#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bll s ARG 317 N 0.00 3.67 -0.22 2.12 0.52 -1.26 -0.89 118.95 122.89 2bll s ARG 317 Ca 0.00 -0.52 -0.05 0.00 -0.52 0.00 0.00 55.73 54.64 2bll s ARG 317 Cb 0.00 -3.73 -0.02 0.00 0.52 0.00 0.00 34.95 31.72 2bll s ARG 317 CO 0.00 -0.33 0.01 0.08 0.02 0.00 0.00 175.30 175.08 2bll s VAL 318 N 1.73 3.95 -0.37 3.52 1.01 0.10 -1.43 120.40 128.92 2bll s VAL 318 Ca 0.06 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 2bll s VAL 318 Cb -0.17 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.41 2bll s VAL 318 CO 0.10 0.40 0.24 -0.22 0.00 0.00 0.00 175.10 175.63 2bll s LEU 319 N 1.28 4.70 -0.32 3.92 2.96 0.47 0.03 118.68 131.72 2bll s LEU 319 Ca 0.04 -0.69 -0.09 0.00 -0.22 0.00 0.00 54.13 53.17 2bll s LEU 319 Cb -0.15 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.44 2bll s LEU 319 CO 0.01 -0.33 0.14 -0.63 -1.32 0.00 0.00 176.35 174.23 2bll s ILE 320 N 1.67 4.41 -0.34 6.68 1.01 0.82 -1.20 121.20 134.25 2bll s ILE 320 Ca 0.05 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 59.96 2bll s ILE 320 Cb -0.18 -3.29 -0.01 0.00 0.01 0.00 0.00 42.46 38.99 2bll s ILE 320 CO 0.09 0.02 0.43 -0.76 0.00 0.00 0.00 174.94 174.72 2bll s LEU 321 N 1.57 4.35 0.00 2.97 1.43 -0.29 -0.34 118.68 128.37 2bll s LEU 321 Ca 0.04 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2bll s LEU 321 Cb -0.17 -2.45 0.00 0.00 0.03 0.00 0.00 46.19 43.59 2bll s LEU 321 CO 0.05 -0.38 0.00 0.61 0.23 0.00 0.00 176.35 176.86 2bll n GLY 322 N 4.85 0.84 0.19 -3.19 0.00 0.86 -0.41 105.19 108.34 2bll n GLY 322 Ca -0.07 -0.26 0.14 0.00 0.00 0.00 0.00 46.02 45.83 2bll n GLY 322 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2bll h VAL 323 N 0.00 0.00 -1.04 1.61 3.04 -1.55 -3.39 116.25 114.92 2bll h VAL 323 Ca 0.00 -0.37 -0.74 0.00 -1.01 0.00 0.00 66.70 64.58 2bll h VAL 323 Cb 0.42 1.23 -0.12 0.00 -2.01 0.00 0.00 31.29 30.82 2bll h VAL 323 CO 0.00 0.00 2.40 -3.20 -1.01 0.00 0.00 177.57 175.76 2bll n ASN 324 N -2.61 5.88 -0.12 3.17 5.15 -1.26 -3.76 115.26 121.71 2bll n ASN 324 Ca 0.02 -3.04 0.00 0.00 -0.60 0.00 0.00 54.58 50.95 2bll n ASN 324 Cb 0.28 -1.48 0.00 0.00 -0.53 0.00 0.00 39.78 38.05 2bll n ASN 324 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bll n GLY 325 N 2.77 1.76 0.43 8.20 0.00 -1.26 -4.78 105.19 112.30 2bll n GLY 325 Ca 0.49 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 2bll n GLY 325 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2bll h PHE 326 N 0.12 -0.98 -0.28 1.61 3.57 -1.87 0.01 116.94 119.12 2bll h PHE 326 Ca 0.00 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 2bll h PHE 326 Cb 0.00 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2bll h PHE 326 CO 0.00 -0.59 -0.09 0.82 -2.23 0.00 0.00 178.31 176.22 2bll h ILE 327 N -1.17 1.29 -0.34 1.41 2.04 -1.89 -2.03 117.51 116.82 2bll h ILE 327 Ca -0.11 -1.14 0.07 0.00 1.00 0.00 0.00 64.86 64.68 2bll h ILE 327 Cb 0.82 1.44 -0.07 0.00 -0.74 0.00 0.00 36.82 38.27 2bll h ILE 327 CO 0.18 0.36 -0.14 1.23 0.00 0.00 0.00 178.15 179.78 2bll h GLY 328 N 0.32 0.15 0.52 5.37 0.00 -1.70 0.46 103.07 108.18 2bll h GLY 328 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.58 2bll h GLY 328 CO 0.03 -0.17 -0.38 3.43 0.00 0.00 0.00 176.54 179.46 2bll h ASN 329 N -0.08 -1.06 -0.13 0.19 2.35 -0.90 -0.20 115.58 115.77 2bll h ASN 329 Ca 0.17 0.10 -0.15 0.00 -0.55 0.00 0.00 56.30 55.87 2bll h ASN 329 Cb 0.34 0.37 -0.01 0.00 0.05 0.00 0.00 38.32 39.08 2bll h ASN 329 CO -0.40 -0.50 -0.45 0.45 -1.65 0.00 0.00 177.43 174.87 2bll h HIS 330 N -0.72 0.83 -0.41 1.19 3.86 -1.18 -1.37 115.15 117.34 2bll h HIS 330 Ca -0.01 -0.26 -0.08 0.00 -1.16 0.00 0.00 60.37 58.85 2bll h HIS 330 Cb 0.68 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 2bll h HIS 330 CO -0.25 1.01 -0.07 1.25 0.86 0.00 0.00 177.93 180.72 2bll h LEU 331 N 0.54 0.78 -0.42 2.43 5.85 -0.11 -2.39 115.31 122.00 2bll h LEU 331 Ca 0.03 -0.35 -0.04 0.00 0.84 0.00 0.00 57.88 58.36 2bll h LEU 331 Cb 1.00 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 2bll h LEU 331 CO 0.09 0.95 0.09 0.74 -0.34 0.00 0.00 178.44 179.97 2bll h THR 332 N 0.60 1.23 -0.53 1.05 2.02 -0.86 -0.26 112.91 116.16 2bll h THR 332 Ca 0.11 -0.82 0.09 0.00 0.77 0.00 0.00 66.41 66.56 2bll h THR 332 Cb 0.59 0.97 -0.07 0.00 -1.74 0.00 0.00 68.15 67.90 2bll h THR 332 CO 0.04 0.29 0.11 -0.08 0.37 0.00 0.00 175.52 176.24 2bll h GLU 333 N 0.54 0.24 0.02 6.66 4.22 -1.21 -0.75 114.58 124.29 2bll h GLU 333 Ca 0.13 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.55 2bll h GLU 333 Cb 0.33 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2bll h GLU 333 CO 0.00 0.16 -0.01 -0.09 -2.18 0.00 0.00 179.01 176.89 2bll h ARG 334 N 0.25 -0.02 -0.40 1.92 9.65 -0.83 -2.83 114.38 122.11 2bll h ARG 334 Ca 0.27 0.00 -0.06 0.00 -1.10 0.00 0.00 59.98 59.09 2bll h ARG 334 Cb 0.37 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.94 2bll h ARG 334 CO -0.35 0.21 -0.01 -0.07 2.80 0.00 0.00 179.97 182.56 2bll h LEU 335 N -0.25 0.62 -0.99 3.80 3.38 -0.82 -2.20 115.31 118.84 2bll h LEU 335 Ca -0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2bll h LEU 335 Cb 0.24 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2bll h LEU 335 CO 0.00 0.69 0.00 -0.07 0.09 0.00 0.00 178.44 179.16 2bll h LEU 336 N 0.61 0.00 -1.20 1.67 3.38 -1.05 -2.31 115.31 116.41 2bll h LEU 336 Ca 0.13 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 2bll h LEU 336 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2bll h LEU 336 CO 0.02 0.00 -0.17 0.03 0.09 0.00 0.00 178.44 178.41 2bll h ARG 337 N 0.00 0.35 -6.32 1.13 3.08 -1.14 -3.43 114.38 108.04 2bll h ARG 337 Ca 0.00 -0.10 -0.56 0.00 0.07 0.00 0.00 59.98 59.39 2bll h ARG 337 Cb 0.46 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 2bll h ARG 337 CO 0.00 0.51 -0.13 -1.21 -1.07 0.00 0.00 179.97 178.07 2bll s GLU 338 N -4.65 3.86 0.00 0.04 0.41 -0.87 -5.00 118.70 112.49 2bll s GLU 338 Ca -0.06 0.33 0.28 0.00 -0.41 0.00 0.00 54.97 55.11 2bll s GLU 338 Cb 0.15 -2.83 1.06 0.00 -1.78 0.00 0.00 34.13 30.73 2bll s GLU 338 CO 0.76 0.43 1.75 -0.25 -0.49 0.00 0.00 175.26 177.45 2bll n ASP 339 N 0.43 0.98 -0.44 -0.19 10.43 -1.26 -3.95 116.55 122.55 2bll n ASP 339 Ca -0.03 -1.04 0.07 0.00 2.57 0.00 0.00 54.79 56.36 2bll n ASP 339 Cb 0.52 0.03 0.18 0.00 1.84 0.00 0.00 41.12 43.70 2bll n ASP 339 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 2bll n HIS 340 N -0.46 0.00 -5.13 1.24 8.25 -1.26 -4.99 115.22 112.87 2bll n HIS 340 Ca 0.16 -1.32 -0.32 0.00 -0.26 0.00 0.00 57.72 55.98 2bll n HIS 340 Cb 0.32 -0.22 -0.15 0.00 1.12 0.00 0.00 29.99 31.06 2bll n HIS 340 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2bll s TYR 341 N -3.08 2.52 -0.19 4.41 1.51 -1.25 -2.30 117.35 118.97 2bll s TYR 341 Ca 0.36 -0.52 -0.01 0.00 -1.01 0.00 0.00 57.07 55.89 2bll s TYR 341 Cb 0.34 -1.61 0.01 0.00 -0.11 0.00 0.00 41.96 40.59 2bll s TYR 341 CO -0.04 -0.08 -0.14 -1.21 -1.11 0.00 0.00 175.55 172.97 2bll s GLU 342 N -0.34 3.16 -0.30 -0.62 0.41 -0.07 -4.88 118.70 116.06 2bll s GLU 342 Ca 0.02 -0.75 -0.11 0.00 -0.41 0.00 0.00 54.97 53.73 2bll s GLU 342 Cb -0.12 -2.72 -0.03 0.00 -1.78 0.00 0.00 34.13 29.47 2bll s GLU 342 CO 0.02 -0.16 0.18 0.08 -0.49 0.00 0.00 175.26 174.89 2bll s VAL 343 N 1.26 5.07 -0.39 2.63 1.01 0.04 0.03 120.40 130.05 2bll s VAL 343 Ca 0.03 -0.07 -0.13 0.00 0.00 0.00 0.00 61.98 61.81 2bll s VAL 343 Cb -0.14 -3.49 0.02 0.00 0.00 0.00 0.00 36.38 32.78 2bll s VAL 343 CO -0.07 0.16 0.26 -0.31 0.00 0.00 0.00 175.10 175.14 2bll s TYR 344 N 1.71 3.24 -0.41 5.22 2.02 0.10 0.20 117.35 129.43 2bll s TYR 344 Ca 0.06 -0.73 -0.10 0.00 -0.37 0.00 0.00 57.07 55.93 2bll s TYR 344 Cb -0.16 -2.52 0.07 0.00 -0.40 0.00 0.00 41.96 38.94 2bll s TYR 344 CO 0.09 -0.61 0.26 0.20 -1.57 0.00 0.00 175.55 173.93 2bll s GLY 345 N 1.63 1.97 -0.11 0.71 0.00 -0.28 -0.13 107.32 111.11 2bll s GLY 345 Ca 0.04 -2.06 -0.17 0.00 0.00 0.00 0.00 44.72 42.53 2bll s GLY 345 CO 0.09 0.95 0.43 -2.27 0.00 0.00 0.00 173.10 172.30 2bll s LEU 346 N 1.47 4.30 0.07 0.66 0.20 0.53 -0.76 118.68 125.14 2bll