#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i0j h ALA 307 N 0.00 1.83 0.00 -1.18 0.00 -1.98 -1.95 119.26 115.98 2i0j h ALA 307 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2i0j h ALA 307 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2i0j h ALA 307 CO 0.00 0.15 0.11 -0.07 0.00 0.00 0.00 179.25 179.44 2i0j h LEU 308 N 0.26 0.00 0.00 0.00 3.38 -1.94 -0.76 115.31 116.25 2i0j h LEU 308 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2i0j h LEU 308 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2i0j h LEU 308 CO -0.01 0.00 -0.84 -1.54 0.09 0.00 0.00 178.44 176.14 2i0j n SER 309 N -2.55 0.81 -4.78 -0.43 3.41 -0.73 -4.99 113.62 104.36 2i0j n SER 309 Ca -0.02 -0.87 -0.41 0.00 -0.26 0.00 0.00 58.87 57.31 2i0j n SER 309 Cb 0.15 1.03 -0.00 0.00 -0.26 0.00 0.00 64.21 65.12 2i0j n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2i0j s LEU 310 N -2.85 4.33 0.39 1.04 1.43 -0.29 -5.00 118.68 117.72 2i0j s LEU 310 Ca 0.06 3.01 -0.10 0.00 -1.03 0.00 0.00 54.13 56.06 2i0j s LEU 310 Cb 0.13 -3.66 -0.06 0.00 0.03 0.00 0.00 46.19 42.62 2i0j s LEU 310 CO 0.70 -0.84 0.75 0.42 0.23 0.00 0.00 176.35 177.61 2i0j s THR 311 N -1.05 4.80 0.11 5.49 -4.23 -1.26 -4.77 115.64 114.73 2i0j s THR 311 Ca 0.53 0.60 -0.22 0.00 -1.18 0.00 0.00 61.69 61.42 2i0j s THR 311 Cb -0.46 -3.73 -0.05 0.00 1.34 0.00 0.00 72.50 69.61 2i0j s THR 311 CO 0.61 -0.49 1.13 0.00 -0.54 0.00 0.00 174.62 175.33 2i0j n ALA 312 N -1.22 -0.46 0.32 3.99 0.00 -1.26 0.22 120.51 122.11 2i0j n ALA 312 Ca 0.02 0.60 0.20 0.00 0.00 0.00 0.00 53.44 54.26 2i0j n ALA 312 Cb 0.54 -0.08 1.08 0.00 0.00 0.00 0.00 19.45 20.99 2i0j n ALA 312 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2i0j h ASP 313 N 0.00 0.00 0.47 0.00 3.32 -1.96 -0.96 116.42 117.28 2i0j h ASP 313 Ca 0.11 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.86 2i0j h ASP 313 Cb 0.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2i0j h ASP 313 CO -0.67 0.01 -1.49 1.56 -1.72 0.00 0.00 179.24 176.93 2i0j h GLN 314 N 0.00 0.27 0.21 3.56 4.20 0.24 -2.63 115.11 120.95 2i0j h GLN 314 Ca -0.00 -0.46 -0.01 0.00 0.06 0.00 0.00 58.65 58.24 2i0j h GLN 314 Cb 0.04 0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.99 2i0j h GLN 314 CO 0.00 1.15 -0.10 1.98 -0.67 0.00 0.00 178.83 181.19 2i0j h MET 315 N 0.07 -0.27 0.41 1.46 4.05 0.59 -1.24 114.93 120.01 2i0j h MET 315 Ca -0.23 0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.20 2i0j h MET 315 Cb 2.02 0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 32.86 2i0j h MET 315 CO 0.17 -0.08 -0.34 0.28 0.23 0.00 0.00 176.91 177.17 2i0j h VAL 316 N -0.41 0.29 -0.68 -5.77 2.07 -1.39 -1.13 116.25 109.23 2i0j h VAL 316 Ca -0.03 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.62 2i0j h VAL 316 Cb 0.31 0.29 -0.13 0.00 -1.52 0.00 0.00 31.29 30.24 2i0j h VAL 316 CO 0.05 0.00 -0.25 -1.28 0.02 0.00 0.00 177.57 176.11 2i0j h SER 317 N -0.76 -0.89 0.10 0.57 0.87 -1.42 0.24 113.55 112.26 2i0j h SER 317 Ca -0.04 0.23 0.02 0.00 -1.23 0.00 0.00 61.79 60.77 2i0j h SER 317 Cb 0.66 0.51 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 2i0j h SER 317 CO -0.02 -0.27 -0.20 0.00 -0.53 0.00 0.00 176.83 175.80 2i0j h ALA 318 N 1.43 -0.34 -0.67 6.23 0.00 -0.96 -0.51 119.26 124.44 2i0j h ALA 318 Ca 0.30 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.29 2i0j h ALA 318 Cb 0.54 0.33 -0.08 0.00 0.00 0.00 0.00 17.79 18.58 2i0j h ALA 318 CO -0.73 -0.73 0.27 -0.07 0.00 0.00 0.00 179.25 177.99 2i0j h LEU 319 N -0.38 0.29 -0.67 0.00 3.38 0.29 0.13 115.31 118.34 2i0j h LEU 319 Ca 0.03 0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 2i0j h LEU 319 Cb 0.41 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2i0j h LEU 319 CO -0.12 0.15 0.04 -0.07 0.09 0.00 0.00 178.44 178.53 2i0j h LEU 320 N 0.46 1.04 -0.42 1.67 3.38 -0.33 -2.99 115.31 118.12 2i0j h LEU 320 Ca 0.35 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2i0j h LEU 320 Cb 0.45 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2i0j h LEU 320 CO -0.33 1.07 0.06 0.44 0.09 0.00 0.00 178.44 179.77 2i0j h ASP 321 N 0.99 0.67 0.21 -0.43 5.19 0.04 -2.97 116.42 120.12 2i0j h ASP 321 Ca 0.18 -0.27 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 2i0j h ASP 321 Cb 0.51 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.84 2i0j h ASP 321 CO 0.02 0.77 0.00 0.00 -3.12 0.00 0.00 179.24 176.91 2i0j h ALA 322 N 0.93 1.00 -1.58 3.45 0.00 -0.66 -3.45 119.26 118.94 2i0j h ALA 322 Ca 0.13 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.34 2i0j h ALA 322 Cb 0.39 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.23 2i0j h ALA 322 CO 0.01 0.00 0.43 0.39 0.00 0.00 0.00 179.25 180.08 2i0j n GLU 323 N -2.41 0.99 -1.64 0.00 -0.58 -1.12 -4.63 120.64 111.25 2i0j n GLU 323 Ca -0.01 0.36 -0.31 0.00 -0.42 0.00 0.00 57.16 56.79 2i0j n GLU 323 Cb 0.10 -1.98 0.06 0.00 -0.57 0.00 0.00 31.44 29.04 2i0j n GLU 323 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2i0j s PRO 324 N 0.61 2.71 0.77 3.49 0.04 -1.26 -5.05 135.00 136.30 2i0j s PRO 324 Ca 0.86 0.75 -0.12 0.00 0.04 0.00 0.00 61.00 62.54 2i0j s PRO 324 Cb -1.01 -1.98 0.05 0.00 0.04 0.00 0.00 34.50 31.61 2i0j s PRO 324 CO 0.49 -1.21 1.11 -1.25 0.04 0.00 0.00 177.00 176.18 2i0j s PRO 325 N -5.14 2.34 -0.46 0.56 0.04 -1.26 -5.01 135.00 126.07 2i0j s PRO 325 Ca 0.59 0.49 -0.18 0.00 0.04 0.00 0.00 61.00 61.94 2i0j s PRO 325 Cb -0.13 -1.96 0.04 0.00 0.04 0.00 0.00 34.50 32.49 2i0j s PRO 325 CO 0.54 -1.40 0.53 0.42 0.04 0.00 0.00 177.00 177.13 2i0j s ILE 326 N -3.29 4.98 0.68 0.56 1.01 -1.26 -5.06 121.20 118.83 2i0j s ILE 326 Ca 0.60 -0.42 -0.11 0.00 0.00 0.00 0.00 60.65 60.72 2i0j s ILE 326 Cb -0.13 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.17 2i0j s ILE 326 CO 0.53 -0.62 1.07 -0.76 0.00 0.00 0.00 174.94 175.16 2i0j s LEU 327 N 2.37 2.98 0.22 2.97 1.43 -1.26 -4.98 118.68 122.41 2i0j s LEU 327 Ca 0.14 1.15 0.06 0.00 -1.03 0.00 0.00 54.13 54.45 2i0j s LEU 327 Cb -0.18 -4.00 -0.04 0.00 0.03 0.00 0.00 46.19 42.00 2i0j s LEU 327 CO 0.13 -1.24 0.18 -0.31 0.23 0.00 0.00 176.35 175.34 2i0j s TYR 328 N -3.30 3.13 0.17 0.29 1.51 -1.26 -4.42 117.35 113.47 2i0j s TYR 328 Ca 0.57 -0.08 -0.30 0.00 -1.01 0.00 0.00 57.07 56.26 2i0j s TYR 328 Cb -0.11 -1.44 -0.07 0.00 -0.11 0.00 0.00 41.96 40.22 2i0j s TYR 328 CO 0.52 0.52 0.98 0.45 -1.11 0.00 0.00 175.55 176.90 2i0j s SER 329 N -3.58 7.51 -0.21 2.29 0.15 -1.26 -4.94 113.70 113.65 2i0j s SER 329 Ca 0.32 1.90 -0.21 0.00 0.70 0.00 0.00 55.95 58.66 2i0j s SER 329 Cb -0.09 -2.60 -0.02 0.00 -1.71 0.00 0.00 66.02 61.60 2i0j s SER 329 CO 0.24 -0.01 0.67 -1.61 1.20 0.00 0.00 173.24 173.73 2i0j s GLU 330 N -0.49 4.19 0.00 5.44 2.02 -1.26 -5.00 118.70 123.59 2i0j s GLU 330 Ca 0.45 0.67 0.00 0.00 0.02 0.00 0.00 54.97 56.11 2i0j s GLU 330 Cb -0.25 -3.60 0.00 0.00 0.10 0.00 0.00 34.13 30.37 2i0j s GLU 330 CO 0.32 -0.32 0.00 2.48 0.02 0.00 0.00 175.26 177.75 2i0j n TYR 331 N 5.34 0.00 -2.06 1.61 0.18 -1.26 -4.98 117.16 115.99 2i0j n TYR 331 Ca 0.00 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.35 2i0j n TYR 331 Cb 0.49 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.43 2i0j n TYR 331 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2i0j s ASP 332 N 0.00 6.14 0.11 9.48 2.15 -1.26 -4.89 116.67 128.41 2i0j s ASP 332 Ca 0.00 1.44 -0.31 0.00 0.43 0.00 0.00 52.55 54.11 2i0j s ASP 332 Cb 0.00 -2.53 -0.10 0.00 -0.30 0.00 0.00 42.92 39.99 2i0j s ASP 332 CO 0.00 -1.49 1.59 1.55 -0.17 0.00 0.00 175.17 176.65 2i0j h PRO 333 N 11.78 -0.61 -5.16 4.34 0.13 -1.99 -3.45 132.00 137.05 2i0j h PRO 333 Ca -0.34 0.04 -0.52 0.00 -0.87 0.00 0.00 66.00 64.32 2i0j h PRO 333 Cb 1.16 0.14 0.15 0.00 0.13 0.00 0.00 31.00 32.58 2i0j h PRO 333 CO 1.02 -0.41 -0.96 2.41 -0.23 0.00 0.00 