEU 453 Cb 0.86 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 1n83 h LEU 453 CO 0.07 0.56 0.39 -0.61 -0.34 0.00 0.00 178.44 178.51 1n83 h GLN 454 N 0.35 1.02 -0.43 1.25 4.15 -0.63 -0.15 115.11 120.66 1n83 h GLN 454 Ca 0.10 -0.13 0.06 0.00 0.77 0.00 0.00 58.65 59.45 1n83 h GLN 454 Cb 0.27 -0.20 -0.05 0.00 0.21 0.00 0.00 27.48 27.72 1n83 h GLN 454 CO -0.00 0.77 0.15 1.25 -1.93 0.00 0.00 178.83 179.06 1n83 h HIS 455 N 1.00 0.26 -0.14 3.99 2.76 -0.39 -2.25 115.15 120.38 1n83 h HIS 455 Ca 0.25 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.31 1n83 h HIS 455 Cb 0.05 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1n83 h HIS 455 CO -0.00 0.09 -0.50 0.28 -1.30 0.00 0.00 177.93 176.51 1n83 h VAL 456 N 0.31 1.33 -0.07 5.26 2.07 -0.46 -3.20 116.25 121.49 1n83 h VAL 456 Ca 0.20 -1.73 -0.03 0.00 0.82 0.00 0.00 66.70 65.96 1n83 h VAL 456 Cb 0.20 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1n83 h VAL 456 CO -0.21 0.52 -0.09 -0.07 0.02 0.00 0.00 177.57 177.74 1n83 h LEU 457 N 0.30 0.20 0.00 2.57 3.38 -0.73 -3.15 115.31 117.88 1n83 h LEU 457 Ca 0.01 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1n83 h LEU 457 Cb 0.98 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1n83 h LEU 457 CO 0.08 0.68 0.00 0.00 0.09 0.00 0.00 178.44 179.29 1n83 n GLN 458 N -4.68 0.96 0.02 1.13 10.64 -0.88 -1.98 117.38 122.60 1n83 n GLN 458 Ca -0.07 0.00 -0.03 0.00 -1.83 0.00 0.00 57.00 55.06 1n83 n GLN 458 Cb 0.33 -1.10 -0.10 0.00 -0.86 0.00 0.00 30.24 28.51 1n83 n GLN 458 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.06 175.01 1n83 h LYS 459 N 0.00 0.00 0.00 2.61 3.64 -1.54 -3.37 116.57 117.92 1n83 h LYS 459 Ca 0.00 0.00 -0.40 0.00 -1.27 0.00 0.00 60.65 58.98 1n83 h LYS 459 Cb 0.00 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.76 1n83 h LYS 459 CO 0.00 0.42 -2.39 0.09 -2.27 0.00 0.00 179.45 175.30 1n83 n ASN 460 N -3.00 1.91 -3.34 4.20 3.02 -1.05 -4.88 115.26 112.13 1n83 n ASN 460 Ca -0.11 0.16 -0.26 0.00 -0.03 0.00 0.00 54.58 54.35 1n83 n ASN 460 Cb 0.91 -0.62 -0.08 0.00 -0.61 0.00 0.00 39.78 39.38 1n83 n ASN 460 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1n83 n HIS 461 N -3.81 0.54 1.09 3.10 8.25 -0.84 -4.86 115.22 118.69 1n83 n HIS 461 Ca -0.47 -3.67 0.00 0.00 -0.26 0.00 0.00 57.72 53.32 1n83 n HIS 461 Cb 0.89 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.73 1n83 n HIS 461 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1n83 n ARG 462 N 1.70 0.65 0.19 -0.41 1.74 -1.26 -3.23 116.66 116.04 1n83 n ARG 462 Ca 0.25 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.38 1n83 n ARG 462 Cb 0.48 -1.11 0.37 0.00 -1.02 0.00 0.00 32.46 31.19 1n83 n ARG 462 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 1n83 h GLU 463 N 0.11 0.00 0.00 5.56 4.11 -1.94 -3.46 114.58 118.96 1n83 h GLU 463 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1n83 h GLU 463 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1n83 h GLU 463 CO 0.00 0.37 0.00 -0.25 0.07 0.00 0.00 179.01 179.20 1n83 n ASP 464 N -3.73 0.19 -3.03 3.06 8.00 -1.20 -5.08 116.55 114.76 1n83 n ASP 464 Ca -0.01 -0.10 -0.20 0.00 0.71 0.00 0.00 54.79 55.18 1n83 n ASP 464 Cb 0.46 