s LEU 346 Ca 0.03 0.77 -0.27 0.00 0.69 0.00 0.00 54.13 55.35 2bll s LEU 346 Cb -0.22 -2.61 0.09 0.00 -0.43 0.00 0.00 46.19 43.02 2bll s LEU 346 CO 0.03 0.07 1.15 -0.62 -0.29 0.00 0.00 176.35 176.69 2bll s ASP 347 N 0.36 -0.07 0.00 3.68 -1.08 -0.52 -0.10 116.67 118.95 2bll s ASP 347 Ca 0.24 -0.32 0.23 0.00 -0.52 0.00 0.00 52.55 52.18 2bll s ASP 347 Cb -0.15 0.31 0.17 0.00 -1.46 0.00 0.00 42.92 41.80 2bll s ASP 347 CO 0.09 -0.59 1.18 0.00 0.52 0.00 0.00 175.17 176.37 2bll n ILE 348 N -0.58 0.00 -4.02 4.11 3.06 -1.05 -1.42 119.36 119.46 2bll n ILE 348 Ca -0.05 -0.01 -0.10 0.00 -2.50 0.00 0.00 62.75 60.09 2bll n ILE 348 Cb 0.61 0.61 -0.07 0.00 0.54 0.00 0.00 39.64 41.33 2bll n ILE 348 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 2bll s GLY 349 N -2.98 0.67 0.00 4.50 0.00 -1.26 -4.96 107.32 103.30 2bll s GLY 349 Ca 0.10 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.79 2bll s GLY 349 CO 0.77 -0.88 0.55 -1.14 0.00 0.00 0.00 173.10 172.40 2bll n SER 350 N -0.27 0.62 -0.26 1.64 3.41 -1.26 -4.63 113.62 112.86 2bll n SER 350 Ca -0.04 -1.26 0.04 0.00 -0.26 0.00 0.00 58.87 57.34 2bll n SER 350 Cb 0.63 0.00 0.26 0.00 -0.26 0.00 0.00 64.21 64.85 2bll n SER 350 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2bll h ASP 351 N 0.00 0.85 0.75 4.04 2.03 -1.98 -1.17 116.42 120.94 2bll h ASP 351 Ca 0.00 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2bll h ASP 351 Cb 0.70 -0.18 0.00 0.00 -0.83 0.00 0.00 39.33 39.01 2bll h ASP 351 CO 0.00 0.56 0.00 0.00 -1.03 0.00 0.00 179.24 178.77 2bll n ALA 352 N -2.41 1.76 -1.94 4.15 0.00 -1.26 -3.53 120.51 117.29 2bll n ALA 352 Ca 0.12 0.02 0.03 0.00 0.00 0.00 0.00 53.44 53.61 2bll n ALA 352 Cb 0.17 -1.35 0.05 0.00 0.00 0.00 0.00 19.45 18.32 2bll n ALA 352 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2bll n ILE 353 N -1.96 0.55 0.27 0.00 -5.35 -0.54 -4.80 119.36 107.53 2bll n ILE 353 Ca 0.03 -0.99 0.14 0.00 -0.27 0.00 0.00 62.75 61.67 2bll n ILE 353 Cb 0.24 0.44 0.78 0.00 -1.74 0.00 0.00 39.64 39.35 2bll n ILE 353 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2bll h SER 354 N 0.37 0.00 0.46 7.28 4.64 -1.34 -0.96 113.55 124.01 2bll h SER 354 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2bll h SER 354 Cb 1.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 2bll h SER 354 CO 0.03 0.09 0.00 -2.11 -0.87 0.00 0.00 176.83 173.97 2bll n ARG 355 N -3.52 0.23 0.00 4.77 1.85 -1.26 -2.44 116.66 116.29 2bll n ARG 355 Ca -0.02 0.10 0.11 0.00 -1.00 0.00 0.00 57.85 57.04 2bll n ARG 355 Cb 0.23 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.14 2bll n ARG 355 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2bll n PHE 356 N -1.33 0.00 0.29 2.89 3.72 -0.36 -4.57 117.46 118.10 2bll n PHE 356 Ca 0.09 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.64 2bll n PHE 356 Cb 0.18 -0.01 0.90 0.00 -0.94 0.00 0.00 39.48 39.61 2bll n PHE 356 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2bll h LEU 357 N 1.92 0.00 -1.34 4.37 3.38 -1.57 -0.18 115.31 121.90 2bll h LEU 357 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bll h LEU 357 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2bll h LEU 357 CO 0.00 0.03 -0.31 0.59 0.09 0.00 0.00 178.44 178.84 2bll n ASN 358 N -3.70 2.39 -4.73 -0.43 3.02 -1.26 -4.93 115.26 105.61 2bll n ASN 358 Ca -0.03 -1.69 -0.42 0.00 -0.03 0.00 0.00 54.58 52.41 2bll n ASN 358 Cb 0.12 0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 39.57 2bll n ASN 358 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2bll s HIS 359 N -2.31 3.25 0.54 3.10 2.46 -0.08 -4.92 115.29 117.34 2bll s HIS 359 Ca 0.22 1.14 0.20 0.00 0.47 0.00 0.00 55.06 57.09 2bll s HIS 359 Cb 0.19 -3.63 1.45 0.00 -0.13 0.00 0.00 32.58 30.46 2bll s HIS 359 CO 0.47 -2.05 2.18 -1.00 -2.47 0.00 0.00 174.74 171.88 2bll h PRO 360 N 5.79 0.00 -0.51 2.88 0.13 -1.92 -2.78 132.00 135.60 2bll h PRO 360 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2bll h PRO 360 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2bll h PRO 360 CO 0.80 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.29 2bll n HIS 361 N -4.32 0.67 -4.09 1.56 8.25 -1.26 -4.90 115.22 111.14 2bll n HIS 361 Ca -0.03 -0.41 -0.36 0.00 -0.26 0.00 0.00 57.72 56.66 2bll n HIS 361 Cb 0.09 -0.01 -0.08 0.00 1.12 0.00 0.00 29.99 31.11 2bll n HIS 361 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2bll s PHE 362 N -1.11 3.37 -0.20 4.41 5.36 -1.05 -0.78 117.98 127.98 2bll s PHE 362 Ca 0.38 0.32 -0.02 0.00 -0.96 0.00 0.00 56.93 56.65 2bll s PHE 362 Cb 0.20 -1.91 0.06 0.00 -0.34 0.00 0.00 43.02 41.03 2bll s PHE 362 CO 0.27 0.53 0.02 -1.01 -1.46 0.00 0.00 175.22 173.58 2bll s HIS 363 N -0.72 1.22 0.12 10.12 3.76 0.13 -4.75 115.29 125.17 2bll s HIS 363 Ca 0.12 -0.97 -0.30 0.00 -0.15 0.00 0.00 55.06 53.76 2bll s HIS 363 Cb -0.12 -1.10 -0.06 0.00 1.11 0.00 0.00 32.58 32.41 2bll s HIS 363 CO 0.03 -0.63 1.04 0.12 -0.85 0.00 0.00 174.74 174.45 2bll s PHE 364 N 1.79 3.68 -0.12 1.40 5.36 -1.26 -1.13 117.98 127.71 2bll s PHE 364 Ca -0.01 1.67 0.01 0.00 -0.96 0.00 0.00 56.93 57.63 2bll s PHE 364 Cb -0.17 -3.18 0.02 0.00 -0.34 0.00 0.00 43.02 39.35 2bll s PHE 364 CO -0.08 -0.26 -0.15 0.08 -1.46 0.00 0.00 175.22 173.35 2bll s VAL 365 N 0.12 1.48 0.10 3.12 1.01 0.06 -4.91 120.40 121.38 2bll s VAL 365 Ca 0.50 -0.62 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 2bll s VAL 365 Cb -0.26 -1.37 -0.06 0.00 0.00 0.00 0.00 36.38 34.69 2bll s VAL 365 CO 0.31 0.44 1.14 -1.61 0.00 0.00 0.00 175.10 175.38 2bll s GLU 366 N 1.11 4.51 0.00 2.72 0.41 -1.26 -1.43 118.70 124.75 2bll s GLU 366 Ca -0.04 1.72 0.00 0.00 -0.41 0.00 0.00 54.97 56.24 2bll s GLU 366 Cb -0.14 -3.33 0.00 0.00 -1.78 0.00 0.00 34.13 28.88 2bll s GLU 366 CO -0.03 -0.10 0.00 0.41 -0.49 0.00 0.00 175.26 175.04 2bll n GLY 367 N 2.70 1.02 3.35 -1.39 0.00 -0.51 -4.82 105.19 105.54 2bll n GLY 367 Ca 0.06 -0.85 -0.06 0.00 0.00 0.00 0.00 46.02 45.17 2bll n GLY 367 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bll s ASP 368 N 0.00 -0.48 0.11 1.61 2.15 -1.26 -2.52 116.67 116.28 2bll s ASP 368 Ca 0.00 1.11 0.19 0.00 0.43 0.00 0.00 52.55 54.28 2bll s ASP 368 Cb 0.00 1.60 0.80 0.00 -0.30 0.00 0.00 42.92 45.02 2bll s ASP 368 CO 0.00 -0.23 1.60 2.30 -0.17 0.00 0.00 175.17 178.67 2bll n ILE 369 N 5.41 0.86 0.03 4.11 -5.35 -1.26 -0.69 119.36 122.47 2bll n ILE 369 Ca -0.09 0.21 -0.01 0.00 -0.27 0.00 0.00 62.75 62.59 2bll n ILE 369 Cb 0.49 -1.02 -0.09 0.00 -1.74 0.00 0.00 39.64 37.29 2bll n ILE 369 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2bll n SER 370 N -1.82 0.86 -0.11 7.28 7.64 -1.26 -4.51 113.62 121.71 2bll n SER 370 Ca 0.03 0.38 -0.24 0.00 1.01 0.00 0.00 58.87 60.05 2bll n SER 370 Cb 0.21 0.14 -0.11 0.00 -1.01 0.00 0.00 64.21 63.44 2bll n SER 370 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2bll n ILE 371 N -2.90 1.56 -2.91 0.44 5.41 -0.78 -4.96 119.36 115.23 2bll n ILE 371 Ca -0.10 -0.34 -0.40 0.00 1.00 0.00 0.00 62.75 62.91 2bll n ILE 371 Cb 0.85 -1.84 -0.06 0.00 -0.71 0.00 0.00 39.64 37.88 2bll n ILE 371 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 2bll s HIS 372 N -2.47 3.91 0.00 1.39 3.76 0.14 -4.98 115.29 117.04 2bll s HIS 372 Ca -0.33 1.70 0.00 0.00 -0.15 0.00 0.00 55.06 56.29 2bll s HIS 372 Cb 0.10 -2.84 0.00 0.00 1.11 0.00 0.00 32.58 30.95 2bll s HIS 372 CO 0.58 0.46 0.00 -1.13 -0.85 0.00 0.00 174.74 173.80 2bll n SER 373 N 1.74 0.00 -0.28 1.40 3.41 -1.26 -4.71 113.62 113.92 2bll n SER 373 Ca -0.04 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2bll n SER 373 Cb 0.48 -0.16 0.12 0.00 -0.26 0.00 0.00 64.21 64.40 2bll n SER 373 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2bll h GLU 374 N 0.00 0.86 -0.79 4.33 5.08 -1.98 -1.58 114.58 120.49 2bll h GLU 374 Ca 0.00 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2bll h GLU 374 Cb 0.00 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 2bll h GLU 374 CO 0.00 0.57 0.52 2.35 -1.00 0.00 0.00 179.01 181.45 2bll h TRP 375 N 0.88 1.00 0.00 4.33 -0.00 -1.99 0.12 115.95 120.30 2bll h TRP 375 Ca 0.34 0.02 -0.08 0.00 -0.00 0.00 0.00 58.89 