178.00 179.83 2i0j n THR 334 N -5.46 0.10 0.00 1.56 -1.04 -1.26 -4.02 114.28 104.15 2i0j n THR 334 Ca -0.07 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.51 2i0j n THR 334 Cb 0.38 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 2i0j n THR 334 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2i0j n ARG 335 N 1.27 0.00 0.00 -2.82 3.00 -1.26 -4.97 116.66 111.87 2i0j n ARG 335 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.91 2i0j n ARG 335 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.85 2i0j n ARG 335 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2i0j n PRO 336 N 0.00 0.00 0.00 5.56 -0.04 -1.26 -4.96 135.00 134.30 2i0j n PRO 336 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2i0j n PRO 336 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2i0j n PRO 336 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2i0j n PHE 337 N 0.00 0.00 0.00 0.54 -1.74 -1.26 -4.96 117.46 110.04 2i0j n PHE 337 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 2i0j n PHE 337 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 2i0j n PHE 337 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 2i0j n SER 338 N -1.00 0.00 0.00 5.98 3.41 -1.26 -1.19 113.62 119.56 2i0j n SER 338 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2i0j n SER 338 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2i0j n SER 338 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2i0j n GLU 339 N 0.00 0.00 0.00 4.33 4.07 -1.26 -4.58 120.64 123.20 2i0j n GLU 339 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2i0j n GLU 339 Cb 0.00 -2.69 0.00 0.00 -0.06 0.00 0.00 31.44 28.69 2i0j n GLU 339 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2i0j n ALA 340 N 0.68 0.00 -0.39 4.31 0.00 -0.33 -2.46 120.51 122.32 2i0j n ALA 340 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2i0j n ALA 340 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2i0j n ALA 340 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2i0j n SER 341 N 0.00 -0.17 0.21 0.00 2.88 -1.26 -4.18 113.62 111.09 2i0j n SER 341 Ca 0.00 0.18 -0.15 0.00 -1.33 0.00 0.00 58.87 57.57 2i0j n SER 341 Cb 0.00 -0.28 -0.08 0.00 -0.75 0.00 0.00 64.21 63.11 2i0j n SER 341 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 2i0j h MET 342 N 3.11 -0.47 -0.68 -1.46 -1.53 -1.89 0.13 114.93 112.14 2i0j h MET 342 Ca 0.00 0.03 0.03 0.00 -3.44 0.00 0.00 59.70 56.33 2i0j h MET 342 Cb 0.00 0.11 -0.04 0.00 -0.55 0.00 0.00 31.60 31.11 2i0j h MET 342 CO 0.00 -0.31 0.42 0.52 0.14 0.00 0.00 176.91 177.67 2i0j h MET 343 N -0.49 0.79 -0.35 0.39 2.86 -1.90 0.78 114.93 117.01 2i0j h MET 343 Ca -0.04 -0.05 0.06 0.00 -2.06 0.00 0.00 59.70 57.61 2i0j h MET 343 Cb 0.39 -0.18 -0.08 0.00 0.06 0.00 0.00 31.60 31.79 2i0j h MET 343 CO 0.05 0.52 -0.45 0.78 1.06 0.00 0.00 176.91 178.87 2i0j h GLY 344 N 0.81 -0.68 0.99 8.32 0.00 -1.62 0.92 103.07 111.82 2i0j h GLY 344 Ca 0.28 0.58 -0.00 0.00 0.00 0.00 0.00 47.33 48.18 2i0j h GLY 344 CO -0.12 -0.18 0.27 1.41 0.00 0.00 0.00 176.54 177.93 2i0j h LEU 345 N -0.38 0.52 -0.22 3.11 3.38 -0.15 -0.63 115.31 120.95 2i0j h LEU 345 Ca 0.11 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2i0j h LEU 345 Cb 0.60 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2i0j h LEU 345 CO -0.54 0.41 0.04 -0.07 0.09 0.00 0.00 178.44 178.37 2i0j h LEU 346 N 0.59 0.34 0.12 1.67 3.38 0.08 -1.99 115.31 119.50 2i0j h LEU 346 Ca 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2i0j h LEU 346 Cb -0.02 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2i0j h LEU 346 CO -0.03 0.51 -0.06 0.74 0.09 0.00 0.00 178.44 179.69 2i0j h THR 347 N 0.17 0.89 -0.85 0.22 2.02 0.94 -0.36 112.91 115.93 2i0j h THR 347 Ca 0.07 -0.02 0.08 0.00 0.77 0.00 0.00 66.41 67.31 2i0j h THR 347 Cb 0.31 0.90 -0.06 0.00 -1.74 0.00 0.00 68.15 67.56 2i0j h THR 347 CO 0.00 0.00 0.55 -1.13 0.37 0.00 0.00 175.52 175.32 2i0j h ASN 348 N -0.17 0.78 -0.15 4.18 -0.73 -1.10 -0.66 115.58 117.73 2i0j h ASN 348 Ca -0.02 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.15 2i0j h ASN 348 Cb 0.13 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.56 2i0j h ASN 348 CO 0.03 0.48 0.04 0.25 -0.37 0.00 0.00 177.43 177.85 2i0j h LEU 349 N 0.87 0.22 -1.41 0.34 5.85 -0.84 -2.77 115.31 117.58 2i0j h LEU 349 Ca 0.38 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.89 2i0j h LEU 349 Cb 0.34 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 2i0j h LEU 349 CO -0.15 0.38 0.41 0.00 -0.34 0.00 0.00 178.44 178.74 2i0j h ALA 350 N 0.84 1.58 -0.08 1.25 0.00 -0.16 -2.03 119.26 120.67 2i0j h ALA 350 Ca 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2i0j h ALA 350 Cb 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2i0j h ALA 350 CO -0.00 0.38 0.01 -0.44 0.00 0.00 0.00 179.25 179.20 2i0j h ASP 351 N 0.81 0.12 0.30 0.00 3.32 -1.00 -1.14 116.42 118.83 2i0j h ASP 351 Ca 0.23 -0.25 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2i0j h ASP 351 Cb -0.06 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2i0j h ASP 351 CO -0.05 0.34 -0.22 0.03 -1.72 0.00 0.00 179.24 177.62 2i0j h ARG 352 N -0.11 0.00 -0.05 3.56 3.08 -1.27 -2.73 114.38 116.87 2i0j h ARG 352 Ca 0.02 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.84 2i0j h ARG 352 Cb 0.27 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.33 2i0j h ARG 352 CO 0.00 0.22 -0.90 0.93 -1.07 0.00 0.00 179.97 179.16 2i0j h GLU 353 N 0.00 0.59 -0.90 0.04 5.08 -1.18 -3.25 114.58 114.97 2i0j h GLU 353 Ca -0.00 -0.57 0.22 0.00 -1.00 0.00 0.00 59.36 58.01 2i0j h GLU 353 Cb 0.43 0.14 -0.12 0.00 0.50 0.00 0.00 28.75 29.71 2i0j h GLU 353 CO 0.03 1.19 0.41 1.25 -1.00 0.00 0.00 179.01 180.88 2i0j h LEU 354 N 0.37 0.36 0.66 1.33 5.85 -0.88 0.20 115.31 123.20 2i0j h LEU 354 Ca -0.08 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2i0j h LEU 354 Cb 1.52 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.68 2i0j h LEU 354 CO 0.17 0.02 -0.33 0.58 -0.34 0.00 0.00 178.44 178.54 2i0j h VAL 355 N 0.43 0.33 0.00 1.05 2.07 -1.59 -1.92 116.25 116.61 2i0j h VAL 355 Ca 0.56 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 68.08 2i0j h VAL 355 Cb 1.04 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2i0j h VAL 355 CO -0.51 0.00 -0.00 0.45 0.02 0.00 0.00 177.57 177.53 2i0j h HIS 356 N -0.90 0.00 -0.41 1.57 3.86 -1.34 -1.46 115.15 116.47 2i0j h HIS 356 Ca -0.09 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 58.99 2i0j h HIS 356 Cb 0.70 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.16 2i0j h HIS 356 CO -0.04 0.00 -0.25 1.98 0.86 0.00 0.00 177.93 180.48 2i0j h MET 357 N 0.00 0.89 0.19 2.45 -1.53 0.12 -2.76 114.93 114.30 2i0j h MET 357 Ca -0.00 -0.41 -0.01 0.00 -3.44 0.00 0.00 59.70 55.84 2i0j h MET 357 Cb 0.01 -0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.05 2i0j h MET 357 CO 0.00 1.06 -0.09 0.82 0.14 0.00 0.00 176.91 178.84 2i0j h ILE 358 N 0.71 0.85 -0.57 1.77 2.04 -0.87 0.89 117.51 122.33 2i0j h ILE 358 Ca 0.08 -0.20 0.12 0.00 1.00 0.00 0.00 64.86 65.87 2i0j h ILE 358 Cb 0.82 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2i0j h ILE 358 CO 0.07 0.05 0.39 0.78 0.00 0.00 0.00 178.15 179.44 2i0j h ASN 359 N -0.36 0.23 0.51 1.72 2.35 -1.58 -1.04 115.58 117.41 2i0j h ASN 359 Ca -0.03 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 2i0j h ASN 359 Cb 0.27 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2i0j h ASN 359 CO 0.04 0.13 -0.24 -0.25 -1.65 0.00 0.00 177.43 175.46 2i0j h TRP 360 N 0.25 -0.63 -0.80 1.19 7.01 -1.05 -3.13 115.95 118.78 2i0j h TRP 360 Ca 0.27 -0.01 0.19 0.00 2.11 0.00 0.00 58.89 61.44 2i0j h TRP 360 Cb 0.73 0.21 -0.14 0.00 -2.10 0.00 0.00 29.16 27.85 2i0j h TRP 360 CO -0.00 -0.31 -0.01 0.00 -2.79 0.00 0.00 178.44 175.33 2i0j h ALA 361 N -0.78 0.82 -0.09 