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 1n83 n ASP 464 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n83 n GLY 465 N 0.47 4.13 0.00 0.44 0.00 -1.26 -4.95 105.19 104.01 1n83 n GLY 465 Ca 0.00 -2.03 0.06 0.00 0.00 0.00 0.00 46.02 44.05 1n83 n GLY 465 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1n83 n ILE 466 N 0.06 0.92 -0.23 -0.61 5.41 -1.26 -3.17 119.36 120.47 1n83 n ILE 466 Ca 0.26 0.23 -0.01 0.00 1.00 0.00 0.00 62.75 64.23 1n83 n ILE 466 Cb 0.59 -1.02 0.11 0.00 -0.71 0.00 0.00 39.64 38.61 1n83 n ILE 466 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1n83 h LEU 467 N 0.00 0.53 -0.59 1.39 5.85 -1.98 0.28 115.31 120.79 1n83 h LEU 467 Ca 0.00 0.04 -0.14 0.00 0.84 0.00 0.00 57.88 58.61 1n83 h LEU 467 Cb 0.17 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1n83 h LEU 467 CO 0.00 0.34 -0.42 0.71 -0.34 0.00 0.00 178.44 178.73 1n83 h THR 468 N 0.67 1.30 -0.69 1.05 1.35 -1.97 -0.10 112.91 114.51 1n83 h THR 468 Ca 0.31 -1.59 -0.04 0.00 -0.55 0.00 0.00 66.41 64.54 1n83 h THR 468 Cb 0.22 1.54 -0.03 0.00 -1.73 0.00 0.00 68.15 68.15 1n83 h THR 468 CO -0.20 0.51 0.28 0.50 -0.25 0.00 0.00 175.52 176.36 1n83 h LYS 469 N 0.53 1.01 0.30 4.72 3.64 -1.52 0.31 116.57 125.57 1n83 h LYS 469 Ca 0.04 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 1n83 h LYS 469 Cb 0.95 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1n83 h LYS 469 CO 0.09 0.82 -0.15 1.25 -2.27 0.00 0.00 179.45 179.19 1n83 h LEU 470 N 0.99 -0.35 -2.20 5.20 5.85 -0.11 -2.96 115.31 121.74 1n83 h LEU 470 Ca 0.23 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1n83 h LEU 470 Cb 0.18 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 1n83 h LEU 470 CO -0.02 -0.01 -0.01 0.40 -0.34 0.00 0.00 178.44 178.45 1n83 h ILE 471 N -0.71 0.77 -0.94 4.05 2.04 -0.78 0.17 117.51 122.11 1n83 h ILE 471 Ca -0.04 -0.05 0.08 0.00 1.00 0.00 0.00 64.86 65.84 1n83 h ILE 471 Cb 0.48 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 37.53 1n83 h ILE 471 CO 0.07 0.01 0.61 0.00 0.00 0.00 0.00 178.15 178.84 1n83 h LYS 473 N 1.04 0.00 -0.78 0.00 1.79 -0.54 -2.88 116.57 115.20 1n83 h LYS 473 Ca 0.42 0.00 0.16 0.00 -2.18 0.00 0.00 60.65 59.05 1n83 h LYS 473 Cb 0.26 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 30.81 1n83 h LYS 473 CO -0.17 0.12 0.29 0.28 -1.08 0.00 0.00 179.45 178.89 1n83 h VAL 474 N 0.00 0.58 -0.58 0.50 2.07 -1.22 0.11 116.25 117.72 1n83 h VAL 474 Ca -0.00 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 1n83 h VAL 474 Cb 0.35 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1n83 h VAL 474 CO 0.02 0.07 0.07 -1.28 0.02 0.00 0.00 177.57 176.47 1n83 h SER 475 N 0.40 0.90 -0.63 0.57 0.87 -1.65 -2.74 113.55 111.27 1n83 h SER 475 Ca 0.45 -0.21 -0.09 0.00 -1.23 0.00 0.00 61.79 60.71 1n83 h SER 475 Cb 0.74 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.44 1n83 h SER 475 CO -0.46 0.92 0.03 0.74 -0.53 0.00 0.00 176.83 177.53 1n83 h THR 476 N 0.89 1.27 -0.69 2.23 2.02 -0.98 -2.23 112.91 115.42 1n83 h THR 476 Ca 0.18 -1.13 0.02 0.00 0.77 0.00 0.00 66.41 66.24 1n83 h THR 476 Cb 0.42 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 1n83 h THR 476 CO 0.01 0.41 0.45 -0.07 0.37 0.00 0.00 