59.17 2bll h TRP 375 Cb 0.16 -0.34 0.01 0.00 -0.00 0.00 0.00 29.16 28.99 2bll h TRP 375 CO -0.05 0.63 -0.33 0.82 -0.00 0.00 0.00 178.44 179.52 2bll h ILE 376 N 1.07 1.53 -0.39 2.65 1.08 -1.76 -2.84 117.51 118.85 2bll h ILE 376 Ca 0.29 -2.00 0.08 0.00 -0.39 0.00 0.00 64.86 62.84 2bll h ILE 376 Cb -0.12 2.77 -0.09 0.00 -3.07 0.00 0.00 36.82 36.31 2bll h ILE 376 CO -0.06 0.55 -0.22 -0.08 -0.69 0.00 0.00 178.15 177.65 2bll h GLU 377 N -0.44 -0.15 -0.74 2.37 4.81 -1.11 0.03 114.58 119.35 2bll h GLU 377 Ca -0.04 0.01 0.17 0.00 -0.13 0.00 0.00 59.36 59.36 2bll h GLU 377 Cb 1.08 0.03 -0.13 0.00 0.63 0.00 0.00 28.75 30.37 2bll h GLU 377 CO 0.06 -0.10 -0.00 -0.92 -0.73 0.00 0.00 179.01 177.32 2bll h TYR 378 N -0.15 -0.06 0.00 0.92 3.20 -0.82 -1.44 116.97 118.62 2bll h TYR 378 Ca 0.19 0.05 -0.17 0.00 3.14 0.00 0.00 58.73 61.94 2bll h TYR 378 Cb 0.45 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 2bll h TYR 378 CO -0.45 -0.23 -0.81 0.45 -1.64 0.00 0.00 178.16 175.47 2bll h HIS 379 N 0.10 0.00 -0.25 -3.82 3.86 -1.02 -0.26 115.15 113.76 2bll h HIS 379 Ca 0.40 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.61 2bll h HIS 379 Cb 0.70 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.16 2bll h HIS 379 CO -0.42 0.81 0.17 0.28 0.86 0.00 0.00 177.93 179.63 2bll h VAL 380 N 0.00 1.07 -0.85 2.45 2.07 -0.57 -1.35 116.25 119.08 2bll h VAL 380 Ca -0.01 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 2bll h VAL 380 Cb 1.44 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.86 2bll h VAL 380 CO 0.11 0.06 0.49 0.50 0.02 0.00 0.00 177.57 178.75 2bll h LYS 381 N 0.34 1.16 -0.11 1.57 3.64 -0.72 -2.84 116.57 119.61 2bll h LYS 381 Ca 0.09 -0.12 -0.13 0.00 -1.27 0.00 0.00 60.65 59.22 2bll h LYS 381 Cb -0.04 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.53 2bll h LYS 381 CO -0.02 0.83 -0.51 -0.22 -2.27 0.00 0.00 179.45 177.26 2bll h LYS 382 N 1.18 0.31 -6.91 1.90 3.64 -0.87 -3.45 116.57 112.36 2bll h LYS 382 Ca 0.30 -0.18 -0.48 0.00 -1.27 0.00 0.00 60.65 59.03 2bll h LYS 382 Cb -0.01 0.01 0.06 0.00 -0.41 0.00 0.00 32.23 31.88 2bll h LYS 382 CO -0.05 0.74 0.02 0.00 -2.27 0.00 0.00 179.45 177.89 2bll n ASP 384 N -2.58 2.55 -3.98 0.00 8.00 -0.52 -4.95 116.55 115.07 2bll n ASP 384 Ca 0.15 -0.09 -0.14 0.00 0.71 0.00 0.00 54.79 55.43 2bll n ASP 384 Cb 0.61 -0.17 -0.13 0.00 -0.02 0.00 0.00 41.12 41.41 2bll n ASP 384 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2bll s VAL 385 N -2.35 0.37 -0.04 2.53 0.11 -0.94 -2.42 120.40 117.65 2bll s VAL 385 Ca -0.22 -0.57 0.03 0.00 -2.93 0.00 0.00 61.98 58.30 2bll s VAL 385 Cb 0.06 -0.38 0.00 0.00 -1.53 0.00 0.00 36.38 34.53 2bll s VAL 385 CO 0.42 -0.14 -0.13 -0.69 -3.33 0.00 0.00 175.10 171.22 2bll s VAL 386 N -0.69 1.15 -0.37 2.04 1.01 -0.27 -0.40 120.40 122.87 2bll s VAL 386 Ca -0.04 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.41 2bll s VAL 386 Cb -0.05 -1.02 0.11 0.00 0.00 0.00 0.00 36.38 35.42 2bll s VAL 386 CO -0.00 0.35 0.13 -0.22 0.00 0.00 0.00 175.10 175.36 2bll s LEU 387 N 0.26 3.20 -0.60 3.92 1.98 -0.34 -0.50 118.68 126.60 2bll s LEU 387 Ca -0.07 -2.12 -0.26 0.00 -2.89 0.00 0.00 54.13 48.79 2bll s LEU 387 Cb -0.12 -1.17 0.04 0.00 0.66 0.00 0.00 46.19 45.59 2bll s LEU 387 CO 0.02 -0.36 1.11 -2.84 -1.89 0.00 0.00 176.35 172.40 2bll s PRO 388 N 0.97 3.38 -0.01 0.98 0.02 -1.26 -1.13 135.00 137.96 2bll s PRO 388 Ca 0.13 -0.06 0.16 0.00 0.02 0.00 0.00 61.00 61.25 2bll s PRO 388 Cb -0.20 -4.07 0.47 0.00 0.02 0.00 0.00 34.50 30.72 2bll s PRO 388 CO -0.13 -1.70 1.39 1.28 -0.33 0.00 0.00 177.00 177.52 2bll n LEU 389 N 8.23 3.44 -4.62 -5.54 4.77 0.45 -4.47 117.00 119.26 2bll n LEU 389 Ca 0.05 -2.02 -0.40 0.00 -0.03 0.00 0.00 56.01 53.60 2bll n LEU 389 Cb 0.48 -0.36 -0.08 0.00 -2.33 0.00 0.00 43.42 41.14 2bll n LEU 389 CO 0.68 0.85 0.24 -0.69 -1.33 0.00 0.00 177.39 177.14 2bll s VAL 390 N -1.04 5.07 -0.22 4.08 1.01 -1.23 -0.05 120.40 128.03 2bll s VAL 390 Ca 0.35 0.87 -0.28 0.00 0.00 0.00 0.00 61.98 62.92 2bll s VAL 390 Cb 0.19 -3.82 0.14 0.00 0.00 0.00 0.00 36.38 32.89 2bll s VAL 390 CO 0.24 0.09 1.10 0.00 0.00 0.00 0.00 175.10 176.52 2bll s ALA 391 N 2.29 -1.99 -0.29 5.51 0.00 -0.71 -4.81 121.76 121.76 2bll s ALA 391 Ca 0.21 1.71 -0.21 0.00 0.00 0.00 0.00 51.96 53.67 2bll s ALA 391 Cb -0.16 -1.10 -0.01 0.00 0.00 0.00 0.00 23.12 21.86 2bll s ALA 391 CO 0.09 -0.26 0.66 0.42 0.00 0.00 0.00 175.76 176.67 2bll s ILE 392 N -0.68 4.92 -0.37 0.00 1.01 -1.26 -2.64 121.20 122.18 2bll s ILE 392 Ca 0.02 0.99 0.08 0.00 0.00 0.00 0.00 60.65 61.74 2bll s ILE 392 Cb -0.02 -4.01 0.44 0.00 0.01 0.00 0.00 42.46 38.88 2bll s ILE 392 CO -0.03 -0.11 1.12 0.00 0.00 0.00 0.00 174.94 175.92 2bll n ALA 393 N 5.89 4.76 -2.59 9.38 0.00 -1.26 -4.95 120.51 131.74 2bll n ALA 393 Ca -0.00 -3.96 -0.43 0.00 0.00 0.00 0.00 53.44 49.05 2bll n ALA 393 Cb 0.49 -0.53 -0.09 0.00 0.00 0.00 0.00 19.45 19.32 2bll n ALA 393 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2bll s THR 394 N -4.92 5.19 0.19 0.00 2.01 -1.26 -5.01 115.64 111.84 2bll s THR 394 Ca 0.46 -0.68 -0.22 0.00 0.31 0.00 0.00 61.69 61.56 2bll s THR 394 Cb 0.40 -4.03 0.12 0.00 0.01 0.00 0.00 72.50 69.01 2bll s THR 394 CO -0.09 -0.44 1.57 -0.65 -0.69 0.00 0.00 174.62 174.33 2bll h PRO 395 N 8.71 -0.12 -1.02 4.92 0.11 -1.98 0.86 132.00 143.49 2bll h PRO 395 Ca -0.27 0.01 0.26 0.00 0.11 0.00 0.00 66.00 66.10 2bll h PRO 395 Cb 1.11 0.03 -0.08 0.00 0.11 0.00 0.00 31.00 32.17 2bll h PRO 395 CO 0.80 -0.08 0.66 -0.84 -0.21 0.00 0.00 178.00 178.33 2bll h ILE 396 N -0.13 0.56 0.00 4.15 3.07 -2.01 0.13 117.51 123.28 2bll h ILE 396 Ca 0.25 -0.13 -0.01 0.00 1.55 0.00 0.00 64.86 66.51 2bll h ILE 396 Cb 0.56 0.14 -0.00 0.00 -0.27 0.00 0.00 36.82 37.25 2bll h ILE 396 CO -0.78 0.07 -0.07 -0.33 -1.05 0.00 0.00 178.15 175.99 2bll h GLU 397 N 0.38 0.00 -0.03 0.16 4.39 -1.21 0.39 114.58 118.66 2bll h GLU 397 Ca 0.56 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 60.23 2bll h GLU 397 Cb 1.47 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.11 2bll h GLU 397 CO -0.25 0.07 -0.16 1.88 -1.16 0.00 0.00 179.01 179.39 2bll h TYR 398 N 0.00 0.04 0.00 4.33 0.05 -0.63 0.41 116.97 121.17 2bll h TYR 398 Ca -0.00 -0.00 -0.32 0.00 0.05 0.00 0.00 58.73 58.46 2bll h TYR 398 Cb 0.13 -0.01 -0.06 0.00 1.01 0.00 0.00 36.73 37.80 2bll h TYR 398 CO 0.00 0.20 -2.19 0.25 -1.05 0.00 0.00 178.16 175.36 2bll n THR 399 N -4.33 1.20 0.09 -2.88 -2.24 -0.97 -3.83 114.28 101.31 2bll n THR 399 Ca -0.02 -0.67 -0.17 0.00 -2.27 0.00 0.00 64.05 60.92 2bll n THR 399 Cb 0.23 -0.72 -0.14 0.00 -2.10 0.00 0.00 70.33 67.60 2bll n THR 399 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2bll h ARG 400 N 0.00 0.29 -1.69 -0.78 2.43 -0.09 -3.40 114.38 111.14 2bll h ARG 400 Ca -0.47 -0.50 -0.47 0.00 -0.81 0.00 0.00 59.98 57.73 2bll h ARG 400 Cb 1.99 0.19 -0.40 0.00 -0.42 0.00 0.00 29.97 31.32 2bll h ARG 400 CO 0.00 1.20 -1.07 -1.71 -1.51 0.00 0.00 179.97 176.88 2bll n ASN 401 N -3.52 1.91 -0.08 -3.80 2.85 0.14 -4.96 115.26 107.81 2bll n ASN 401 Ca -0.13 -3.08 0.05 0.00 -0.11 0.00 0.00 54.58 51.30 2bll n ASN 401 Cb 1.04 -0.57 0.39 0.00 1.24 0.00 0.00 39.78 41.88 2bll n ASN 401 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2bll h PRO 402 N 2.96 0.64 -0.24 1.20 0.13 -1.62 -2.19 132.00 132.86 2bll h PRO 402 Ca 0.06 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 65.10 2bll h PRO 402 Cb 0.96 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 2bll h PRO 402 CO 0.58 0.42 -0.05 -0.07 -0.23 0.00 0.00 178.00 178.65 2bll h LEU 403 N 0.66 0.46 -0.85 1.56 3.38 -1.90 -0.70 115.31 117.92 2bll h LEU 403 Ca 0.22 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 2bll h LEU 403 Cb 0.06 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2bll h LEU 403 CO -0.06 0.71 0.40 -0.09 0.09 0.00 0.00 178.44 179.49 2bll h ARG 404 N 0.21 1.23 -0.88 1.13 9.65 -1.90 0.16 114.38 123.97 2bll h ARG 404 Ca 0.06 -0.18 0.04 0.00 -1.10 0.00 0.00 59.98 58.80 2bll h ARG 404 Cb 0.50 -0.22 -0.05 0.00 -1.39 0.00 0.00 29.97 28.81 2bll h ARG 404 CO 0.02 0.94 0.56 0.28 2.80 0.00 0.00 179.97 