2.65 0.00 0.07 0.69 119.26 122.62 2i0j h ALA 361 Ca -0.07 0.27 0.03 0.00 0.00 0.00 0.00 54.91 55.13 2i0j h ALA 361 Cb 0.61 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2i0j h ALA 361 CO 0.11 -0.44 0.19 0.87 0.00 0.00 0.00 179.25 179.98 2i0j h LYS 362 N 0.08 0.00 -0.04 0.00 1.57 -1.20 0.94 116.57 117.92 2i0j h LYS 362 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 2i0j h LYS 362 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 2i0j h LYS 362 CO -0.73 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 178.69 2i0j n ARG 363 N -3.39 2.29 -2.45 3.15 1.74 0.24 -4.46 116.66 113.78 2i0j n ARG 363 Ca -0.00 -1.88 -0.43 0.00 -0.77 0.00 0.00 57.85 54.77 2i0j n ARG 363 Cb 0.28 -1.46 -0.02 0.00 -1.02 0.00 0.00 32.46 30.23 2i0j n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2i0j s VAL 364 N -1.99 4.18 -0.41 1.55 1.01 0.32 -4.83 120.40 120.23 2i0j s VAL 364 Ca 0.29 1.32 -0.43 0.00 0.00 0.00 0.00 61.98 63.16 2i0j s VAL 364 Cb 0.20 -4.21 -0.17 0.00 0.00 0.00 0.00 36.38 32.20 2i0j s VAL 364 CO 0.30 -0.52 1.86 -2.65 0.00 0.00 0.00 175.10 174.10 2i0j n PRO 365 N 7.32 0.50 0.00 2.72 -0.02 -1.26 -0.94 135.00 143.31 2i0j n PRO 365 Ca 0.14 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2i0j n PRO 365 Cb 0.47 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 2i0j n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2i0j n GLY 366 N 5.30 1.36 0.19 -1.23 0.00 -1.26 -4.89 105.19 104.66 2i0j n GLY 366 Ca 0.37 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.27 2i0j n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2i0j h PHE 367 N 0.00 -0.36 -0.05 1.61 3.57 -1.33 -3.16 116.94 117.22 2i0j h PHE 367 Ca 0.00 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.51 2i0j h PHE 367 Cb 0.00 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.86 2i0j h PHE 367 CO 0.00 -0.01 0.10 -0.39 -2.23 0.00 0.00 178.31 175.77 2i0j h VAL 368 N -0.81 0.28 0.00 1.41 -1.51 -1.78 -0.55 116.25 113.29 2i0j h VAL 368 Ca -0.04 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.43 2i0j h VAL 368 Cb 0.51 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 2i0j h VAL 368 CO 0.07 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.88 2i0j n ASP 369 N -3.47 0.00 -4.97 4.19 8.00 -1.19 -4.72 116.55 114.38 2i0j n ASP 369 Ca -0.02 -0.26 -0.21 0.00 0.71 0.00 0.00 54.79 55.02 2i0j n ASP 369 Cb 0.18 -0.12 0.02 0.00 -0.02 0.00 0.00 41.12 41.18 2i0j n ASP 369 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2i0j s LEU 370 N -2.24 3.56 0.69 0.64 1.43 -0.22 -5.07 118.68 117.47 2i0j s LEU 370 Ca 0.20 0.02 -0.13 0.00 -1.03 0.00 0.00 54.13 53.19 2i0j s LEU 370 Cb 0.11 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.41 2i0j s LEU 370 CO 0.20 -0.83 1.08 0.42 0.23 0.00 0.00 176.35 177.46 2i0j s THR 371 N -2.55 3.58 0.14 5.49 -4.23 -1.26 -4.82 115.64 112.00 2i0j s THR 371 Ca 0.52 0.61 -0.18 0.00 -1.18 0.00 0.00 61.69 61.46 2i0j s THR 371 Cb -0.10 -3.18 -0.02 0.00 1.34 0.00 0.00 72.50 70.55 2i0j s THR 371 CO 0.36 -0.58 1.80 0.25 -0.54 0.00 0.00 174.62 175.91 2i0j h LEU 372 N -0.43 0.36 -1.22 4.79 6.46 -1.97 0.17 115.31 123.45 2i0j h LEU 372 Ca -0.45 -0.01 0.09 0.00 -0.12 0.00 0.00 57.88 57.39 2i0j h LEU 372 Cb 1.23 -0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 41.01 2i0j h LEU 372 CO 0.55 0.26 0.56 -0.74 -0.62 0.00 0.00 178.44 178.45 2i0j h HIS 373 N 0.43 0.93 -0.08 1.25 2.76 -2.00 -0.77 115.15 117.67 2i0j h HIS 373 Ca 0.12 0.02 -0.17 0.00 -2.20 0.00 0.00 60.37 58.14 2i0j h HIS 373 Cb -0.04 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 28.61 2i0j h HIS 373 CO -0.06 0.45 -0.69 -0.44 -1.30 0.00 0.00 177.93 175.89 2i0j h ASP 374 N 0.88 0.42 -0.53 3.26 5.19 -1.74 -1.81 116.42 122.10 2i0j h ASP 374 Ca 0.39 -0.27 -0.12 0.00 -0.62 0.00 0.00 57.03 56.42 2i0j h ASP 374 Cb 0.36 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.73 2i0j h ASP 374 CO -0.16 0.98 -0.13 1.56 -3.12 0.00 0.00 179.24 178.37 2i0j h GLN 375 N 0.25 1.02 -0.28 3.56 4.20 0.05 -2.08 115.11 121.84 2i0j h GLN 375 Ca -0.02 -0.39 -0.10 0.00 0.06 0.00 0.00 58.65 58.19 2i0j h GLN 375 Cb 1.25 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 2i0j h GLN 375 CO 0.12 1.08 -0.25 0.28 -0.67 0.00 0.00 178.83 179.38 2i0j h VAL 376 N 0.89 1.27 -0.00 -0.54 2.07 -1.07 -2.41 116.25 116.46 2i0j h VAL 376 Ca 0.13 -1.30 -0.15 0.00 0.82 0.00 0.00 66.70 66.20 2i0j h VAL 376 Cb 0.71 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 2i0j h VAL 376 CO 0.05 0.42 -0.71 -0.74 0.02 0.00 0.00 177.57 176.61 2i0j h HIS 377 N 0.47 0.03 -0.13 1.57 -0.00 -1.17 -0.63 115.15 115.29 2i0j h HIS 377 Ca 0.07 -0.01 -0.12 0.00 -0.00 0.00 0.00 60.37 60.31 2i0j h HIS 377 Cb 0.69 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.10 2i0j h HIS 377 CO 0.03 0.73 -0.38 -0.07 -0.00 0.00 0.00 177.93 178.24 2i0j h LEU 378 N 0.01 0.55 -0.09 0.26 3.38 -1.27 -2.40 115.31 115.75 2i0j h LEU 378 Ca -0.01 -0.60 -0.02 0.00 0.09 0.00 0.00 57.88 57.35 2i0j h LEU 378 Cb 1.26 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 2i0j h LEU 378 CO 0.09 1.05 -0.02 -0.07 0.09 0.00 0.00 178.44 179.59 2i0j h LEU 379 N 0.08 0.16 -1.52 1.67 3.38 -1.44 -0.78 115.31 116.87 2i0j h LEU 379 Ca -0.01 -0.36 0.13 0.00 0.09 0.00 0.00 57.88 57.73 2i0j h LEU 379 Cb 1.00 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 2i0j h LEU 379 CO 0.08 0.49 0.50 -0.08 0.09 0.00 0.00 178.44 179.52 2i0j h GLU 380 N -0.16 0.48 0.00 1.13 4.81 -1.18 0.11 114.58 119.77 2i0j h GLU 380 Ca 0.02 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 2i0j h GLU 380 Cb 0.41 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 2i0j h GLU 380 CO 0.01 0.32 -0.18 1.03 -0.73 0.00 0.00 179.01 179.45 2i0j h SER 381 N 0.50 0.00 0.00 1.04 0.87 -1.11 -3.37 113.55 111.47 2i0j h SER 381 Ca 0.36 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 2i0j h SER 381 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 2i0j h SER 381 CO -0.13 0.09 -0.09 0.00 -0.53 0.00 0.00 176.83 176.18 2i0j n ALA 382 N -2.13 1.89 -0.16 6.23 0.00 -0.33 -4.73 120.51 121.28 2i0j n ALA 382 Ca 0.03 -1.40 -0.10 0.00 0.00 0.00 0.00 53.44 51.98 2i0j n ALA 382 Cb 0.57 -0.20 -0.00 0.00 0.00 0.00 0.00 19.45 19.82 2i0j n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2i0j h TRP 383 N 0.00 0.83 -0.19 0.00 5.08 -1.02 -1.53 115.95 119.12 2i0j h TRP 383 Ca 0.00 -0.12 -0.18 0.00 1.08 0.00 0.00 58.89 59.67 2i0j h TRP 383 Cb 0.90 -0.22 -0.00 0.00 -3.00 0.00 0.00 29.16 26.84 2i0j h TRP 383 CO 0.02 0.78 -0.61 1.25 -1.28 0.00 0.00 178.44 178.60 2i0j h LEU 384 N 0.64 0.72 -0.44 0.11 5.85 -1.88 -0.25 115.31 120.07 2i0j h LEU 384 Ca 0.14 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2i0j h LEU 384 Cb 0.41 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2i0j h LEU 384 CO 0.01 1.16 0.28 -0.33 -0.34 0.00 0.00 178.44 179.22 2i0j h GLU 385 N 0.48 0.59 -0.55 1.25 5.08 -1.84 0.11 114.58 119.70 2i0j h GLU 385 Ca -0.00 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 2i0j h GLU 385 Cb 1.18 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 2i0j h GLU 385 CO 0.12 0.41 0.22 0.82 -1.00 0.00 0.00 179.01 179.58 2i0j h ILE 386 N 0.59 1.22 -0.62 3.13 2.04 -1.11 -0.10 117.51 122.66 2i0j h ILE 386 Ca 0.16 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 2i0j h ILE 386 Cb -0.04 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 2i0j h ILE 386 CO -0.03 0.26 0.32 -0.07 0.00 0.00 0.00 178.15 178.63 2i0j h LEU 387 N 0.75 0.80 -0.21 1.44 3.38 -0.70 -1.94 115.31 118.83 2i0j h LEU 387 Ca 0.18 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2i0j h LEU 387 Cb 0.19 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2i0j h LEU 387 CO -0.02 0.69 -0.02 0.24 0.09 0.00 0.00 178.44 179.42 2i0j h MET 388 N 0.85 0.38 0.00 1.13 2.86 -0.38 -1.41 