175.52 176.69 1n83 h LEU 477 N 1.00 0.76 -0.91 2.58 3.38 -0.93 0.15 115.31 121.34 1n83 h LEU 477 Ca 0.18 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1n83 h LEU 477 Cb 0.53 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1n83 h LEU 477 CO 0.03 0.54 0.21 0.03 0.09 0.00 0.00 178.44 179.34 1n83 h ARG 478 N 0.90 1.01 -0.34 1.13 3.08 -1.19 0.14 114.38 119.11 1n83 h ARG 478 Ca 0.26 -0.20 -0.12 0.00 0.07 0.00 0.00 59.98 60.00 1n83 h ARG 478 Cb -0.06 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 1n83 h ARG 478 CO -0.07 0.86 -0.24 0.00 -1.07 0.00 0.00 179.97 179.45 1n83 h ALA 479 N 1.25 0.49 -0.12 0.04 0.00 -0.76 0.81 119.26 120.97 1n83 h ALA 479 Ca 0.22 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1n83 h ALA 479 Cb 0.27 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1n83 h ALA 479 CO -0.01 0.47 0.05 1.25 0.00 0.00 0.00 179.25 181.02 1n83 h LEU 480 N 0.54 0.15 -0.93 0.00 5.85 -0.42 -1.17 115.31 119.33 1n83 h LEU 480 Ca 0.07 -0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.55 1n83 h LEU 480 Cb 0.80 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1n83 h LEU 480 CO 0.06 0.24 -0.35 0.00 -0.34 0.00 0.00 178.44 178.06 1n83 h GLY 482 N 1.11 1.30 1.11 0.00 0.00 -0.58 -2.27 103.07 103.73 1n83 h GLY 482 Ca 0.04 -0.57 -0.14 0.00 0.00 0.00 0.00 47.33 46.66 1n83 h GLY 482 CO 0.06 0.55 -0.24 3.21 0.00 0.00 0.00 176.54 180.12 1n83 h ARG 483 N 1.22 0.99 -0.48 4.80 3.08 -0.81 -1.73 114.38 121.45 1n83 h ARG 483 Ca 0.31 -0.44 0.06 0.00 0.07 0.00 0.00 59.98 59.98 1n83 h ARG 483 Cb 0.01 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 29.98 1n83 h ARG 483 CO -0.05 1.11 0.19 1.25 -1.07 0.00 0.00 179.97 181.40 1n83 h HIS 484 N 0.84 0.34 -0.17 3.04 2.76 -1.06 -0.55 115.15 120.35 1n83 h HIS 484 Ca 0.10 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.29 1n83 h HIS 484 Cb 0.82 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.70 1n83 h HIS 484 CO 0.06 0.13 0.09 1.15 -1.30 0.00 0.00 177.93 178.06 1n83 h THR 485 N 0.38 1.10 -0.35 6.26 2.02 -1.13 -0.41 112.91 120.78 1n83 h THR 485 Ca 0.22 -0.28 0.05 0.00 0.77 0.00 0.00 66.41 67.17 1n83 h THR 485 Cb 0.20 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.55 1n83 h THR 485 CO -0.21 0.10 0.08 -0.33 0.37 0.00 0.00 175.52 175.53 1n83 h GLU 486 N 0.17 0.21 -0.51 6.66 5.08 -0.90 -0.61 114.58 124.68 1n83 h GLU 486 Ca 0.06 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1n83 h GLU 486 Cb 0.07 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1n83 h GLU 486 CO -0.01 0.14 0.12 0.87 -1.00 0.00 0.00 179.01 179.13 1n83 h LYS 487 N 0.21 0.82 -0.66 2.33 1.79 -0.93 -2.11 116.57 118.02 1n83 h LYS 487 Ca 0.17 -0.20 0.04 0.00 -2.18 0.00 0.00 60.65 58.48 1n83 h LYS 487 Cb 0.18 -0.11 -0.05 0.00 -1.58 0.00 0.00 32.23 30.67 1n83 h LYS 487 CO -0.20 0.79 0.39 1.25 -1.08 0.00 0.00 179.45 180.59 1n83 h LEU 488 N 0.71 0.60 -0.80 2.94 5.85 -0.66 0.18 115.31 124.14 1n83 h LEU 488 Ca 0.16 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1n83 h LEU 488 Cb 0.34 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 1n83 h LEU 488 CO 0.00 0.41 0.49 0.24 -0.34 0.00 0.00 178.44 179.24 1n83 h MET 489 N 0.74 1.07 -0.50 1.25 2.86 -0.79 0.26 114.93 119.82 1n83 h MET 489 Ca 0.28 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.73 1n83 h MET 489 Cb 0.11 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 1n83 h MET 489 CO -0.15 0.75 -0.09 0.00 1.06 0.00 0.00 176.91 178.49 1n83 h ALA 490 N 1.26 0.68 -0.25 6.32 0.00 -0.77 -1.79 119.26 124.72 1n83 h ALA 490 Ca 0.29 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1n83 h ALA 490 Cb -0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1n83 h ALA 490 CO -0.06 0.57 0.11 0.35 0.00 0.00 0.00 179.25 180.23 1n83 h PHE 491 N 0.80 0.36 -0.28 0.00 3.57 -0.26 -2.63 116.94 118.50 1n83 h PHE 491 Ca 0.13 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.65 1n83 h PHE 491 Cb 0.64 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 1n83 h PHE 491 CO 0.05 0.36 0.19 -0.22 -2.23 0.00 0.00 178.31 176.46 1n83 h LYS 492 N 0.26 0.19 -0.23 1.11 3.64 -0.32 0.35 116.57 121.57 1n83 h LYS 492 Ca 0.08 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1n83 h LYS 492 Cb 0.14 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1n83 h LYS 492 CO -0.01 0.13 -0.11 0.00 -2.27 0.00 0.00 179.45 177.19 1n83 h ALA 493 N 1.85 1.39 0.05 5.00 0.00 -0.95 -2.25 119.26 124.35 1n83 h ALA 493 Ca 0.12 -0.23 -0.33 0.00 0.00 0.00 0.00 54.91 54.48 1n83 h ALA 493 Cb 0.25 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1n83 h ALA 493 CO -0.02 0.42 -1.85 -0.89 0.00 0.00 0.00 179.25 176.91 1n83 n ILE 494 N -4.25 1.68 -3.09 0.00 5.41 -0.28 -4.54 119.36 114.28 1n83 n ILE 494 Ca 0.00 -0.74 -0.24 0.00 1.00 0.00 0.00 62.75 62.77 1n83 n ILE 494 Cb 0.29 -1.33 -0.05 0.00 -0.71 0.00 0.00 39.64 37.84 1n83 n ILE 494 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1n83 n TYR 495 N -3.23 2.67 -0.27 1.39 4.02 -0.04 -4.93 117.16 116.76 1n83 n TYR 495 Ca -0.24 -3.94 -0.03 0.00 -0.01 0.00 0.00 57.90 53.67 1n83 n TYR 495 Cb 1.05 -0.47 0.13 0.00 -0.02 0.00 0.00 39.34 40.03 1n83 n TYR 495 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1n83 h PRO 496 N 3.24 1.13 0.00 -0.72 0.13 -1.64 -2.21 132.00 131.92 1n83 h PRO 496 Ca 0.13 -0.15 -0.14 0.00 -0.87 0.00 0.00 66.00 64.96 1n83 h PRO 496 Cb 0.67 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.57 1n83 h PRO 496 CO 0.71 0.86 -0.68 -0.44 -0.23 0.00 0.00 178.00 178.22 1n83 h ASP 497 N 1.12 0.00 -0.18 1.44 3.45 -1.92 -0.40 116.42 119.94 1n83 h ASP 497 Ca 0.28 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.71 1n83 h ASP 497 Cb 0.09 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.85 1n83 h ASP 497 CO -0.04 0.68 0.01 0.40 -1.57 0.00 0.00 179.24 178.72 1n83 h ILE 498 N 0.00 1.25 -0.19 0.35 1.08 -1.85 -0.11 117.51 118.03 1n83 h ILE 498 Ca -0.01 -0.83 -0.01 0.00 -0.39 0.00 0.00 64.86 63.62 1n83 h ILE 498 Cb 1.32 1.44 -0.01 0.00 -3.07 0.00 0.00 36.82 36.50 1n83 h ILE 498 CO 0.09 0.25 0.10 0.58 -0.69 0.00 0.00 178.15 178.48 1n83 h VAL 499 N 0.08 1.13 -0.51 1.67 2.07 -1.33 0.21 116.25 119.57 1n83 h VAL 499 Ca 0.05 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1n83 h VAL 499 Cb 0.37 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1n83 h VAL 499 CO 0.01 0.12 0.32 -0.09 0.02 0.00 0.00 177.57 177.95 1n83 h ARG 500 N 0.19 0.67 0.00 1.57 2.43 -0.98 -2.78 114.38 115.48 1n83 h ARG 500 Ca 0.07 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.10 1n83 h ARG 500 Cb 0.11 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1n83 h ARG 500 CO -0.01 0.47 -1.75 1.28 -1.51 0.00 0.00 179.97 178.44 1n83 n LEU 501 N -4.71 0.32 0.00 3.80 4.77 -0.06 -4.61 117.00 116.51 1n83 n LEU 501 Ca 0.02 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1n83 n LEU 501 Cb 0.04 0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1n83 n LEU 501 CO 0.35 0.06 0.07 1.41 -1.33 0.00 0.00 177.39 177.95 1n83 n HIS 502 N -2.53 0.00 -3.27 -1.77 8.25 0.74 -5.02 115.22 111.62 1n83 n HIS 502 Ca -0.09 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.03 1n83 n HIS 502 Cb 0.70 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.76 1n83 n HIS 502 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1n83 s PHE 503 N -0.53 3.57 0.20 4.41 0.40 -1.05 -4.99 117.98 119.99 1n83 s PHE 503 Ca 0.00 1.14 -0.32 0.00 -0.60 0.00 0.00 56.93 57.14 1n83 s PHE 503 Cb 0.00 -2.44 -0.13 0.00 0.51 0.00 0.00 43.02 40.96 1n83 s PHE 503 CO 0.00 0.35 1.65 -2.30 0.70 0.00 0.00 175.22 175.62 1n83 n PRO 504 N 0.52 2.53 -0.28 0.24 -0.02 -1.26 -4.87 135.00 131.86 1n83 n PRO 504 Ca -0.03 0.91 0.08 0.00 -2.02 0.00 0.00 63.50 62.44 1n83 n PRO 504 Cb 0.52 -2.72 0.23 0.00 -0.02 0.00 0.00 33.50 31.51 1n83 n PRO 504 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1n83 h PRO 505 N 6.21 0.38 -0.59 0.52 0.11 -1.95 -1.52 132.00 135.16 1n83 h PRO 505 Ca -0.44 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.68 1n83 h PRO 505 Cb 1.22 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 1n83 h PRO 505 CO 0.91 0.25 0.36 1.25 -0.21 0.00 0.00 178.00 180.56 1n83 h LEU 506 N 0.39 0.58 -0.57 2.35 5.85 -1.99 0.16 115.31 122.08 1n83 h LEU 506 Ca 0.47 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.23 1n83 h LEU 506 Cb 0.81 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 1n83 h LEU 506 CO -0.48 0.40 0.32 0.22 -0.34 0.00 0.00 178.44 178.56 1n83 h TYR 507 N 0.70 0.60 -0.62 1.25 3.20 -1.73 -0.48 116.97 119.89 1n83 h TYR 507 Ca 0.24 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.05 1n83 h TYR 507 Cb 0.04 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 1n83 h TYR 507 CO -0.06 0.32 0.05 0.87 -1.64 0.00 0.00 178.16 177.69 1n83 h LYS 508 N 0.63 1.05 -0.76 1.82 1.57 -0.57 -1.52 116.57 118.78 1n83 h LYS 508 Ca 0.24 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 1n83 h LYS 508 Cb 0.09 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 1n83 h LYS 508 CO -0.13 0.99 0.34 0.93 -0.57 0.00 0.00 179.45 181.01 1n83 h GLU 509 N 0.97 1.12 0.04 3.15 5.08 -0.24 -3.12 114.58 121.58 1n83 h GLU 509 Ca 0.18 -0.18 -0.23 0.00 -1.00 0.00 0.00 59.36 58.13 1n83 h GLU 509 Cb 0.49 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 1n83 h GLU 509 CO 0.02 0.89 -1.02 -0.07 -1.00 0.00 0.00 179.01 177.83 1n83 h LEU 510 N 1.08 0.39 -1.07 1.33 3.38 -0.85 -3.51 115.31 116.08 1n83 h LEU 510 Ca 0.26 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1n83 h LEU 510 Cb 0.17 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1n83 h LEU 510 CO -0.03 1.19 0.00 0.49 0.09 0.00 0.00 178.44 180.19