184.58 2bll h VAL 405 N 1.21 1.13 -0.24 0.20 2.07 -1.08 -1.69 116.25 117.85 2bll h VAL 405 Ca 0.29 -0.37 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 2bll h VAL 405 Cb 0.13 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 2bll h VAL 405 CO -0.04 0.20 -0.17 0.15 0.02 0.00 0.00 177.57 177.74 2bll h PHE 406 N 1.09 0.63 -0.24 1.57 3.57 -0.46 -0.29 116.94 122.81 2bll h PHE 406 Ca 0.35 -0.17 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 2bll h PHE 406 Cb 0.03 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 2bll h PHE 406 CO -0.02 0.83 0.04 0.93 -2.23 0.00 0.00 178.31 177.87 2bll h GLU 407 N 0.25 0.40 0.09 1.11 5.08 -0.52 0.68 114.58 121.66 2bll h GLU 407 Ca 0.05 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2bll h GLU 407 Cb 0.70 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2bll h GLU 407 CO 0.05 0.52 -0.05 1.25 -1.00 0.00 0.00 179.01 179.78 2bll h LEU 408 N 0.21 -0.11 -0.48 1.33 5.85 -1.37 -0.64 115.31 120.10 2bll h LEU 408 Ca 0.07 -0.44 -0.17 0.00 0.84 0.00 0.00 57.88 58.19 2bll h LEU 408 Cb 0.31 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2bll h LEU 408 CO 0.00 0.54 -0.57 0.44 -0.34 0.00 0.00 178.44 178.51 2bll h ASP 409 N -0.92 0.64 0.00 1.25 5.19 -1.08 -3.25 116.42 118.25 2bll h ASP 409 Ca -0.01 -0.35 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 2bll h ASP 409 Cb 0.54 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.86 2bll h ASP 409 CO 0.02 1.07 -0.09 0.33 -3.12 0.00 0.00 179.24 177.46 2bll n PHE 410 N -3.95 0.06 -0.11 4.55 7.35 0.21 -4.34 117.46 121.21 2bll n PHE 410 Ca -0.03 0.02 -0.07 0.00 -0.76 0.00 0.00 57.45 56.61 2bll n PHE 410 Cb 0.62 -0.19 0.01 0.00 0.35 0.00 0.00 39.48 40.27 2bll n PHE 410 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2bll h GLU 411 N -0.12 0.39 -0.15 -4.13 5.08 -1.18 -0.99 114.58 113.49 2bll h GLU 411 Ca 0.00 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 2bll h GLU 411 Cb 0.09 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2bll h GLU 411 CO 0.00 0.26 -0.50 0.93 -1.00 0.00 0.00 179.01 178.70 2bll h GLU 412 N 0.41 0.40 -0.08 2.33 4.39 -1.17 -2.84 114.58 118.02 2bll h GLU 412 Ca 0.16 -0.23 -0.13 0.00 0.34 0.00 0.00 59.36 59.49 2bll h GLU 412 Cb 0.05 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 2bll h GLU 412 CO -0.10 0.81 -0.54 -0.91 -1.16 0.00 0.00 179.01 177.11 2bll h ASN 413 N 0.32 0.24 -0.66 1.42 2.35 -1.56 -3.04 115.58 114.64 2bll h ASN 413 Ca 0.01 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.62 2bll h ASN 413 Cb 1.00 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 39.27 2bll h ASN 413 CO 0.09 0.74 0.37 0.25 -1.65 0.00 0.00 177.43 177.23 2bll h LEU 414 N 0.17 0.83 -0.45 1.61 5.85 -1.07 -0.37 115.31 121.88 2bll h LEU 414 Ca 0.00 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2bll h LEU 414 Cb 1.01 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 2bll h LEU 414 CO 0.08 0.66 0.25 0.03 -0.34 0.00 0.00 178.44 179.13 2bll h ARG 415 N 0.94 0.62 -0.75 1.25 3.08 -1.39 -0.90 114.38 117.22 2bll h ARG 415 Ca 0.24 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 2bll h ARG 415 Cb 0.02 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 2bll h ARG 415 CO -0.04 0.48 0.32 0.82 -1.07 0.00 0.00 179.97 180.48 2bll h ILE 416 N 0.59 1.25 -0.59 2.04 2.04 -1.42 -1.27 117.51 120.14 2bll h ILE 416 Ca 0.16 -0.76 0.05 0.00 1.00 0.00 0.00 64.86 65.31 2bll h ILE 416 Cb 0.03 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.41 2bll h ILE 416 CO -0.03 0.31 0.32 0.40 0.00 0.00 0.00 178.15 179.15 2bll h ILE 417 N 1.08 0.96 0.00 -0.67 2.04 -0.74 -2.21 117.51 117.97 2bll h ILE 417 Ca 0.25 -0.21 -0.10 0.00 1.00 0.00 0.00 64.86 65.81 2bll h ILE 417 Cb 0.18 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2bll h ILE 417 CO -0.02 0.11 -0.47 0.03 0.00 0.00 0.00 178.15 177.80 2bll h ARG 418 N 0.60 0.00 -0.65 2.37 3.08 -0.72 -1.82 114.38 117.23 2bll h ARG 418 Ca 0.26 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.26 2bll h ARG 418 Cb 0.16 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 2bll h ARG 418 CO -0.17 0.47 0.20 1.88 -1.07 0.00 0.00 179.97 181.28 2bll h TYR 419 N 0.00 1.05 -0.53 3.04 0.05 -0.76 -0.68 116.97 119.15 2bll h TYR 419 Ca -0.00 -0.11 -0.04 0.00 0.05 0.00 0.00 58.73 58.63 2bll h TYR 419 Cb 0.88 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 38.29 2bll h TYR 419 CO 0.00 0.85 0.17 0.00 -1.05 0.00 0.00 178.16 178.14 2bll h VAL 421 N 0.73 0.81 -0.45 0.00 2.07 -1.25 0.85 116.25 119.01 2bll h VAL 421 Ca 0.17 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.67 2bll h VAL 421 Cb 0.27 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 2bll h VAL 421 CO -0.01 0.00 0.18 0.50 0.02 0.00 0.00 177.57 178.27 2bll h LYS 422 N -0.01 0.67 -0.64 1.57 3.64 -0.92 -2.92 116.57 117.96 2bll h LYS 422 Ca 0.08 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2bll h LYS 422 Cb 0.14 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2bll h LYS 422 CO -0.18 0.61 0.00 0.66 -2.27 0.00 0.00 179.45 178.27 2bll n TYR 423 N -4.61 1.34 -3.77 1.91 4.01 -0.47 -4.94 117.16 110.62 2bll n TYR 423 Ca 0.01 -0.53 -0.23 0.00 -0.16 0.00 0.00 57.90 56.99 2bll n TYR 423 Cb 0.15 -0.23 0.02 0.00 -0.31 0.00 0.00 39.34 38.96 2bll n TYR 423 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2bll n ARG 424 N 0.96 -4.63 -4.06 -0.72 1.74 0.05 -4.98 116.66 105.02 2bll n ARG 424 Ca 0.23 0.57 -0.27 0.00 -0.77 0.00 0.00 57.85 57.61 2bll n ARG 424 Cb 0.81 -5.08 -0.05 0.00 -1.02 0.00 0.00 32.46 27.12 2bll n ARG 424 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2bll s LYS 425 N -6.15 2.96 0.16 5.56 -0.14 0.07 -4.99 119.74 117.21 2bll s LYS 425 Ca 0.07 -0.82 -0.30 0.00 -1.36 0.00 0.00 55.97 53.56 2bll s LYS 425 Cb -0.03 -2.69 -0.07 0.00 -1.68 0.00 0.00 37.83 33.35 2bll s LYS 425 CO 0.83 0.50 0.94 0.50 -0.76 0.00 0.00 175.35 177.36 2bll s ARG 426 N -3.03 4.75 -0.08 1.68 3.52 -1.02 -4.46 118.95 120.31 2bll s ARG 426 Ca 0.31 1.44 0.04 0.00 -0.13 0.00 0.00 55.73 57.39 2bll s ARG 426 Cb -0.10 -3.33 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 2bll s ARG 426 CO 0.24 0.36 -0.20 -1.50 -0.81 0.00 0.00 175.30 173.38 2bll s ILE 427 N -0.53 2.43 -0.36 4.11 2.07 -0.53 -1.12 121.20 127.27 2bll s ILE 427 Ca 0.44 -0.91 -0.02 0.00 -1.41 0.00 0.00 60.65 58.74 2bll s ILE 427 Cb -0.24 -1.94 0.08 0.00 0.13 0.00 0.00 42.46 40.49 2bll s ILE 427 CO 0.30 0.56 0.11 -0.63 -1.91 0.00 0.00 174.94 173.37 2bll s ILE 428 N 0.00 3.13 -0.16 2.00 1.01 0.35 -1.49 121.20 126.04 2bll s ILE 428 Ca -0.07 -1.77 -0.04 0.00 0.00 0.00 0.00 60.65 58.77 2bll s ILE 428 Cb -0.15 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.29 2bll s ILE 428 CO 0.05 -0.43 -0.03 0.12 0.00 0.00 0.00 174.94 174.64 2bll s PHE 429 N 1.18 3.02 -0.75 3.97 5.36 -0.30 -4.01 117.98 126.45 2bll s PHE 429 Ca 0.03 -0.35 -0.26 0.00 -0.96 0.00 0.00 56.93 55.39 2bll s PHE 429 Cb -0.21 -1.98 0.02 0.00 -0.34 0.00 0.00 43.02 40.51 2bll s PHE 429 CO -0.03 -0.08 1.44 -1.25 -1.46 0.00 0.00 175.22 173.84 2bll s PRO 430 N 0.49 3.10 0.00 10.12 0.04 -1.26 -0.89 135.00 146.59 2bll s PRO 430 Ca -0.03 -0.16 0.00 0.00 0.04 0.00 0.00 61.00 60.84 2bll s PRO 430 Cb -0.14 -4.38 0.00 0.00 0.04 0.00 0.00 34.50 30.02 2bll s PRO 430 CO 0.03 -2.32 0.00 0.45 0.04 0.00 0.00 177.00 175.20 2bll n SER 431 N 10.17 -0.44 -3.99 6.66 2.88 0.14 -4.93 113.62 124.12 2bll n SER 431 Ca 0.11 -0.45 -0.10 0.00 -1.33 0.00 0.00 58.87 57.10 2bll n SER 431 Cb 0.50 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.84 2bll n SER 431 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2bll s THR 432 N -0.67 0.18 0.14 2.46 -1.32 -1.26 -4.53 115.64 110.64 2bll s THR 432 Ca 0.00 -0.87 0.34 0.00 -1.21 0.00 0.00 61.69 59.95 2bll s THR 432 Cb 0.00 -0.30 0.38 0.00 -1.51 0.00 0.00 72.50 71.06 2bll s THR 432 CO 0.00 -0.44 2.03 0.77 -2.21 0.00 0.00 174.62 174.76 2bll h SER 433 N 4.74 0.00 0.36 8.08 4.64 -1.89 -2.13 113.55 127.35 2bll h SER 433 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2bll h SER 433 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2bll h SER 433 CO 0.42 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 176.05 2bll h GLU 434 N 0.00 0.00 0.00 4.77 5.08 -1.95 -3.16 114.58 119.33 2bll h GLU 434 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2bll h GLU 434 Cb 0.