114.93 118.37 2i0j h MET 388 Ca 0.22 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 2i0j h MET 388 Cb 0.08 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.71 2i0j h MET 388 CO -0.03 0.60 -0.05 0.97 1.06 0.00 0.00 176.91 179.46 2i0j h ILE 389 N 0.13 0.97 -0.04 -1.22 2.10 -0.94 0.33 117.51 118.82 2i0j h ILE 389 Ca 0.06 -0.18 -0.01 0.00 1.08 0.00 0.00 64.86 65.81 2i0j h ILE 389 Cb 0.45 1.10 -0.00 0.00 -1.09 0.00 0.00 36.82 37.28 2i0j h ILE 389 CO 0.02 0.05 -0.00 1.23 -1.08 0.00 0.00 178.15 178.36 2i0j h GLY 390 N 0.17 0.09 0.07 8.18 0.00 -1.03 -1.75 103.07 108.80 2i0j h GLY 390 Ca -0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 2i0j h GLY 390 CO 0.01 0.06 -0.05 -2.00 0.00 0.00 0.00 176.54 174.56 2i0j h LEU 391 N -0.23 -0.12 -1.71 3.11 5.85 0.09 -1.69 115.31 120.61 2i0j h LEU 391 Ca 0.01 0.01 0.50 0.00 0.84 0.00 0.00 57.88 59.24 2i0j h LEU 391 Cb 0.35 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.34 2i0j h LEU 391 CO 0.00 -0.07 1.22 0.52 -0.34 0.00 0.00 178.44 179.77 2i0j n VAL 392 N -2.48 -0.02 -0.01 1.05 0.31 0.97 0.17 118.33 118.32 2i0j n VAL 392 Ca -0.01 1.33 -0.16 0.00 -0.01 0.00 0.00 64.34 65.48 2i0j n VAL 392 Cb 0.05 -2.21 -0.11 0.00 -0.91 0.00 0.00 33.84 30.65 2i0j n VAL 392 CO 0.00 0.00 0.00 -0.25 -1.32 0.00 0.00 176.83 175.26 2i0j h TRP 393 N 0.00 0.44 -0.00 3.52 2.91 -0.41 -3.28 115.95 119.13 2i0j h TRP 393 Ca 0.83 -0.23 0.00 0.00 1.13 0.00 0.00 58.89 60.61 2i0j h TRP 393 Cb 3.27 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 31.87 2i0j h TRP 393 CO -0.00 1.04 -0.02 2.89 -1.03 0.00 0.00 178.44 181.32 2i0j n ARG 394 N -4.36 0.20 -0.56 2.65 1.85 0.13 -2.92 116.66 113.65 2i0j n ARG 394 Ca -0.10 -0.01 0.06 0.00 -1.00 0.00 0.00 57.85 56.80 2i0j n ARG 394 Cb 0.58 -1.50 0.29 0.00 -1.05 0.00 0.00 32.46 30.78 2i0j n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2i0j n SER 395 N -1.39 4.09 -0.01 2.89 7.64 -0.67 -4.37 113.62 121.80 2i0j n SER 395 Ca 0.10 -2.50 -0.16 0.00 1.01 0.00 0.00 58.87 57.32 2i0j n SER 395 Cb 0.30 -0.56 -0.05 0.00 -1.01 0.00 0.00 64.21 62.88 2i0j n SER 395 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2i0j h MET 396 N 3.05 0.74 -1.01 1.43 2.86 -1.62 -3.19 114.93 117.18 2i0j h MET 396 Ca 0.00 -0.59 -0.40 0.00 -2.06 0.00 0.00 59.70 56.65 2i0j h MET 396 Cb 1.36 0.12 -0.23 0.00 0.06 0.00 0.00 31.60 32.91 2i0j h MET 396 CO 0.27 1.20 0.51 0.39 1.06 0.00 0.00 176.91 180.33 2i0j n GLU 397 N -3.93 1.96 -2.97 1.72 1.02 -1.26 -4.30 120.64 112.89 2i0j n GLU 397 Ca -0.07 -2.30 -0.14 0.00 -0.02 0.00 0.00 57.16 54.64 2i0j n GLU 397 Cb 0.73 -1.90 0.01 0.00 -0.02 0.00 0.00 31.44 30.26 2i0j n GLU 397 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2i0j n HIS 398 N -0.74 0.03 -1.51 -0.32 8.25 -1.20 -5.11 115.22 114.62 2i0j n HIS 398 Ca 0.46 -3.26 -0.54 0.00 -0.26 0.00 0.00 57.72 54.12 2i0j n HIS 398 Cb 1.37 -0.10 -0.06 0.00 1.12 0.00 0.00 29.99 32.31 2i0j n HIS 398 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2i0j n PRO 399 N 0.14 0.38 -0.05 -0.41 -0.04 -1.26 -0.21 135.00 133.56 2i0j n PRO 399 Ca 0.17 0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 2i0j n PRO 399 Cb 0.72 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 2i0j n PRO 399 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2i0j n GLY 400 N 1.83 1.72 3.25 0.55 0.00 -1.26 -5.02 105.19 106.26 2i0j n GLY 400 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 2i0j n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i0j s LYS 401 N -0.40 1.07 -0.30 1.61 1.02 0.71 -3.82 119.74 119.63 2i0j s LYS 401 Ca 0.00 -1.46 0.00 0.00 0.02 0.00 0.00 55.97 54.53 2i0j s LYS 401 Cb 0.00 -0.62 0.06 0.00 -0.52 0.00 0.00 37.83 36.76 2i0j s LYS 401 CO 0.00 0.07 -0.02 -0.51 -0.92 0.00 0.00 175.35 173.97 2i0j s LEU 402 N -3.17 3.91 -1.28 3.17 1.43 0.53 -4.79 118.68 118.49 2i0j s LEU 402 Ca 0.17 -1.43 -0.17 0.00 -1.03 0.00 0.00 54.13 51.67 2i0j s LEU 402 Cb 0.03 -1.66 -0.00 0.00 0.03 0.00 0.00 46.19 44.58 2i0j s LEU 402 CO 0.01 -0.27 2.07 -0.11 0.23 0.00 0.00 176.35 178.28 2i0j n LEU 403 N 4.53 5.75 -0.21 1.79 7.94 -1.26 -1.90 117.00 133.65 2i0j n LEU 403 Ca -0.11 -3.79 -0.00 0.00 -1.11 0.00 0.00 56.01 50.99 2i0j n LEU 403 Cb 0.43 -1.57 0.11 0.00 0.53 0.00 0.00 43.42 42.92 2i0j n LEU 403 CO 0.25 0.48 1.00 -0.26 -1.11 0.00 0.00 177.39 177.74 2i0j h PHE 404 N 6.87 0.42 -4.17 1.96 0.04 -1.77 -3.44 116.94 116.85 2i0j h PHE 404 Ca 0.50 0.03 -0.15 0.00 2.80 0.00 0.00 57.97 61.15 2i0j h PHE 404 Cb 0.70 -0.10 -0.14 0.00 2.20 0.00 0.00 35.95 38.62 2i0j h PHE 404 CO 1.40 0.12 -0.48 0.00 -0.60 0.00 0.00 178.31 178.74 2i0j s ALA 405 N -6.09 0.47 0.36 2.45 0.00 -0.83 -4.98 121.76 113.14 2i0j s ALA 405 Ca -0.13 -1.21 0.38 0.00 0.00 0.00 0.00 51.96 51.00 2i0j s ALA 405 Cb 0.17 0.92 1.82 0.00 0.00 0.00 0.00 23.12 26.03 2i0j s ALA 405 CO 0.75 -0.58 2.15 -1.35 0.00 0.00 0.00 175.76 176.73 2i0j h PRO 406 N 2.68 0.00 -0.13 0.00 0.11 -1.85 -1.96 132.00 130.85 2i0j h PRO 406 Ca -0.33 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.75 2i0j h PRO 406 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2i0j h PRO 406 CO 0.53 0.01 -0.08 0.27 -0.21 0.00 0.00 178.00 178.52 2i0j n ASN 407 N -3.13 2.74 -2.91 -2.05 6.94 -1.26 -4.74 115.26 110.84 2i0j n ASN 407 Ca -0.01 -3.28 -0.12 0.00 -0.02 0.00 0.00 54.58 51.15 2i0j n ASN 407 Cb 0.20 -0.51 -0.00 0.00 -2.36 0.00 0.00 39.78 37.11 2i0j n ASN 407 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 2i0j n LEU 408 N -1.08 -2.27 -4.40 -4.53 7.94 -0.74 -4.84 117.00 107.09 2i0j n LEU 408 Ca 0.20 -3.55 -0.42 0.00 -1.11 0.00 0.00 56.01 51.14 2i0j n LEU 408 Cb 0.78 0.74 -0.11 0.00 0.53 0.00 0.00 43.42 45.37 2i0j n LEU 408 CO 0.07 1.97 -0.12 -0.22 -1.11 0.00 0.00 177.39 177.99 2i0j s LEU 409 N -0.17 4.93 0.21 -1.96 2.96 -1.25 -1.95 118.68 121.44 2i0j s LEU 409 Ca 0.32 -1.01 0.06 0.00 -0.22 0.00 0.00 54.13 53.28 2i0j s LEU 409 Cb 0.12 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2i0j s LEU 409 CO -0.16 -0.43 0.16 -0.76 -1.32 0.00 0.00 176.35 173.84 2i0j s LEU 410 N 1.59 3.79 0.28 -0.68 1.43 -0.80 -4.89 118.68 119.40 2i0j s LEU 410 Ca 0.03 -0.20 0.11 0.00 -1.03 0.00 0.00 54.13 53.04 2i0j s LEU 410 Cb -0.20 -2.36 -0.05 0.00 0.03 0.00 0.00 46.19 43.62 2i0j s LEU 410 CO 0.08 0.02 -0.15 1.51 0.23 0.00 0.00 176.35 178.03 2i0j s ASP 411 N -3.46 3.81 0.27 2.29 1.47 -1.26 -0.35 116.67 119.45 2i0j s ASP 411 Ca 0.32 -0.94 0.09 0.00 1.18 0.00 0.00 52.55 53.20 2i0j s ASP 411 Cb -0.09 -0.43 0.85 0.00 -0.34 0.00 0.00 42.92 42.92 2i0j s ASP 411 CO 0.24 0.03 1.26 -1.14 0.68 0.00 0.00 175.17 176.24 2i0j n ARG 412 N -0.68 -0.06 0.41 2.11 0.63 -1.25 -0.63 116.66 117.19 2i0j n ARG 412 Ca -0.05 1.16 -0.18 0.00 -0.92 0.00 0.00 57.85 57.85 2i0j n ARG 412 Cb 0.60 -1.95 -0.09 0.00 0.45 0.00 0.00 32.46 31.46 2i0j n ARG 412 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2i0j h ASN 413 N 0.00 -0.86 0.00 6.15 2.35 -1.95 -2.12 115.58 119.15 2i0j h ASN 413 Ca 0.59 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.35 2i0j h ASN 413 Cb 1.41 0.22 0.00 0.00 0.05 0.00 0.00 38.32 40.01 2i0j h ASN 413 CO -0.69 -0.58 0.29 0.00 -1.65 0.00 0.00 177.43 174.80 2i0j n GLN 414 N -5.51 0.09 0.16 0.81 6.02 0.20 0.43 117.38 119.58 2i0j n GLN 414 Ca -0.14 0.57 0.05 0.00 -0.01 0.00 0.00 57.00 57.46 2i0j n GLN 414 Cb 0.41 -2.08 0.06 0.00 1.02 0.00 0.00 30.24 29.66 2i0j n GLN 414 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2i0j h GLY 415 N 0.00 0.00 2.00 1.08 0.00 -1.12 -3.09 103.07 101.94 2i0j h GLY 415 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2i0j h GLY 415 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 2i0j n LYS 416 N -3.20 0.02 0.01 4.80 5.02 0.17 -3.03 118.16 121.95 2i0j n LYS 416 Ca 0.02 0.23 0.15 0.00 -2.02 0.00 0.00 58.31 56.69 2i0j n LYS 416 Cb 0.69 -1.54 0.61 0.00 -0.02 0.00 0.00 35.03 34.76 2i0j n LYS 416 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2i0j h SER 417 N 0.00 0.15 -4.35 4.39 0.87 -1.64 -3.41 113.55 109.56 2i0j h SER 417 Ca 0.00 0.00 -0.60 0.00 -1.23 0.00 0.00 61.79 59.97 2i0j h SER 417 Cb 0.30 -0.03 -0.27 0.00 -0.44 0.00 0.00 62.40 61.96 2i0j h SER 417 CO 0.00 0.09 -0.85 -0.69 -0.53 0.00 0.00 176.83 174.85 2i0j s VAL 418 N -5.17 1.68 -0.08 2.23 1.01 -1.17 -5.06 120.40 113.83 2i0j s VAL 418 Ca -0.06 -1.08 -0.30 0.00 0.00 0.00 0.00 61.98 60.55 2i0j s VAL 418 Cb 0.19 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2i0j s VAL 418 CO 0.73 0.32 1.52 -0.70 0.00 0.00 0.00 175.10 176.97 2i0j s GLU 419 N -0.89 4.20 0.00 2.72 2.12 -1.26 -2.59 118.70 123.00 2i0j s GLU 419 Ca 0.08 2.02 0.00 0.00 0.36 0.00 0.00 54.97 57.43 2i0j s GLU 419 Cb -0.09 -3.89 0.00 0.00 0.26 0.00 0.00 34.13 30.42 2i0j s GLU 419 CO 0.01 -0.78 0.00 0.41 -0.54 0.00 0.00 175.26 174.35 2i0j n GLY 420 N 3.94 0.30 0.13 -1.50 0.00 -1.26 -4.93 105.19 101.87 2i0j n GLY 420 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 2i0j n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2i0j h MET 421 N 3.90 0.00 -0.19 1.61 -1.53 -1.71 -3.35 114.93 113.67 2i0j h MET 421 Ca 0.00 0.00 -0.18 0.00 -3.44 0.00 0.00 59.70 56.08 2i0j h MET 421 Cb 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.05 2i0j h MET 421 CO 0.00 0.00 -0.62 0.28 0.14 0.00 0.00 176.91 176.71 2i0j h VAL 422 N 0.00 1.31 0.17 -5.77 2.07 -1.75 -0.15 116.25 112.12 2i0j h VAL 422 Ca 0.00 -1.87 -0.01 0.00 0.82 0.00 0.00 66.70 65.64 2i0j h VAL 422 Cb 0.95 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 2i0j h VAL 422 CO 0.00 0.59 -0.08 -0.33 0.02 0.00 0.00 177.57 177.76 2i0j h GLU 423 N 0.48 -0.22 0.35 1.57 3.07 -1.95 0.18 114.58 118.07 2i0j h GLU 423 Ca -0.01 0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2i0j h GLU 423 Cb 1.20 0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 29.13 2i0j h GLU 423 CO 0.12 -0.11 -0.50 0.82 -1.40 0.00 0.00 179.01 177.94 2i0j h ILE 424 N -0.27 0.03 -0.87 3.13 1.08 -1.67 -1.11 117.51 117.83 2i0j h ILE 424 Ca -0.02 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.65 2i0j h ILE 424 Cb 0.21 0.03 -0.16 0.00 -3.07 0.00 0.00 36.82 33.83 2i0j h ILE 424 CO 0.04 0.00 -0.04 -0.26 -0.69 0.00 0.00 178.15 177.20 2i0j h PHE 425 N -0.90 -0.14 -0.34 1.37 0.04 -0.87 0.37 116.94 116.47 2i0j h PHE 425 Ca -0.04 0.07 -0.07 0.00 2.80 0.00 0.00 57.97 60.73 2i0j h PHE 425 Cb 0.82 0.20 -0.02 0.00 2.20 0.00 0.00 35.95 39.15 2i0j h PHE 425 CO -0.33 -0.33 -0.06 -0.44 -0.60 0.00 0.00 178.31 176.54 2i0j h ASP 426 N 0.05 0.54 -0.19 2.17 3.32 -0.02 -0.21 116.42 122.08 2i0j h ASP 426 Ca 0.48 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.36 2i0j h ASP 426 Cb 0.88 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 2i0j h ASP 426 CO -0.81 0.65 -0.06 0.24 -1.72 0.00 0.00 179.24 177.55 2i0j h MET 427 N 0.53 0.37 -0.35 3.56 2.86 0.89 0.41 114.93 123.20 2i0j h MET 427 Ca 0.10 -0.15 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2i0j h MET 427 Cb 0.44 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 2i0j h MET 427 CO 0.02 0.64 0.22 -0.07 1.06 0.00 0.00 176.91 178.78 2i0j h LEU 428 N 0.08 0.36 0.04 1.22 3.38 -0.79 0.08 115.31 119.68 2i0j h LEU 428 Ca 0.05 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2i0j h LEU 428 Cb 0.51 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2i0j h LEU 428 CO 0.02 0.26 -0.12 -0.07 0.09 0.00 0.00 178.44 178.62 2i0j h LEU 429 N 0.44 -0.33 -0.77 1.67 3.38 -0.95 0.13 115.31 118.88 2i0j h LEU 429 Ca 0.14 0.04 0.17 0.00 0.09 0.00 0.00 57.88 58.32 2i0j h LEU 429 Cb -0.01 0.13 -0.11 0.00 0.09 0.00 0.00 40.66 40.76 2i0j h LEU 429 CO -0.05 -0.17 0.22 0.00 0.09 0.00 0.00 178.44 178.53 2i0j h ALA 430 N 0.71 1.04 -0.28 1.53 0.00 -0.34 -0.57 119.26 121.35 2i0j h ALA 430 Ca 0.03 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2i0j h ALA 430 Cb 0.25 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2i0j h ALA 430 CO -0.09 -0.33 -0.14 1.15 0.00 0.00 0.00 179.25 179.85 2i0j h THR 431 N 0.31 1.30 -0.73 0.00 2.02 -0.26 -2.48 112.91 113.07 2i0j h THR 431 Ca 0.44 -1.23 0.11 0.00 0.77 0.00 0.00 66.41 66.50 2i0j h THR 431 Cb 0.76 1.51 -0.05 0.00 -1.74 0.00 0.00 68.15 68.63 2i0j h THR 431 CO -0.51 0.39 0.48 -1.28 0.37 0.00 0.00 175.52 174.97 2i0j h SER 432 N 0.32 0.52 0.05 4.18 0.87 0.71 -1.43 113.55 118.77 2i0j h SER 432 Ca 0.06 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2i0j h SER 432 Cb 0.65 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 2i0j h SER 432 CO 0.04 0.30 -0.02 0.28 -0.53 0.00 0.00 176.83 176.90 2i0j h SER 433 N 0.57 -0.06 -0.93 6.23 0.02 -1.06 -2.25 113.55 116.08 2i0j h SER 433 Ca 0.34 -0.35 0.14 0.00 -0.84 0.00 0.00 61.79 61.08 2i0j h SER 433 Cb 0.55 0.01 -0.09 0.00 0.14 0.00 0.00 62.40 63.01 2i0j h SER 433 CO -0.12 0.33 0.55 -0.09 -1.14 0.00 0.00 176.83 176.36 2i0j h ARG 434 N -0.45 0.77 -0.45 3.45 9.65 -0.86 0.80 114.38 127.29 2i0j h ARG 434 Ca -0.01 -0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 58.75 2i0j h ARG 434 Cb 0.41 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.80 2i0j h ARG 434 CO 0.01 0.51 -0.01 0.74 2.80 0.00 0.00 179.97 184.02 2i0j h PHE 435 N 0.80 0.88 -0.56 2.20 -1.00 -1.24 -0.50 116.94 117.52 2i0j h PHE 435 Ca 0.49 -0.16 -0.07 0.00 2.81 0.00 0.00 57.97 61.05 2i0j h PHE 435 Cb 0.62 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.93 2i0j h PHE 435 CO -0.04 0.86 0.08 -0.09 -1.61 0.00 0.00 178.31 177.51 2i0j h ARG 436 N 0.65 0.94 -0.26 1.51 2.43 -0.54 -0.35 114.38 118.75 2i0j h ARG 436 Ca 0.13 -0.26 -0.05 0.00 -0.81 0.00 0.00 59.98 58.99 2i0j h ARG 436 Cb 0.51 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 2i0j h ARG 436 CO 0.03 0.90 -0.06 1.98 -1.51 0.00 0.00 179.97 181.31 2i0j h MET 437 N 0.83 0.41 -0.00 0.20 4.05 0.74 -2.31 114.93 118.84 2i0j h MET 437 Ca 0.17 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.50 2i0j h MET 437 Cb 0.42 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.17 2i0j h MET 437 CO 0.01 0.49 -0.24 -1.33 0.23 0.00 0.00 176.91 176.07 2i0j n MET 438 N -4.28 0.43 -3.59 0.39 2.81 -0.21 -4.94 117.12 107.74 2i0j n MET 438 Ca 0.01 -0.19 -0.22 0.00 -1.81 0.00 0.00 57.70 55.48 2i0j n MET 438 Cb 0.26 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.34 2i0j n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2i0j n ASN 439 N -1.11 -4.27 -4.67 7.83 2.85 -0.22 -4.86 115.26 110.80 2i0j n ASN 439 Ca 0.10 -0.62 -0.46 0.00 -0.11 0.00 0.00 54.58 53.50 2i0j n ASN 439 Cb 0.32 -4.84 -0.04 0.00 1.24 0.00 0.00 39.78 36.46 2i0j n ASN 439 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2i0j n LEU 440 N -4.62 3.07 -4.90 1.20 7.94 -0.73 -4.97 117.00 113.99 2i0j n LEU 440 Ca -0.12 1.11 -0.28 0.00 -1.11 0.00 0.00 56.01 55.61 2i0j n LEU 440 Cb 0.60 -1.42 -0.00 0.00 0.53 0.00 0.00 43.42 43.13 2i0j n LEU 440 CO 0.65 -0.38 0.48 -1.10 -1.11 0.00 0.00 177.39 175.93 2i0j s GLN 441 N 0.39 3.56 0.29 1.96 -1.52 -1.26 -4.95 119.66 118.13 2i0j s GLN 441 Ca 0.75 0.28 0.05 0.00 -1.95 0.00 0.00 55.36 54.49 2i0j s GLN 441 Cb -0.67 -2.34 0.45 0.00 -0.22 0.00 0.00 33.01 30.23 2i0j s GLN 441 CO 0.43 -0.24 1.72 0.78 -0.25 0.00 0.00 175.29 177.72 2i0j h GLY 442 N 0.21 0.37 1.17 3.09 0.00 -1.99 -1.02 103.07 104.90 2i0j h GLY 442 Ca -0.47 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 46.46 2i0j h GLY 442 CO 0.62 0.30 0.07 0.83 0.00 0.00 0.00 176.54 178.35 2i0j h GLU 443 N 0.30 1.00 -0.32 4.80 3.07 -1.99 -1.65 114.58 119.79 2i0j h GLU 443 Ca 0.04 -0.27 -0.14 0.00 -0.50 0.00 0.00 59.36 58.48 2i0j h GLU 443 Cb 0.73 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 2i0j h GLU 443 CO 0.06 0.95 -0.38 0.93 -1.40 0.00 0.00 179.01 179.16 