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 2bll h GLU 434 CO 0.00 0.00 -0.05 -0.39 -1.00 0.00 0.00 179.01 177.57 2bll h VAL 435 N 0.00 0.97 0.00 3.13 -1.51 -1.63 -2.74 116.25 114.47 2bll h VAL 435 Ca 0.00 -0.18 -0.11 0.00 -1.23 0.00 0.00 66.70 65.18 2bll h VAL 435 Cb 0.18 1.10 -0.02 0.00 -2.13 0.00 0.00 31.29 30.42 2bll h VAL 435 CO 0.00 0.05 -0.54 1.88 -1.23 0.00 0.00 177.57 177.73 2bll h TYR 436 N 0.00 0.00 0.00 5.19 0.05 -1.80 -3.41 116.97 117.00 2bll h TYR 436 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2bll h TYR 436 Cb 0.09 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.83 2bll h TYR 436 CO 0.00 0.54 0.00 0.41 -1.05 0.00 0.00 178.16 178.06 2bll n GLY 437 N 0.09 3.67 1.69 3.88 0.00 -1.04 -1.73 105.19 111.75 2bll n GLY 437 Ca -0.01 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 2bll n GLY 437 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2bll n MET 438 N 14.00 1.70 -1.58 1.61 2.81 0.47 -4.86 117.12 131.27 2bll n MET 438 Ca 0.00 -1.68 -0.52 0.00 -1.81 0.00 0.00 57.70 53.69 2bll n MET 438 Cb 0.00 -1.66 -0.06 0.00 -0.71 0.00 0.00 33.22 30.80 2bll n MET 438 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2bll n SER 440 N 2.35 0.77 -4.75 0.00 3.41 -1.26 -4.88 113.62 109.26 2bll n SER 440 Ca 0.18 -0.69 -0.37 0.00 -0.26 0.00 0.00 58.87 57.72 2bll n SER 440 Cb 0.19 0.06 0.04 0.00 -0.26 0.00 0.00 64.21 64.24 2bll n SER 440 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2bll s ASP 441 N -2.54 5.17 0.22 4.04 1.01 -1.26 -4.91 116.67 118.39 2bll s ASP 441 Ca 0.25 2.62 0.05 0.00 0.71 0.00 0.00 52.55 56.18 2bll s ASP 441 Cb 0.19 -2.62 0.17 0.00 1.01 0.00 0.00 42.92 41.67 2bll s ASP 441 CO 0.52 -1.62 1.50 0.11 0.21 0.00 0.00 175.17 175.89 2bll h LYS 442 N 1.18 0.16 -5.00 8.23 1.57 -1.93 -3.41 116.57 117.37 2bll h LYS 442 Ca -0.51 -0.14 -0.67 0.00 -1.87 0.00 0.00 60.65 57.47 2bll h LYS 442 Cb 1.30 0.03 -0.35 0.00 0.08 0.00 0.00 32.23 33.30 2bll h LYS 442 CO 0.56 0.80 -0.83 0.71 -0.57 0.00 0.00 179.45 180.12 2bll s TYR 443 N -3.51 2.92 -0.19 -1.35 2.02 -1.26 -4.28 117.35 111.70 2bll s TYR 443 Ca -0.03 -1.75 -0.29 0.00 -0.37 0.00 0.00 57.07 54.63 2bll s TYR 443 Cb 0.11 -1.94 -0.02 0.00 -0.40 0.00 0.00 41.96 39.71 2bll s TYR 443 CO 0.80 -0.80 1.36 -0.06 -1.57 0.00 0.00 175.55 175.27 2bll s PHE 444 N 1.26 2.63 -0.20 2.71 0.08 0.11 -4.53 117.98 120.04 2bll s PHE 444 Ca 0.02 0.83 -0.02 0.00 0.12 0.00 0.00 56.93 57.88 2bll s PHE 444 Cb -0.15 -3.70 -0.00 0.00 -0.57 0.00 0.00 43.02 38.60 2bll s PHE 444 CO -0.10 -2.08 -0.10 0.34 -0.10 0.00 0.00 175.22 173.18 2bll s ASP 445 N 2.58 3.95 0.38 1.36 3.68 -1.26 -1.29 116.67 126.08 2bll s ASP 445 Ca 0.59 -0.45 0.06 0.00 2.13 0.00 0.00 52.55 54.87 2bll s ASP 445 Cb -0.22 -1.65 0.76 0.00 -1.45 0.00 0.00 42.92 40.36 2bll s ASP 445 CO 0.20 0.01 2.01 -0.33 0.13 0.00 0.00 175.17 177.19 2bll h GLU 446 N 7.88 0.59 0.00 4.34 3.07 -1.90 0.11 114.58 128.68 2bll h GLU 446 Ca -0.41 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.40 2bll h GLU 446 Cb 1.16 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.95 2bll h GLU 446 CO 0.61 0.43 -0.94 -0.25 -1.40 0.00 0.00 179.01 177.46 2bll n ASP 447 N -4.43 0.72 0.00 1.42 8.00 -1.26 -4.75 116.55 116.24 2bll n ASP 447 Ca 0.03 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 54.99 2bll n ASP 447 Cb 0.09 0.81 0.00 0.00 -0.02 0.00 0.00 41.12 42.01 2bll n ASP 447 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2bll n HIS 448 N -1.67 0.00 -2.30 1.24 8.25 -0.91 -5.08 115.22 114.75 2bll n HIS 448 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.08 2bll n HIS 448 Cb 0.37 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.45 2bll n HIS 448 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2bll s SER 449 N -1.16 6.98 0.56 0.41 0.01 -0.02 -5.00 113.70 115.48 2bll s SER 449 Ca 0.00 2.26 -0.19 0.00 1.31 0.00 0.00 55.95 59.34 2bll s SER 449 Cb 0.00 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.58 2bll s SER 449 CO 0.00 -0.48 1.12 0.20 0.41 0.00 0.00 173.24 174.49 2bll s ASN 450 N 0.52 5.63 -0.19 2.44 0.01 -1.26 -4.91 114.94 117.18 2bll s ASN 450 Ca 0.57 2.13 -0.07 0.00 -0.71 0.00 0.00 52.86 54.77 2bll s ASN 450 Cb -0.34 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 38.71 2bll s ASN 450 CO 0.35 -1.28 0.06 -0.76 -1.51 0.00 0.00 177.10 173.96 2bll s LEU 451 N -4.01 3.78 -0.17 0.60 1.43 -1.26 -4.59 118.68 114.46 2bll s LEU 451 Ca 0.71 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.87 2bll s LEU 451 Cb -0.23 -1.96 0.03 0.00 0.03 0.00 0.00 46.19 44.06 2bll s LEU 451 CO 0.30 0.15 -0.12 -0.63 0.23 0.00 0.00 176.35 176.28 2bll s ILE 452 N 0.48 1.54 0.35 -0.59 1.01 -0.70 -4.96 121.20 118.32 2bll s ILE 452 Ca 0.03 -0.76 0.07 0.00 0.00 0.00 0.00 60.65 59.99 2bll s ILE 452 Cb -0.13 -1.53 -0.07 0.00 0.01 0.00 0.00 42.46 40.74 2bll s ILE 452 CO 0.01 0.32 -0.03 0.68 0.00 0.00 0.00 174.94 175.92 2bll s VAL 453 N 1.47 1.88 1.01 2.92 -7.23 -1.26 -0.39 120.40 118.80 2bll s VAL 453 Ca 0.02 -2.09 -0.17 0.00 -1.81 0.00 0.00 61.98 57.93 2bll s VAL 453 Cb -0.14 -2.73 0.23 0.00 0.56 0.00 0.00 36.38 34.29 2bll s VAL 453 CO -0.09 -0.13 1.32 -0.83 -0.31 0.00 0.00 175.10 175.05 2bll s GLY 454 N -3.58 1.79 1.15 2.32 0.00 -1.26 -5.02 107.32 102.72 2bll s GLY 454 Ca 0.33 -1.25 -0.14 0.00 0.00 0.00 0.00 44.72 43.65 2bll s GLY 454 CO 0.16 -0.43 0.72 -1.05 0.00 0.00 0.00 173.10 172.49 2bll n PRO 455 N -3.94 -2.12 0.17 2.90 -0.02 -1.26 -4.87 135.00 125.85 2bll n PRO 455 Ca 0.16 -0.59 0.06 0.00 -2.02 0.00 0.00 63.50 61.11 2bll n PRO 455 Cb 0.59 -2.03 0.53 0.00 -0.02 0.00 0.00 33.50 32.57 2bll n PRO 455 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2bll h VAL 456 N -2.47 1.07 0.00 -1.45 2.07 -2.03 -2.57 116.25 110.87 2bll h VAL 456 Ca -0.58 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2bll h VAL 456 Cb 1.34 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2bll h VAL 456 CO 0.45 0.08 0.00 -0.46 0.02 0.00 0.00 177.57 177.67 2bll n ASN 457 N -4.46 0.00 -4.06 0.57 0.23 -1.26 -3.97 115.26 102.31 2bll n ASN 457 Ca -0.01 -0.72 -0.35 0.00 -0.53 0.00 0.00 54.58 52.97 2bll n ASN 457 Cb 0.13 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 37.72 2bll n ASN 457 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2bll s LYS 458 N -2.00 2.53 0.04 -3.83 -0.14 -0.97 -4.98 119.74 110.40 2bll s LYS 458 Ca 0.10 -2.66 0.19 0.00 -1.36 0.00 0.00 55.97 52.23 2bll s LYS 458 Cb 0.05 -3.67 0.78 0.00 -1.68 0.00 0.00 37.83 33.31 2bll s LYS 458 CO 0.08 -1.18 1.59 -0.35 -0.76 0.00 0.00 175.35 174.73 2bll n PRO 459 N 3.23 0.03 0.13 -1.68 -0.04 -1.25 -2.83 135.00 132.58 2bll n PRO 459 Ca 0.09 0.23 0.19 0.00 -0.04 0.00 0.00 63.50 63.97 2bll n PRO 459 Cb 0.36 -1.56 0.77 0.00 -0.04 0.00 0.00 33.50 33.04 2bll n PRO 459 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 2bll h ARG 460 N 0.00 0.00 0.00 0.54 0.11 -1.94 -2.34 114.38 110.75 2bll h ARG 460 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bll h ARG 460 Cb 0.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.40 2bll h ARG 460 CO 0.00 0.00 0.00 0.91 0.10 0.00 0.00 179.97 180.98 2bll n TRP 461 N -3.86 0.00 -0.07 4.08 7.02 -1.13 -3.74 117.44 119.74 2bll n TRP 461 Ca 0.05 0.00 0.02 0.00 -1.02 0.00 0.00 57.50 56.55 2bll n TRP 461 Cb 0.48 -0.13 0.35 0.00 -2.42 0.00 0.00 31.31 29.59 2bll n TRP 461 CO 0.00 0.00 0.00 0.97 -2.02 0.00 0.00 177.69 176.64 2bll h ILE 462 N 0.00 1.15 -0.03 -0.99 2.10 -1.68 -1.39 117.51 116.67 2bll h ILE 462 Ca 0.00 -0.33 -0.01 0.00 1.08 0.00 0.00 64.86 65.60 2bll h ILE 462 Cb 0.12 0.43 -0.00 0.00 -1.09 0.00 0.00 36.82 36.29 2bll h ILE 462 CO 0.00 0.15 -0.01 0.22 -1.08 0.00 0.00 178.15 177.44 2bll h TYR 463 N 0.70 0.07 -0.47 2.19 3.20 -1.82 -0.55 116.97 120.29 2bll h TYR 463 Ca 0.18 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.09 2bll h TYR 463 Cb -0.02 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 2bll h TYR 463 CO 0.00 0.42 0.21 1.03 -1.64 0.00 0.00 178.16 178.19 2bll h SER 464 N -0.31 0.29 0.38 -2.11 0.87 -1.71 -2.28 113.55 108.69 2bll h SER 464 Ca 0.01 0.03 -0.22 0.00 -1.23 0.00 0.00 61.79 60.38 2bll h SER 464 Cb 0.40 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.34 2bll h SER 464 CO 0.00 0.20 -0.93 0.58 -0.53 0.00 0.00 176.83 176.16 2bll h VAL 465 N 0.43 1.42 -0.73 2.23 2.07 -1.30 -1.37 116.25 119.00 2bll h VAL 465 Ca 0.21 -2.48 0.02 0.00 0.82 0.00 0.00 66.70 65.27 2bll h VAL 465 Cb 0.15 2.