2i0j h GLU 444 N 0.94 0.76 0.70 2.33 5.08 -1.88 -3.04 114.58 119.47 2i0j h GLU 444 Ca 0.18 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 2i0j h GLU 444 Cb 0.45 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2i0j h GLU 444 CO 0.02 1.01 -0.48 0.35 -1.00 0.00 0.00 179.01 178.91 2i0j h PHE 445 N 0.63 -1.28 -0.99 4.33 3.57 -0.69 -1.88 116.94 120.63 2i0j h PHE 445 Ca 0.06 -0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.76 2i0j h PHE 445 Cb 0.93 0.47 -0.10 0.00 2.79 0.00 0.00 35.95 40.04 2i0j h PHE 445 CO 0.05 -0.69 0.62 -0.39 -2.23 0.00 0.00 178.31 175.67 2i0j h VAL 446 N -1.12 0.65 0.38 1.41 -1.51 -1.37 0.02 116.25 114.71 2i0j h VAL 446 Ca -0.09 -0.20 -0.02 0.00 -1.23 0.00 0.00 66.70 65.15 2i0j h VAL 446 Cb 0.91 0.01 0.00 0.00 -2.13 0.00 0.00 31.29 30.08 2i0j h VAL 446 CO 0.07 0.11 -0.18 0.00 -1.23 0.00 0.00 177.57 176.33 2i0j h LEU 448 N -0.59 0.37 -0.50 0.00 3.38 -0.25 0.84 115.31 118.56 2i0j h LEU 448 Ca -0.05 0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2i0j h LEU 448 Cb 0.44 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 2i0j h LEU 448 CO 0.09 0.23 0.18 0.50 0.09 0.00 0.00 178.44 179.52 2i0j h LYS 449 N 0.52 0.35 0.00 1.13 3.64 -0.94 -0.86 116.57 120.41 2i0j h LYS 449 Ca 0.30 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.57 2i0j h LYS 449 Cb 0.31 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2i0j h LYS 449 CO -0.25 0.23 -0.44 0.77 -2.27 0.00 0.00 179.45 177.49 2i0j h SER 450 N 0.36 0.00 0.31 4.20 0.02 -0.46 -2.55 113.55 115.43 2i0j h SER 450 Ca 0.24 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.06 2i0j h SER 450 Cb 0.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2i0j h SER 450 CO -0.24 0.44 -0.51 0.40 -1.14 0.00 0.00 176.83 175.77 2i0j h ILE 451 N 0.00 1.35 0.17 3.27 2.04 0.16 -2.92 117.51 121.58 2i0j h ILE 451 Ca -0.00 -1.77 -0.01 0.00 1.00 0.00 0.00 64.86 64.08 2i0j h ILE 451 Cb 0.81 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2i0j h ILE 451 CO 0.06 0.53 -0.08 0.40 0.00 0.00 0.00 178.15 179.05 2i0j h ILE 452 N 0.18 0.90 -0.28 -0.67 2.04 -0.79 0.60 117.51 119.49 2i0j h ILE 452 Ca 0.01 -0.30 0.05 0.00 1.00 0.00 0.00 64.86 65.62 2i0j h ILE 452 Cb 0.97 1.08 -0.08 0.00 -0.74 0.00 0.00 36.82 38.06 2i0j h ILE 452 CO 0.08 0.07 -0.47 0.25 0.00 0.00 0.00 178.15 178.08 2i0j h LEU 453 N -0.37 -1.53 -0.77 1.44 5.85 -1.46 0.11 115.31 118.57 2i0j h LEU 453 Ca -0.02 0.21 -0.12 0.00 0.84 0.00 0.00 57.88 58.78 2i0j h LEU 453 Cb 0.29 0.64 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 2i0j h LEU 453 CO 0.04 -0.42 -0.58 -0.07 -0.34 0.00 0.00 178.44 177.08 2i0j h LEU 454 N -0.44 0.00 0.00 2.25 3.38 -1.48 -3.31 115.31 115.72 2i0j h LEU 454 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2i0j h LEU 454 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2i0j h LEU 454 CO -0.50 0.58 -1.17 -3.20 0.09 0.00 0.00 178.44 174.23 2i0j n ASN 455 N -3.74 0.59 0.20 -0.43 2.85 0.20 -4.09 115.26 110.84 2i0j n ASN 455 Ca -0.01 0.05 -0.08 0.00 -0.11 0.00 0.00 54.58 54.43 2i0j n ASN 455 Cb 0.60 0.85 -0.04 0.00 1.24 0.00 0.00 39.78 42.43 2i0j n ASN 455 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2i0j h SER 456 N 0.00 -0.43 -0.20 1.20 0.02 -0.87 -3.28 113.55 109.99 2i0j h SER 456 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2i0j h SER 456 Cb 0.88 0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2i0j h SER 456 CO 0.00 -0.30 0.00 0.61 -1.14 0.00 0.00 176.83 176.00 2i0j n GLY 457 N -1.13 0.44 0.33 -3.77 0.00 -1.26 -4.39 105.19 95.41 2i0j n GLY 457 Ca -0.06 -0.44 0.16 0.00 0.00 0.00 0.00 46.02 45.68 2i0j n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2i0j h VAL 458 N 2.40 0.61 -0.70 1.61 3.04 -1.71 -1.65 116.25 119.86 2i0j h VAL 458 Ca 0.00 0.00 -0.29 0.00 -1.01 0.00 0.00 66.70 65.40 2i0j h VAL 458 Cb 0.53 0.85 -0.17 0.00 -2.01 0.00 0.00 31.29 30.49 2i0j h VAL 458 CO 0.00 0.00 0.30 -1.22 -1.01 0.00 0.00 177.57 175.64 2i0j n TYR 459 N -4.04 2.23 -2.11 3.17 4.02 -1.26 -4.03 117.16 115.15 2i0j n TYR 459 Ca 0.02 -1.47 0.02 0.00 -0.01 0.00 0.00 57.90 56.47 2i0j n TYR 459 Cb 0.34 -0.70 0.02 0.00 -0.02 0.00 0.00 39.34 38.98 2i0j n TYR 459 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2i0j n THR 460 N -0.71 0.20 0.00 -0.72 -2.24 -0.62 -5.22 114.28 104.96 2i0j n THR 460 Ca 0.44 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2i0j n THR 460 Cb 1.37 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 70.20 2i0j n THR 460 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2i0j n PHE 461 N 0.05 0.00 -1.84 4.78 3.72 -1.23 -5.09 117.46 117.85 2i0j n PHE 461 Ca 0.04 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.48 2i0j n PHE 461 Cb 0.86 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.48 2i0j n PHE 461 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2i0j n SER 464 N 0.00 1.16 -3.98 4.37 2.88 -1.26 -5.08 113.62 111.71 2i0j n SER 464 Ca 0.00 -2.64 -0.30 0.00 -1.33 0.00 0.00 58.87 54.60 2i0j n SER 464 Cb 0.00 -0.35 0.23 0.00 -0.75 0.00 0.00 64.21 63.34 2i0j n SER 464 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2i0j s THR 465 N -1.32 1.68 0.11 2.46 -4.23 -1.26 -4.91 115.64 108.16 2i0j s THR 465 Ca 0.24 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.65 2i0j s THR 465 Cb 0.24 -2.48 -0.16 0.00 1.34 0.00 0.00 72.50 71.44 2i0j s THR 465 CO -0.05 0.00 1.31 -0.07 -0.54 0.00 0.00 174.62 175.27 2i0j h LEU 466 N -2.47 0.84 -1.10 4.79 3.38 -2.05 -2.87 115.31 115.83 2i0j h LEU 466 Ca -0.47 -0.57 0.13 0.00 0.09 0.00 0.00 57.88 57.06 2i0j h LEU 466 Cb 1.30 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 41.72 2i0j h LEU 466 CO 0.39 1.36 0.61 0.50 0.09 0.00 0.00 178.44 181.39 2i0j h LYS 467 N 0.46 0.86 0.00 1.13 1.63 -2.01 -1.39 116.57 117.26 2i0j h LYS 467 Ca -0.06 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2i0j h LYS 467 Cb 1.44 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 2i0j h LYS 467 CO 0.16 0.57 0.00 0.45 -3.45 0.00 0.00 179.45 177.18 2i0j n SER 468 N -4.61 0.00 -0.06 4.20 2.88 -1.09 -2.24 113.62 112.71 2i0j n SER 468 Ca 0.19 0.82 -0.02 0.00 -1.33 0.00 0.00 58.87 58.53 2i0j n SER 468 Cb 0.40 -0.32 -0.01 0.00 -0.75 0.00 0.00 64.21 63.52 2i0j n SER 468 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2i0j n LEU 469 N -1.95 -0.15 -0.31 2.46 4.77 -0.56 -0.47 117.00 120.79 2i0j n LEU 469 Ca 0.00 0.74 0.08 0.00 -0.03 0.00 0.00 56.01 56.79 2i0j n LEU 469 Cb 0.00 -0.28 0.18 0.00 -2.33 0.00 0.00 43.42 40.99 2i0j n LEU 469 CO 0.00 -0.45 0.76 -0.33 -1.33 0.00 0.00 177.39 176.05 2i0j h GLU 470 N 0.00 0.03 0.72 3.23 3.07 -1.37 -1.47 114.58 118.80 2i0j h GLU 470 Ca 0.02 -0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.85 2i0j h GLU 470 Cb 0.06 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 27.96 2i0j h GLU 470 CO -0.13 0.02 -0.36 0.93 -1.40 0.00 0.00 179.01 178.07 2i0j h GLU 471 N 0.04 -0.95 -0.90 2.33 4.39 -0.31 -2.78 114.58 116.40 2i0j h GLU 471 Ca 0.47 0.06 0.18 0.00 0.34 0.00 0.00 59.36 60.42 2i0j h GLU 471 Cb 0.85 0.22 -0.07 0.00 -0.10 0.00 0.00 28.75 29.64 2i0j h GLU 471 CO -0.84 -0.63 0.59 0.87 -1.16 0.00 0.00 179.01 177.83 2i0j h LYS 472 N -0.98 0.50 -0.46 2.33 1.57 -0.55 -0.30 116.57 118.67 2i0j h LYS 472 Ca -0.10 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 2i0j h LYS 472 Cb 0.76 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 2i0j h LYS 472 CO 0.15 0.33 0.07 0.22 -0.57 0.00 0.00 179.45 179.65 2i0j h ASP 473 N 0.51 0.74 -0.54 0.86 3.58 -1.11 -0.96 116.42 119.50 2i0j h ASP 473 Ca 0.47 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.65 2i0j h ASP 473 Cb 1.01 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.84 2i0j h ASP 473 CO -0.20 0.82 0.34 -0.74 -2.88 0.00 0.00 179.24 176.58 2i0j h HIS 474 N 0.63 0.70 -0.26 0.28 2.76 -0.82 -1.57 115.15 116.87 2i0j h HIS 474 Ca 0.14 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.31 2i0j h HIS 474 Cb 0.40 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 2i0j h HIS 474 CO 0.03 0.47 0.13 0.82 -1.30 0.00 0.00 177.93 178.08 2i0j h ILE 475 N 0.73 1.13 0.00 6.26 2.04 -1.16 -0.85 117.51 125.66 2i0j h ILE 475 Ca 0.20 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2i0j h ILE 475 Cb -0.04 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 2i0j h ILE 475 CO -0.04 0.13 -0.05 0.45 0.00 0.00 0.00 178.15 178.65 2i0j h HIS 476 N 0.29 0.00 0.12 1.37 3.86 -0.89 0.11 115.15 120.01 2i0j h HIS 476 Ca 0.09 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 59.01 2i0j h HIS 476 Cb 0.09 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 2i0j h HIS 476 CO -0.03 0.05 -1.36 0.00 0.86 0.00 0.00 177.93 177.45 2i0j h ARG 477 N 0.00 0.26 -0.14 2.45 3.08 -0.61 -1.45 114.38 117.98 2i0j h ARG 477 Ca -0.00 -0.44 -0.06 0.00 0.07 0.00 0.00 59.98 59.54 2i0j h ARG 477 Cb 0.32 0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 2i0j h ARG 477 CO 0.01 1.17 -0.16 0.28 -1.07 0.00 0.00 179.97 180.19 2i0j h VAL 478 N 0.07 1.36 -0.30 2.04 2.07 -0.59 -1.16 116.25 119.75 2i0j h VAL 478 Ca -0.18 -1.35 0.06 0.00 0.82 0.00 0.00 66.70 66.05 2i0j h VAL 478 Cb 1.99 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 33.64 2i0j h VAL 478 CO 0.19 0.39 -0.05 -0.07 0.02 0.00 0.00 177.57 178.05 2i0j h LEU 479 N -0.04 -0.22 -2.03 2.57 3.38 -0.85 0.22 115.31 118.34 2i0j h LEU 479 Ca 0.02 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2i0j h LEU 479 Cb 0.70 0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 2i0j h LEU 479 CO 0.04 -0.07 -0.05 0.44 0.09 0.00 0.00 178.44 178.88 2i0j h ASP 480 N 0.03 0.00 0.15 -0.43 3.32 -1.20 0.89 116.42 119.18 2i0j h ASP 480 Ca 0.14 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.00 2i0j h ASP 480 Cb 0.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 2i0j h ASP 480 CO -0.28 0.05 -0.74 0.50 -1.72 0.00 0.00 179.24 177.05 2i0j h LYS 481 N 0.00 0.51 -0.12 3.56 1.63 0.59 -2.63 116.57 120.11 2i0j h LYS 481 Ca -0.00 -0.41 -0.20 0.00 -0.85 0.00 0.00 60.65 59.18 2i0j h LYS 481 Cb 0.10 0.09 0.01 0.00 -0.60 0.00 0.00 32.23 31.83 2i0j h LYS 481 CO 0.01 1.04 -0.71 0.82 -3.45 0.00 0.00 179.45 177.16 2i0j h ILE 482 N 0.35 1.31 -0.94 2.00 2.04 0.52 -1.85 117.51 120.93 2i0j h ILE 482 Ca -0.04 -1.95 0.15 0.00 1.00 0.00 0.00 64.86 64.02 2i0j h ILE 482 Cb 1.33 2.10 -0.09 0.00 -0.74 0.00 0.00 36.82 39.41 2i0j h ILE 482 CO 0.13 0.61 0.55 0.74 0.00 0.00 0.00 178.15 180.18 2i0j h THR 483 N 0.38 0.78 0.69 -0.27 2.02 -0.86 0.42 112.91 116.07 2i0j h THR 483 Ca -0.05 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 66.83 2i0j h THR 483 Cb 1.35 -0.06 0.01 0.00 -1.74 0.00 0.00 68.15 67.70 2i0j h THR 483 CO 0.15 0.14 -0.33 0.44 0.37 0.00 0.00 175.52 176.29 2i0j h ASP 484 N 0.78 -0.78 -0.87 4.18 3.32 -1.30 -2.32 116.42 119.42 2i0j h ASP 484 Ca 0.51 -0.00 0.22 0.00 0.02 0.00 0.00 57.03 57.78 2i0j h ASP 484 Cb 0.68 0.20 -0.15 0.00 0.22 0.00 0.00 39.33 40.28 2i0j h ASP 484 CO -0.34 -0.48 0.07 0.74 -1.72 0.00 0.00 179.24 177.51 2i0j h THR 485 N -1.06 0.21 0.32 0.35 2.02 -0.39 0.17 112.91 114.53 2i0j h THR 485 Ca -0.09 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 2i0j h THR 485 Cb 0.74 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 2i0j h THR 485 CO 0.16 0.02 -0.22 -0.07 0.37 0.00 0.00 175.52 175.77 2i0j h LEU 486 N 0.09 -0.57 -0.44 2.58 3.38 -0.80 -0.09 115.31 119.47 2i0j h LEU 486 Ca 0.52 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.61 2i0j h LEU 486 Cb 1.01 0.18 -0.08 0.00 0.09 0.00 0.00 40.66 41.86 2i0j h LEU 486 CO -0.76 -0.35 -0.07 0.40 0.09 0.00 0.00 178.44 177.75 2i0j h ILE 487 N -0.54 0.60 -0.77 1.22 1.08 -0.43 0.37 117.51 119.03 2i0j h ILE 487 Ca -0.03 -0.01 0.13 0.00 -0.39 0.00 0.00 64.86 64.56 2i0j h ILE 487 Cb 0.46 0.56 -0.09 0.00 -3.07 0.00 0.00 36.82 34.68 2i0j h ILE 487 CO 0.01 0.01 0.36 -0.74 -0.69 0.00 0.00 178.15 177.10 2i0j h HIS 488 N 0.03 0.63 -0.25 1.37 2.76 -0.27 0.24 115.15 119.67 2i0j h HIS 488 Ca 0.21 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.41 2i0j h HIS 488 Cb 0.32 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.10 2i0j h HIS 488 CO -0.35 0.15 0.12 -0.07 -1.30 0.00 0.00 177.93 176.49 2i0j h LEU 489 N 0.55 0.30 0.07 0.26 3.38 0.95 -1.02 115.31 119.79 2i0j h LEU 489 Ca 0.41 -0.02 -0.26 0.00 0.09 0.00 0.00 57.88 58.10 2i0j h LEU 489 Cb 0.56 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2i0j h LEU 489 CO -0.35 0.25 -1.28 0.24 0.09 0.00 0.00 178.44 177.39 2i0j h MET 490 N 0.34 0.14 -0.45 1.13 2.86 -0.04 -2.84 114.93 116.06 2i0j h MET 490 Ca 0.09 -0.24 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 2i0j h MET 490 Cb 0.03 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 2i0j h MET 490 CO -0.01 1.03 -0.18 0.00 1.06 0.00 0.00 176.91 178.81 2i0j h ALA 491 N 0.75 0.84 -0.16 6.32 0.00 -0.09 -2.68 119.26 124.25 2i0j h ALA 491 Ca -0.13 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.30 2i0j h ALA 491 Cb 1.92 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 2i0j h ALA 491 CO 0.15 0.64 -0.39 0.87 0.00 0.00 0.00 179.25 180.53 2i0j h LYS 492 N 0.77 0.35 0.00 0.00 1.57 -1.26 -2.89 116.57 115.11 2i0j h LYS 492 Ca 0.11 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2i0j h LYS 492 Cb 0.71 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 2i0j h LYS 492 CO 0.05 0.69 0.00 0.00 -0.57 0.00 0.00 179.45 179.62 2i0j n ALA 493 N -2.48 2.09 0.00 3.86 0.00 -1.06 -4.89 120.51 118.03 2i0j n ALA 493 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2i0j n ALA 493 Cb 0.48 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.59 2i0j n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i0j n GLY 494 N 0.48 0.58 3.78 0.00 0.00 -1.09 -5.08 105.19 103.85 2i0j n GLY 494 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 2i0j n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i0j s LEU 495 N 0.00 4.00 1.06 0.99 1.43 -1.03 -5.03 118.68 120.09 2i0j s LEU 495 Ca 0.00 2.19 -0.16 0.00 -1.03 0.00 0.00 54.13 55.13 2i0j s LEU 495 Cb 0.00 -4.30 0.22 0.00 0.03 0.00 0.00 46.19 42.14 2i0j s LEU 495 CO 0.00 -0.83 1.16 0.42 0.23 0.00 0.00 176.35 177.33 2i0j s THR 496 N -1.64 1.83 0.09 5.49 -4.23 -1.26 -4.68 115.64 111.24 2i0j s THR 496 Ca 0.64 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.93 2i0j s THR 496 Cb -0.25 -2.67 -0.12 0.00 1.34 0.00 0.00 72.50 70.81 2i0j s THR 496 CO 0.31 0.00 1.66 -0.07 -0.54 0.00 0.00 174.62 175.98 2i0j h LEU 497 N -2.03 0.15 -1.37 4.79 3.38 -1.99 0.13 115.31 118.36 2i0j h LEU 497 Ca -0.47 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.38 2i0j h LEU 497 Cb 1.29 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 2i0j h LEU 497 CO 0.44 0.22 0.27 -0.61 0.09 0.00 0.00 178.44 178.85 2i0j h GLN 498 N 0.07 0.69 -0.21 1.13 4.15 -2.00 -1.31 115.11 117.63 2i0j h GLN 498 Ca 0.04 -0.07 -0.14 0.00 0.77 0.00 0.00 58.65 59.25 2i0j h GLN 498 Cb 0.11 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 2i0j h GLN 498 CO -0.01 0.52 -0.45 1.96 -1.93 0.00 0.00 178.83 178.92 2i0j h GLN 499 N 0.70 0.53 -0.40 1.69 4.20 -1.81 -2.46 115.11 117.57 2i0j h GLN 499 Ca 0.18 -0.29 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 2i0j h GLN 499 Cb 0.03 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 2i0j h GLN 499 CO -0.03 0.88 0.18 1.96 -0.67 0.00 0.00 178.83 181.15 2i0j h GLN 500 N 0.43 0.58 0.00 1.46 4.20 0.37 -2.17 115.11 119.98 2i0j h GLN 500 Ca 0.03 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2i0j h GLN 500 Cb 0.95 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.63 2i0j h GLN 500 CO 0.08 0.52 -0.26 1.12 -0.67 0.00 0.00 178.83 179.63 2i0j h HIS 