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.30 2bll h VAL 465 CO -0.17 0.74 0.48 0.28 0.02 0.00 0.00 177.57 178.91 2bll h SER 466 N 0.21 0.81 -0.39 0.57 0.02 -0.92 -1.02 113.55 112.83 2bll h SER 466 Ca -0.07 -0.01 -0.16 0.00 -0.84 0.00 0.00 61.79 60.71 2bll h SER 466 Cb 1.56 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.90 2bll h SER 466 CO 0.16 0.58 -0.37 0.11 -1.14 0.00 0.00 176.83 176.17 2bll h LYS 467 N 0.96 0.93 -0.55 3.45 1.79 -1.33 -1.62 116.57 120.19 2bll h LYS 467 Ca 0.28 -0.48 -0.03 0.00 -2.18 0.00 0.00 60.65 58.24 2bll h LYS 467 Cb -0.06 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.58 2bll h LYS 467 CO -0.08 1.14 0.24 0.37 -1.08 0.00 0.00 179.45 180.04 2bll h GLN 468 N 0.75 0.81 -0.71 3.15 4.15 -1.11 -1.01 115.11 121.14 2bll h GLN 468 Ca 0.06 -0.13 -0.07 0.00 0.77 0.00 0.00 58.65 59.28 2bll h GLN 468 Cb 0.96 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.48 2bll h GLN 468 CO 0.09 0.68 0.16 1.25 -1.93 0.00 0.00 178.83 179.09 2bll h LEU 469 N 0.75 1.08 -0.66 -2.39 5.85 -1.07 -1.28 115.31 117.59 2bll h LEU 469 Ca 0.19 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.73 2bll h LEU 469 Cb 0.16 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 2bll h LEU 469 CO -0.02 1.04 0.37 0.25 -0.34 0.00 0.00 178.44 179.74 2bll h LEU 470 N 1.08 0.55 -0.42 2.25 5.85 -1.04 0.19 115.31 123.75 2bll h LEU 470 Ca 0.22 0.03 0.07 0.00 0.84 0.00 0.00 57.88 59.04 2bll h LEU 470 Cb 0.39 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 2bll h LEU 470 CO 0.00 0.36 0.09 0.44 -0.34 0.00 0.00 178.44 178.99 2bll h ASP 471 N 0.68 0.02 -0.57 1.25 3.32 -0.72 0.24 116.42 120.63 2bll h ASP 471 Ca 0.30 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.39 2bll h ASP 471 Cb 0.18 0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 2bll h ASP 471 CO -0.18 0.04 0.25 0.03 -1.72 0.00 0.00 179.24 177.67 2bll h ARG 472 N 0.22 0.88 -0.36 3.56 3.08 -0.53 0.37 114.38 121.60 2bll h ARG 472 Ca 0.21 -0.13 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 2bll h ARG 472 Cb 0.25 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2bll h ARG 472 CO -0.27 0.71 -0.08 0.28 -1.07 0.00 0.00 179.97 179.54 2bll h VAL 473 N 0.87 1.28 -0.59 2.04 2.07 -0.49 -0.92 116.25 120.50 2bll h VAL 473 Ca 0.21 -1.15 0.05 0.00 0.82 0.00 0.00 66.70 66.63 2bll h VAL 473 Cb 0.15 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 2bll h VAL 473 CO -0.02 0.38 0.32 0.40 0.02 0.00 0.00 177.57 178.67 2bll h ILE 474 N 0.49 0.97 -0.48 4.57 2.04 -0.72 -1.14 117.51 123.24 2bll h ILE 474 Ca 0.09 -0.21 0.02 0.00 1.00 0.00 0.00 64.86 65.76 2bll h ILE 474 Cb 0.59 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2bll h ILE 474 CO 0.03 0.11 0.29 -0.25 0.00 0.00 0.00 178.15 178.33 2bll h TRP 475 N 0.61 0.53 -0.75 1.37 2.91 -0.65 -0.34 115.95 119.64 2bll h TRP 475 Ca 0.26 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.26 2bll h TRP 475 Cb 0.14 -0.17 -0.03 0.00 -0.51 0.00 0.00 29.16 28.59 2bll h TRP 475 CO -0.09 0.31 0.33 0.00 -1.03 0.00 0.00 178.44 177.96 2bll h ALA 476 N 1.22 0.98 -0.53 2.65 0.00 -0.84 -0.61 119.26 122.12 2bll h ALA 476 Ca 0.19 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2bll h ALA 476 Cb 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2bll h ALA 476 CO -0.09 0.57 0.14 1.88 0.00 0.00 0.00 179.25 181.75 2bll h TYR 477 N 1.07 0.83 -0.20 0.00 0.05 -0.80 0.83 116.97 118.76 2bll h TYR 477 Ca 0.25 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.95 2bll h TYR 477 Cb 0.17 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.66 2bll h TYR 477 CO 0.01 0.69 0.09 0.78 -1.05 0.00 0.00 178.16 178.69 2bll h GLY 478 N 0.95 0.31 1.00 3.88 0.00 -0.49 0.32 103.07 109.04 2bll h GLY 478 Ca 0.17 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.27 2bll h GLY 478 CO -0.00 0.15 -0.03 0.83 0.00 0.00 0.00 176.54 177.49 2bll h GLU 479 N 0.18 0.84 0.00 4.80 5.08 -0.85 -3.21 114.58 121.42 2bll h GLU 479 Ca 0.07 -0.28 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 2bll h GLU 479 Cb 0.14 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2bll h GLU 479 CO -0.01 0.90 -1.97 1.63 -1.00 0.00 0.00 179.01 178.57 2bll n LYS 480 N -4.34 0.72 -0.03 2.33 4.76 0.26 -4.62 118.16 117.25 2bll n LYS 480 Ca 0.00 -0.13 0.01 0.00 -2.87 0.00 0.00 58.31 55.32 2bll n LYS 480 Cb 0.33 -1.45 0.01 0.00 -1.84 0.00 0.00 35.03 32.07 2bll n LYS 480 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2bll n GLU 481 N -2.30 1.57 -1.88 1.97 4.07 0.11 -5.01 120.64 119.18 2bll n GLU 481 Ca -0.10 -1.17 -0.19 0.00 -0.06 0.00 0.00 57.16 55.64 2bll n GLU 481 Cb 0.66 -0.82 -0.05 0.00 -0.06 0.00 0.00 31.44 31.17 2bll n GLU 481 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2bll n GLY 482 N -0.35 0.90 3.72 8.31 0.00 -1.02 -4.92 105.19 111.83 2bll n GLY 482 Ca 0.01 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 2bll n GLY 482 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bll s LEU 483 N -4.71 4.37 -0.30 0.99 2.96 -1.03 -4.94 118.68 116.02 2bll s LEU 483 Ca 0.00 2.77 -0.21 0.00 -0.22 0.00 0.00 54.13 56.47 2bll s LEU 483 Cb 0.00 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.09 2bll s LEU 483 CO 0.00 -0.92 0.69 -1.58 -1.32 0.00 0.00 176.35 173.21 2bll s GLN 484 N 1.21 3.93 0.06 1.98 0.74 -1.26 -4.28 119.66 122.03 2bll s GLN 484 Ca 0.73 0.41 0.01 0.00 0.05 0.00 0.00 55.36 56.56 2bll s GLN 484 Cb -0.47 -3.73 -0.03 0.00 1.10 0.00 0.00 33.01 29.88 2bll s GLN 484 CO 0.32 -0.60 -0.05 -0.59 -0.55 0.00 0.00 175.29 173.81 2bll s PHE 485 N 2.73 0.62 -0.03 1.67 -0.12 -1.26 -1.46 117.98 120.13 2bll s PHE 485 Ca 0.28 -0.76 0.03 0.00 -0.05 0.00 0.00 56.93 56.42 2bll s PHE 485 Cb -0.15 -0.39 0.00 0.00 -0.63 0.00 0.00 43.02 41.85 2bll s PHE 485 CO 0.12 -0.19 -0.10 0.99 -0.05 0.00 0.00 175.22 175.99 2bll s THR 486 N -2.65 0.87 -0.14 -4.49 2.01 -0.56 -0.64 115.64 110.04 2bll s THR 486 Ca -0.01 -0.41 -0.07 0.00 0.31 0.00 0.00 61.69 61.51 2bll s THR 486 Cb -0.01 -0.77 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 2bll s THR 486 CO -0.04 0.27 0.12 -0.76 -0.69 0.00 0.00 174.62 173.52 2bll s LEU 487 N 0.15 4.24 0.09 4.42 1.43 -0.25 -1.16 118.68 127.61 2bll s LEU 487 Ca -0.03 0.36 0.08 0.00 -1.03 0.00 0.00 54.13 53.51 2bll s LEU 487 Cb -0.09 -2.05 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2bll s LEU 487 CO 0.01 0.33 -0.20 0.72 0.23 0.00 0.00 176.35 177.43 2bll s PHE 488 N -0.56 1.75 -0.29 0.29 -0.12 -0.07 -0.80 117.98 118.17 2bll s PHE 488 Ca 0.12 -0.42 0.02 0.00 -0.05 0.00 0.00 56.93 56.61 2bll s PHE 488 Cb -0.12 -0.97 0.08 0.00 -0.63 0.00 0.00 43.02 41.38 2bll s PHE 488 CO 0.02 0.18 -0.01 1.03 -0.05 0.00 0.00 175.22 176.40 2bll s ARG 489 N -1.82 1.59 0.22 1.99 0.52 0.27 0.27 118.95 122.00 2bll s ARG 489 Ca 0.06 -1.45 -0.30 0.00 -0.52 0.00 0.00 55.73 53.52 2bll s ARG 489 Cb -0.10 -2.84 -0.09 0.00 0.52 0.00 0.00 34.95 32.45 2bll s ARG 489 CO 0.04 -0.78 1.05 -1.25 0.02 0.00 0.00 175.30 174.38 2bll s PRO 490 N 1.15 4.68 -0.41 3.54 0.04 -1.26 -0.31 135.00 142.43 2bll s PRO 490 Ca 0.02 1.68 -0.05 0.00 0.04 0.00 0.00 61.00 62.69 2bll s PRO 490 Cb -0.19 -3.25 0.10 0.00 0.04 0.00 0.00 34.50 31.20 2bll s PRO 490 CO -0.09 0.24 0.22 -0.06 0.04 0.00 0.00 177.00 177.35 2bll s PHE 491 N -0.77 3.49 -1.29 0.56 0.08 -0.33 -4.28 117.98 115.44 2bll s PHE 491 Ca 0.45 -2.12 -0.23 0.00 0.12 0.00 0.00 56.93 55.16 2bll s PHE 491 Cb -0.29 -3.14 0.03 0.00 -0.57 0.00 0.00 43.02 39.05 2bll s PHE 491 CO 0.36 -0.94 0.53 0.09 -0.10 0.00 0.00 175.22 175.16 2bll n ASN 492 N 4.71 -2.88 -4.76 1.36 3.02 -1.26 -3.63 115.26 111.82 2bll n ASN 492 Ca -0.06 -1.23 -0.39 0.00 -0.03 0.00 0.00 54.58 52.87 2bll n ASN 492 Cb 0.42 -2.01 0.01 0.00 -0.61 0.00 0.00 39.78 37.59 2bll n ASN 492 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2bll s TRP 493 N -3.74 2.61 -0.04 3.10 0.52 -1.26 -1.39 118.94 118.75 2bll s TRP 493 Ca 0.35 1.38 -0.25 0.00 0.02 0.00 0.00 56.10 57.59 2bll s TRP 493 Cb -0.18 -3.73 0.05 0.00 -1.15 0.00 0.00 33.47 28.47 2bll s TRP 493 CO 0.96 -2.43 0.55 0.00 0.02 0.00 0.00 176.95 176.05 2bll s MET 494 N -2.50 0.92 0.00 4.98 0.23 -0.18 -0.99 119.30 121.77 2bll s MET 494 Ca 0.62 0.11 0.00 0.00 -1.03 0.00 0.00 55.69 55.39 2bll s MET 494 Cb -0.39 0.43 0.00 0.00 -1.53 0.00 0.00 34.83 33.34 2bll s MET 494 CO 0.49 -0.28 0.00 0.41 -2.03 0.00 0.00 175.02 173.61 2bll n GLY 495 N 1.04 -0.54 3.69 3.16 0.00 -1.26 0.06 105.19 111.35 2bll n GLY 495 Ca -0.20 -0.96 -0.37 0.00 0.00 0.00 0.00 46.02 44.50 2bll n GLY 495 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bll n PRO 496 N 0.00 0.97 -3.36 1.61 -0.02 -1.26 -4.03 135.00 128.91 2bll n PRO 496 Ca 0.00 0.39 -0.18 0.00 -2.02 0.00 0.00 63.50 61.68 2bll n PRO 496 Cb 0.00 -2.43 0.07 0.00 -0.02 0.00 0.00 33.50 31.12 2bll n PRO 496 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2bll n ARG 497 N -1.79 -6.41 -1.66 -0.52 1.74 -1.26 -4.97 116.66 101.79 2bll n ARG 497 Ca 0.15 0.72 -0.41 0.00 -0.77 0.00 0.00 57.85 57.54 2bll n ARG 497 Cb 0.48 -5.40 0.01 0.00 -1.02 0.00 0.00 32.46 26.53 2bll n ARG 497 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2bll n LEU 498 N -4.11 3.35 -4.73 0.55 4.77 -1.26 -3.75 117.00 111.83 2bll n LEU 498 Ca -0.09 1.08 -0.35 0.00 -0.03 0.00 0.00 56.01 56.62 2bll n LEU 498 Cb 0.59 -1.43 0.08 0.00 -2.33 0.00 0.00 43.42 40.33 2bll n LEU 498 CO 0.54 -1.02 0.83 -1.81 -1.33 0.00 0.00 177.39 174.60 2bll s ASP 499 N -0.62 4.45 0.63 -1.43 1.01 -1.26 -4.82 116.67 114.63 2bll s ASP 499 Ca 0.62 2.41 -0.18 0.00 0.71 0.00 0.00 52.55 56.11 2bll s ASP 499 Cb -0.54 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 40.78 2bll s ASP 499 CO 0.58 -2.10 1.26 0.20 0.21 0.00 0.00 175.17 175.32 2bll s ASN 500 N -1.84 4.78 0.41 0.27 0.01 -1.26 -4.92 114.94 112.37 2bll s ASN 500 Ca 0.76 2.52 0.11 0.00 -0.71 0.00 0.00 52.86 55.55 2bll s ASN 500 Cb -0.31 -2.61 0.93 0.00 0.41 0.00 0.00 41.25 39.67 2bll s ASN 500 CO 0.42 -1.88 1.97 0.25 -1.51 0.00 0.00 177.10 176.35 2bll h LEU 501 N 0.60 0.47 -3.53 0.60 5.85 -1.97 -2.01 115.31 115.32 2bll h LEU 501 Ca -0.51 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.08 2bll h LEU 501 Cb 1.32 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 42.18 2bll h LEU 501 CO 0.54 0.29 0.13 0.59 -0.34 0.00 0.00 178.44 179.64 2bll n ASN 502 N -4.48 4.18 -4.75 1.25 3.02 -1.26 -4.86 115.26 108.36 2bll n ASN 502 Ca 0.10 -3.26 -0.40 0.00 -0.03 0.00 0.00 54.58 51.00 2bll n ASN 502 Cb 0.33 -0.67 -0.05 0.00 -0.61 0.00 0.00 39.78 38.78 2bll n ASN 502 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bll s ALA 503 N -2.99 3.38 -0.86 5.41 0.00 -0.76 -4.95 121.76 120.99 2bll s ALA 503 Ca 0.50 0.27 -0.08 0.00 0.00 0.00 0.00 51.96 52.64 2bll s ALA 503 Cb 0.41 -2.97 -0.17 0.00 0.00 0.00 0.00 23.12 20.38 2bll s ALA 503 CO 0.10 0.08 3.27 0.00 0.00 0.00 0.00 175.76 179.21 2bll n ALA 504 N 2.74 7.01 -3.16 0.00 0.00 -1.26 -4.79 120.51 121.06 2bll n ALA 504 Ca -0.03 -2.74 -0.21 0.00 0.00 0.00 0.00 53.44 50.46 2bll n ALA 504 Cb 0.50 -2.87 -0.16 0.00 0.00 0.00 0.00 19.45 16.92 2bll n ALA 504 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2bll s ARG 505 N 1.57 1.07 0.28 0.00 1.81 -1.08 -1.73 118.95 120.86 2bll s ARG 505 Ca 0.68 -0.31 -0.28 0.00 -1.72 0.00 0.00 55.73 54.11 2bll s ARG 505 Cb 0.25 -0.98 -0.09 0.00 -0.45 0.00 0.00 34.95 33.67 2bll s ARG 505 CO -0.03 0.08 0.95 0.42 -0.68 0.00 0.00 175.30 176.04 2bll s ILE 506 N 0.34 4.12 0.00 1.52 1.01 0.93 -4.70 121.20 124.41 2bll s ILE 506 Ca -0.06 1.96 0.00 0.00 0.00 0.00 0.00 60.65 62.55 2bll s ILE 506 Cb -0.10 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.19 2bll s ILE 506 CO 0.01 0.33 0.00 0.61 0.00 0.00 0.00 174.94 175.89 2bll n GLY 507 N 1.06 3.76 3.76 6.18 0.00 -1.26 -4.56 105.19 114.14 2bll n GLY 507 Ca -0.00 -0.56 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 2bll n GLY 507 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bll s SER 508 N 0.00 7.10 -0.29 1.61 1.04 -1.26 -4.13 113.70 117.77 2bll s SER 508 Ca 0.00 1.31 -0.36 0.00 0.48 0.00 0.00 55.95 57.39 2bll s SER 508 Cb 0.00 -2.41 -0.12 0.00 0.10 0.00 0.00 66.02 63.58 2bll s SER 508 CO 0.00 0.09 2.06 -0.24 0.98 0.00 0.00 173.24 176.13 2bll n SER 509 N 2.59 2.40 0.07 7.02 2.88 -0.16 -4.86 113.62 123.57 2bll n SER 509 Ca -0.05 0.63 -0.06 0.00 -1.33 0.00 0.00 58.87 58.06 2bll n SER 509 Cb 0.50 -1.26 0.11 0.00 -0.75 0.00 0.00 64.21 62.82 2bll n SER 509 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2bll h ARG 510 N 10.91 0.29 -0.27 -1.46 -0.00 -1.95 -2.06 114.38 119.84 2bll h ARG 510 Ca -0.34 -0.20 -0.01 0.00 -0.50 0.00 0.00 59.98 58.92 2bll h ARG 510 Cb 1.31 0.03 -0.01 0.00 0.00 0.00 0.00 29.97 31.30 2bll h ARG 510 CO 1.00 0.80 0.12 0.00 0.00 0.00 0.00 179.97 181.89 2bll h ALA 511 N 1.15 0.35 -0.04 0.04 0.00 -2.00 -0.81 119.26 117.95 2bll h ALA 511 Ca -0.01 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 2bll h ALA 511 Cb 1.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2bll h ALA 511 CO 0.10 -0.06 -0.66 -0.84 0.00 0.00 0.00 179.25 177.78 2bll h ILE 512 N 0.29 1.43 -0.78 0.00 -2.65 -1.95 -2.30 117.51 111.55 2bll h ILE 512 Ca 0.09 -2.15 -0.02 0.00 1.03 0.00 0.00 64.86 63.81 2bll h ILE 512 Cb 0.16 2.13 -0.04 0.00 -2.05 0.00 0.00 36.82 37.02 2bll h ILE 512 CO -0.01 0.63 0.40 0.74 0.03 0.00 0.00 178.15 179.94 2bll h THR 513 N 0.12 1.24 0.00 0.16 2.02 -1.18 -0.69 112.91 114.58 2bll h THR 513 Ca -0.01 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 2bll h THR 513 Cb 1.19 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2bll h THR 513 CO 0.10 0.28 -0.00 -0.61 0.37 0.00 0.00 175.52 175.66 2bll h GLN 514 N 1.09 -0.00 -0.58 6.66 5.75 -1.02 -0.70 115.11 126.31 2bll h GLN 514 Ca 0.27 0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.79 2bll h GLN 514 Cb 0.08 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.60 2bll h GLN 514 CO -0.04 0.22 0.36 -0.07 -2.65 0.00 0.00 178.83 176.66 2bll h LEU 515 N -0.22 0.61 -0.89 -2.39 3.38 -1.30 0.14 115.31 114.63 2bll h LEU 515 Ca -0.00 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2bll h LEU 515 Cb 0.22 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2bll h LEU 515 CO 0.00 0.43 0.29 0.40 0.09 0.00 0.00 178.44 179.65 2bll h ILE 516 N 0.73 1.25 -0.68 1.22 2.04 -1.02 -2.26 117.51 118.80 2bll h ILE 516 Ca 0.22 -0.80 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 2bll h ILE 516 Cb -0.02 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 2bll h ILE 516 CO -0.08 0.32 0.41 -0.07 0.00 0.00 0.00 178.15 178.73 2bll h LEU 517 N 1.07 0.81 -0.68 1.44 4.07 -0.38 -0.47 115.31 121.18 2bll h LEU 517 Ca 0.25 -0.06 0.10 0.00 0.08 0.00 0.00 57.88 58.24 2bll h LEU 517 Cb 0.22 -0.21 -0.07 0.00 1.08 0.00 0.00 40.66 41.68 2bll h LEU 517 CO -0.02 0.64 0.31 0.78 -1.08 0.00 0.00 178.44 179.07 2bll h ASN 518 N 0.92 0.38 -0.29 -0.43 2.35 -0.32 0.18 115.58 118.37 2bll h ASN 518 Ca 0.24 0.07 -0.14 0.00 -0.55 0.00 0.00 56.30 55.92 2bll h ASN 518 Cb -0.03 0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 2bll h ASN 518 CO -0.05 0.21 -0.37 -0.07 -1.65 0.00 0.00 177.43 175.51 2bll h LEU 519 N 0.53 0.82 -0.57 1.61 3.38 -0.90 0.77 115.31 120.96 2bll h LEU 519 Ca 0.34 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 2bll h LEU 519 Cb 0.39 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2bll h LEU 519 CO -0.29 1.15 0.29 0.58 0.09 0.00 0.00 178.44 180.26 2bll h VAL 520 N 0.51 1.20 0.00 1.22 2.07 -0.77 -3.11 116.25 117.36 2bll h VAL 520 Ca 0.04 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2bll h VAL 520 Cb 0.95 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2bll h VAL 520 CO 0.09 0.22 -0.38 -0.62 0.02 0.00 0.00 177.57 176.90 2bll