501 N 0.50 0.00 0.02 2.96 2.07 -1.38 -2.67 115.15 116.67 2i0j h HIS 501 Ca 0.14 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.49 2i0j h HIS 501 Cb 0.14 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.13 2i0j h HIS 501 CO -0.01 0.00 -0.65 1.96 -3.07 0.00 0.00 177.93 176.16 2i0j h GLN 502 N 0.00 0.40 0.00 5.12 4.20 -1.31 -2.04 115.11 121.48 2i0j h GLN 502 Ca 0.00 -0.46 -0.08 0.00 0.06 0.00 0.00 58.65 58.17 2i0j h GLN 502 Cb 0.76 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.66 2i0j h GLN 502 CO 0.00 1.13 -0.36 -0.09 -0.67 0.00 0.00 178.83 178.84 2i0j h ARG 503 N -0.14 0.00 -0.17 1.46 2.43 -1.46 -0.85 114.38 115.65 2i0j h ARG 503 Ca -0.09 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.03 2i0j h ARG 503 Cb 1.38 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.93 2i0j h ARG 503 CO 0.13 0.36 -0.10 1.25 -1.51 0.00 0.00 179.97 180.09 2i0j h LEU 504 N 0.00 0.39 -0.95 3.80 5.85 -1.44 -0.92 115.31 122.05 2i0j h LEU 504 Ca -0.00 -0.43 -0.05 0.00 0.84 0.00 0.00 57.88 58.24 2i0j h LEU 504 Cb 0.64 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 2i0j h LEU 504 CO 0.05 0.74 0.21 0.00 -0.34 0.00 0.00 178.44 179.09 2i0j h ALA 505 N 0.67 1.16 -0.10 1.25 0.00 -1.08 -0.78 119.26 120.37 2i0j h ALA 505 Ca 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2i0j h ALA 505 Cb 0.60 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2i0j h ALA 505 CO 0.03 0.59 0.04 1.96 0.00 0.00 0.00 179.25 181.87 2i0j h GLN 506 N 0.94 0.15 -0.19 0.00 4.20 -1.04 -0.86 115.11 118.30 2i0j h GLN 506 Ca 0.21 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 2i0j h GLN 506 Cb 0.26 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 2i0j h GLN 506 CO -0.01 0.26 0.07 -0.07 -0.67 0.00 0.00 178.83 178.41 2i0j h LEU 507 N 0.00 0.28 -1.72 1.46 3.38 -0.98 -2.71 115.31 115.02 2i0j h LEU 507 Ca 0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 2i0j h LEU 507 Cb 0.17 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2i0j h LEU 507 CO -0.00 0.39 -0.07 -0.07 0.09 0.00 0.00 178.44 178.78 2i0j h LEU 508 N 0.15 0.00 -0.02 1.67 3.38 -1.12 -1.68 115.31 117.70 2i0j h LEU 508 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2i0j h LEU 508 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2i0j h LEU 508 CO -0.00 0.07 0.00 -0.07 0.09 0.00 0.00 178.44 178.52 2i0j h LEU 509 N 0.00 0.00 -0.62 1.67 3.38 -0.93 -3.13 115.31 115.67 2i0j h LEU 509 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 2i0j h LEU 509 Cb 0.44 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2i0j h LEU 509 CO 0.01 0.00 -0.57 0.40 0.09 0.00 0.00 178.44 178.37 2i0j h ILE 510 N 0.00 1.20 0.00 1.22 2.04 -0.99 -2.55 117.51 118.43 2i0j h ILE 510 Ca 0.00 -2.10 -0.05 0.00 1.00 0.00 0.00 64.86 63.71 2i0j h ILE 510 Cb 0.96 2.20 -0.01 0.00 -0.74 0.00 0.00 36.82 39.23 2i0j h ILE 510 CO 0.00 0.56 -0.24 -0.07 0.00 0.00 0.00 178.15 178.40 2i0j h LEU 511 N 0.00 0.00 -1.27 1.44 3.38 -1.49 -0.53 115.31 116.84 2i0j h LEU 511 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2i0j h LEU 511 Cb 1.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2i0j h LEU 511 CO 0.07 0.24 -0.02 -1.28 0.09 0.00 0.00 178.44 177.54 2i0j h SER 512 N 0.00 0.44 -0.09 -0.43 0.87 -1.55 -0.48 113.55 112.31 2i0j h SER 512 Ca -0.00 -0.08 -0.16 0.00 -1.23 0.00 0.00 61.79 60.32 2i0j h SER 512 Cb 0.45 -0.11 0.01 0.00 -0.44 0.00 0.00 62.40 62.30 2i0j h SER 512 CO 0.03 0.52 -0.55 0.45 -0.53 0.00 0.00 176.83 176.75 2i0j h HIS 513 N 0.45 0.74 0.00 2.24 3.86 -1.17 -2.38 115.15 118.88 2i0j h HIS 513 Ca 0.10 -0.33 -0.00 0.00 -1.16 0.00 0.00 60.37 58.97 2i0j h HIS 513 Cb 0.33 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.69 2i0j h HIS 513 CO 0.01 1.12 -0.01 0.82 0.86 0.00 0.00 177.93 180.73 2i0j h ILE 514 N 0.14 0.22 0.01 2.45 2.04 -0.74 0.36 117.51 122.00 2i0j h ILE 514 Ca -0.04 -0.09 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 2i0j h ILE 514 Cb 1.20 1.07 0.01 0.00 -0.74 0.00 0.00 36.82 38.36 2i0j h ILE 514 CO 0.11 0.01 -0.28 -0.09 0.00 0.00 0.00 178.15 177.91 2i0j h ARG 515 N 0.00 0.17 -0.85 2.37 9.65 -0.87 -2.46 114.38 122.39 2i0j h ARG 515 Ca -0.00 -0.19 0.07 0.00 -1.10 0.00 0.00 59.98 58.76 2i0j h ARG 515 Cb 0.07 0.06 -0.07 0.00 -1.39 0.00 0.00 29.97 28.64 2i0j h ARG 515 CO 0.00 0.96 0.51 1.25 2.80 0.00 0.00 179.97 185.49 2i0j h HIS 516 N -0.54 0.95 -0.67 2.20 2.76 -0.61 -1.46 115.15 117.78 2i0j h HIS 516 Ca -0.04 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.09 2i0j h HIS 516 Cb 1.06 -0.30 -0.03 0.00 1.55 0.00 0.00 27.41 29.70 2i0j h HIS 516 CO 0.19 0.45 0.14 0.52 -1.30 0.00 0.00 177.93 177.93 2i0j h MET 517 N 0.91 1.09 -0.81 5.26 2.86 -1.01 -1.81 114.93 121.42 2i0j h MET 517 Ca 0.39 -0.27 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 2i0j h MET 517 Cb 0.24 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 2i0j h MET 517 CO -0.20 0.98 0.41 1.03 1.06 0.00 0.00 176.91 180.19 2i0j h SER 518 N 1.01 1.03 -0.19 1.22 0.87 -0.85 0.26 113.55 116.91 2i0j h SER 518 Ca 0.21 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 2i0j h SER 518 Cb 0.40 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 2i0j h SER 518 CO 0.01 0.85 0.06 0.78 -0.53 0.00 0.00 176.83 178.00 2i0j h ASN 519 N 1.14 0.27 -0.62 6.23 2.35 -0.89 -1.10 115.58 122.96 2i0j h ASN 519 Ca 0.28 -0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.75 2i0j h ASN 519 Cb 0.08 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 2i0j h ASN 519 CO -0.04 0.39 0.07 0.11 -1.65 0.00 0.00 177.43 176.32 2i0j h LYS 520 N 0.13 1.06 0.00 0.81 1.79 -1.02 -2.33 116.57 117.01 2i0j h LYS 520 Ca 0.06 -0.29 -0.01 0.00 -2.18 0.00 0.00 60.65 58.22 2i0j h LYS 520 Cb 0.22 -0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 30.75 2i0j h LYS 520 CO -0.00 0.99 -0.06 0.78 -1.08 0.00 0.00 179.45 180.08 2i0j h GLY 521 N 1.03 0.00 1.41 3.86 0.00 -0.17 -2.58 103.07 106.62 2i0j h GLY 521 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.26 2i0j h GLY 521 CO 0.02 0.00 -1.41 -0.33 0.00 0.00 0.00 176.54 174.81 2i0j h MET 522 N 0.00 0.05 -0.60 4.80 2.86 -0.69 -2.08 114.93 119.27 2i0j h MET 522 Ca -0.00 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 2i0j h MET 522 Cb 0.11 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 2i0j h MET 522 CO 0.01 0.82 0.29 0.93 1.06 0.00 0.00 176.91 180.01 2i0j h GLU 523 N 0.01 0.86 0.19 1.72 5.08 -1.23 0.10 114.58 121.31 2i0j h GLU 523 Ca -0.18 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2i0j h GLU 523 Cb 1.92 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 31.02 2i0j h GLU 523 CO 0.11 0.69 -0.09 1.25 -1.00 0.00 0.00 179.01 179.98 2i0j h HIS 524 N 0.81 -0.23 -0.93 4.33 2.76 -1.54 -0.88 115.15 119.47 2i0j h HIS 524 Ca 0.20 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.47 2i0j h HIS 524 Cb 0.12 0.08 -0.07 0.00 1.55 0.00 0.00 27.41 29.09 2i0j h HIS 524 CO -0.00 -0.07 0.60 1.25 -1.30 0.00 0.00 177.93 178.41 2i0j h LEU 525 N -0.35 0.85 -0.05 0.26 5.85 -1.01 0.40 115.31 121.27 2i0j h LEU 525 Ca -0.03 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2i0j h LEU 525 Cb 0.27 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2i0j h LEU 525 CO 0.04 0.50 0.00 0.00 -0.34 0.00 0.00 178.44 178.64 2i0j n TYR 526 N -4.54 0.11 -0.05 1.25 9.36 0.32 -2.86 117.16 120.74 2i0j n TYR 526 Ca 0.16 0.04 -0.13 0.00 3.32 0.00 0.00 57.90 61.29 2i0j n TYR 526 Cb 0.30 -0.56 -0.14 0.00 -0.63 0.00 0.00 39.34 38.31 2i0j n TYR 526 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2i0j n SER 527 N -1.60 1.10 0.00 2.98 2.88 0.12 -5.06 113.62 114.04 2i0j n SER 527 Ca 0.05 0.18 0.09 0.00 -1.33 0.00 0.00 58.87 57.86 2i0j n SER 527 Cb 0.25 -0.03 0.51 0.00 -0.75 0.00 0.00 64.21 64.19 2i0j n SER 527 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04