n GLU 521 N -4.56 0.27 -2.88 1.57 1.02 0.60 -4.37 120.64 112.30 2bll n GLU 521 Ca 0.03 0.13 -0.16 0.00 -0.02 0.00 0.00 57.16 57.15 2bll n GLU 521 Cb 0.11 -1.72 0.03 0.00 -0.02 0.00 0.00 31.44 29.84 2bll n GLU 521 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bll n GLY 522 N 1.33 -0.12 3.98 0.62 0.00 0.09 -4.82 105.19 106.27 2bll n GLY 522 Ca 0.04 -0.13 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 2bll n GLY 522 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bll s SER 523 N -2.89 5.91 0.56 1.61 1.04 -0.18 -4.49 113.70 115.26 2bll s SER 523 Ca 0.25 -0.08 -0.14 0.00 0.48 0.00 0.00 55.95 56.45 2bll s SER 523 Cb -0.11 -1.27 -0.06 0.00 0.10 0.00 0.00 66.02 64.67 2bll s SER 523 CO 0.31 -0.52 1.01 -2.84 0.98 0.00 0.00 173.24 172.17 2bll s PRO 524 N -4.28 3.79 -0.39 4.02 0.02 -1.26 -4.32 135.00 132.57 2bll s PRO 524 Ca 0.46 0.88 -0.21 0.00 0.02 0.00 0.00 61.00 62.15 2bll s PRO 524 Cb -0.10 -2.11 0.01 0.00 0.02 0.00 0.00 34.50 32.33 2bll s PRO 524 CO 0.33 -0.41 0.66 0.42 -0.33 0.00 0.00 177.00 177.67 2bll s ILE 525 N -2.85 4.84 -0.22 2.83 1.01 -0.23 -4.91 121.20 121.67 2bll s ILE 525 Ca 0.57 0.41 -0.29 0.00 0.00 0.00 0.00 60.65 61.34 2bll s ILE 525 Cb -0.10 -4.15 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 2bll s ILE 525 CO 0.41 -0.46 1.46 -0.54 0.00 0.00 0.00 174.94 175.81 2bll s LYS 526 N 2.82 3.94 -0.80 2.79 1.02 -1.26 -0.19 119.74 128.05 2bll s LYS 526 Ca 0.24 1.58 -0.11 0.00 0.02 0.00 0.00 55.97 57.70 2bll s LYS 526 Cb -0.14 -3.94 0.21 0.00 -0.52 0.00 0.00 37.83 33.44 2bll s LYS 526 CO 0.17 -1.10 0.71 -0.51 -0.92 0.00 0.00 175.35 173.70 2bll s LEU 527 N 4.56 6.41 -0.29 3.17 1.43 0.90 -4.92 118.68 129.95 2bll s LEU 527 Ca 0.64 -2.78 -0.27 0.00 -1.03 0.00 0.00 54.13 50.68 2bll s LEU 527 Cb -0.23 -2.13 -0.06 0.00 0.03 0.00 0.00 46.19 43.81 2bll s LEU 527 CO 0.25 -0.51 2.28 -0.51 0.23 0.00 0.00 176.35 178.09 2bll s ILE 528 N 0.03 3.00 -1.43 -0.59 1.10 -1.26 -1.30 121.20 120.75 2bll s ILE 528 Ca 0.18 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.32 2bll s ILE 528 Cb -0.12 -3.00 0.00 0.00 0.15 0.00 0.00 42.46 39.49 2bll s ILE 528 CO -0.08 -0.00 0.00 0.47 -2.11 0.00 0.00 174.94 173.22 2bll n ASP 529 N 12.89 -4.86 0.00 4.50 8.00 -1.26 -2.58 116.55 133.24 2bll n ASP 529 Ca 0.32 0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.85 2bll n ASP 529 Cb 0.48 -3.95 0.00 0.00 -0.02 0.00 0.00 41.12 37.63 2bll n ASP 529 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bll n GLY 530 N -1.01 0.11 2.92 0.44 0.00 -0.42 -4.56 105.19 102.67 2bll n GLY 530 Ca -0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 2bll n GLY 530 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bll n GLY 531 N -1.97 -0.08 0.13 -0.02 0.00 -1.06 -4.63 105.19 97.54 2bll n GLY 531 Ca 0.00 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.11 2bll n GLY 531 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bll n LYS 532 N -3.57 0.46 -2.30 1.61 4.76 -1.26 -2.01 118.16 115.85 2bll n LYS 532 Ca -0.01 -0.25 -0.41 0.00 -2.87 0.00 0.00 58.31 54.76 2bll n LYS 532 Cb 0.55 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 32.21 2bll n LYS 532 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2bll s GLN 533 N -2.72 4.42 -0.13 1.97 0.00 -1.26 -4.79 119.66 117.16 2bll s GLN 533 Ca 0.19 1.95 -0.06 0.00 -0.00 0.00 0.00 55.36 57.44 2bll s GLN 533 Cb 0.19 -3.24 -0.04 0.00 0.00 0.00 0.00 33.01 29.92 2bll s GLN 533 CO 0.59 -0.21 0.11 0.15 0.00 0.00 0.00 175.29 175.92 2bll s LYS 534 N 0.13 3.49 0.08 9.60 1.02 -0.67 -2.41 119.74 130.98 2bll s LYS 534 Ca 0.56 -0.21 0.01 0.00 0.02 0.00 0.00 55.97 56.36 2bll s LYS 534 Cb -0.34 -3.15 -0.04 0.00 -0.52 0.00 0.00 37.83 33.78 2bll s LYS 534 CO 0.36 0.67 -0.06 1.03 -0.92 0.00 0.00 175.35 176.42 2bll s ARG 535 N -0.73 0.75 0.00 1.68 1.81 0.13 -2.74 118.95 119.85 2bll s ARG 535 Ca 0.13 -1.23 0.03 0.00 -1.72 0.00 0.00 55.73 52.94 2bll s ARG 535 Cb -0.12 -0.14 -0.03 0.00 -0.45 0.00 0.00 34.95 34.21 2bll s ARG 535 CO 0.03 -0.03 -0.05 0.00 -0.68 0.00 0.00 175.30 174.58 2bll s PHE 537 N -1.03 1.16 -0.06 0.00 0.08 -0.62 -4.01 117.98 113.49 2bll s PHE 537 Ca 0.18 -0.22 0.00 0.00 0.12 0.00 0.00 56.93 57.01 2bll s PHE 537 Cb -0.11 -0.75 0.02 0.00 -0.57 0.00 0.00 43.02 41.61 2bll s PHE 537 CO 0.09 -0.02 -0.04 0.99 -0.10 0.00 0.00 175.22 176.13 2bll s THR 538 N -0.30 0.63 0.31 0.64 2.01 -0.48 -4.35 115.64 114.09 2bll s THR 538 Ca 0.05 -0.11 -0.29 0.00 0.31 0.00 0.00 61.69 61.64 2bll s THR 538 Cb -0.05 -0.68 -0.10 0.00 0.01 0.00 0.00 72.50 71.68 2bll s THR 538 CO -0.00 0.27 1.32 -0.62 -0.69 0.00 0.00 174.62 174.89 2bll s ASP 539 N 1.31 6.79 0.51 3.53 2.15 -1.26 -1.01 116.67 128.69 2bll s ASP 539 Ca -0.04 2.65 0.17 0.00 0.43 0.00 0.00 52.55 55.75 2bll s ASP 539 Cb -0.14 -2.64 1.26 0.00 -0.30 0.00 0.00 42.92 41.10 2bll s ASP 539 CO -0.02 -0.54 2.12 -0.29 -0.17 0.00 0.00 175.17 176.27 2bll h ILE 540 N 3.17 0.99 -0.84 4.11 6.09 -0.73 -0.33 117.51 129.97 2bll h ILE 540 Ca -0.48 -0.13 -0.01 0.00 -1.37 0.00 0.00 64.86 62.87 2bll h ILE 540 Cb 1.22 1.07 -0.04 0.00 0.47 0.00 0.00 36.82 39.55 2bll h ILE 540 CO 0.68 0.04 0.49 0.03 -3.07 0.00 0.00 178.15 176.31 2bll h ARG 541 N 0.00 1.14 0.22 2.19 3.08 -1.91 0.30 114.38 119.40 2bll h ARG 541 Ca -0.00 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 2bll h ARG 541 Cb 0.07 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2bll h ARG 541 CO 0.00 0.81 -0.11 -0.44 -1.07 0.00 0.00 179.97 179.17 2bll h ASP 542 N 1.16 -0.25 -0.38 7.04 3.32 -1.61 -2.81 116.42 122.89 2bll h ASP 542 Ca 0.30 -0.27 0.08 0.00 0.02 0.00 0.00 57.03 57.15 2bll h ASP 542 Cb -0.02 0.07 -0.08 0.00 0.22 0.00 0.00 39.33 39.52 2bll h ASP 542 CO -0.05 0.22 -0.16 1.23 -1.72 0.00 0.00 179.24 178.76 2bll h GLY 543 N -0.83 0.15 2.00 2.75 0.00 -1.00 -2.18 103.07 103.95 2bll h GLY 543 Ca -0.03 0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.41 2bll h GLY 543 CO 0.05 -0.18 -0.46 1.19 0.00 0.00 0.00 176.54 177.14 2bll h ILE 544 N -0.09 1.32 -0.51 2.60 6.09 -0.53 -1.01 117.51 125.38 2bll h ILE 544 Ca 0.19 -1.57 -0.01 0.00 -1.37 0.00 0.00 64.86 62.10 2bll h ILE 544 Cb 0.38 1.85 -0.02 0.00 0.47 0.00 0.00 36.82 39.49 2bll h ILE 544 CO -0.44 0.45 0.30 -0.08 -3.07 0.00 0.00 178.15 175.31 2bll h GLU 545 N 0.00 0.71 -0.25 2.19 4.57 -1.21 0.13 114.58 120.71 2bll h GLU 545 Ca -0.00 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2bll h GLU 545 Cb 0.81 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 2bll h GLU 545 CO 0.06 0.53 0.12 0.00 -1.18 0.00 0.00 179.01 178.54 2bll h ALA 546 N 1.13 0.32 -0.70 2.92 0.00 -0.76 -1.09 119.26 121.08 2bll h ALA 546 Ca 0.18 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2bll h ALA 546 Cb 0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2bll h ALA 546 CO -0.03 -0.11 0.19 1.25 0.00 0.00 0.00 179.25 180.55 2bll h LEU 547 N 0.28 1.05 -0.51 0.00 5.85 -0.98 -1.11 115.31 119.88 2bll h LEU 547 Ca 0.09 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.63 2bll h LEU 547 Cb 0.12 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 2bll h LEU 547 CO -0.01 1.00 0.25 0.22 -0.34 0.00 0.00 178.44 179.56 2bll h TYR 548 N 1.05 0.46 -0.46 1.25 3.20 -0.60 -0.56 116.97 121.31 2bll h TYR 548 Ca 0.22 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 2bll h TYR 548 Cb 0.34 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 2bll h TYR 548 CO 0.03 0.22 0.12 0.00 -1.64 0.00 0.00 178.16 176.89 2bll h ARG 549 N 0.49 0.67 -0.62 1.82 3.08 -0.60 -0.58 114.38 118.65 2bll h ARG 549 Ca 0.23 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 2bll h ARG 549 Cb 0.15 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 2bll h ARG 549 CO -0.17 0.60 0.34 0.82 -1.07 0.00 0.00 179.97 180.49 2bll h ILE 550 N 0.66 1.20 -0.32 2.04 2.04 -0.46 0.24 117.51 122.91 2bll h ILE 550 Ca 0.15 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.52 2bll h ILE 550 Cb 0.23 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 2bll h ILE 550 CO -0.01 0.22 0.19 0.40 0.00 0.00 0.00 178.15 178.95 2bll h ILE 551 N 0.84 1.04 -0.97 -0.67 2.04 -0.42 -2.61 117.51 116.77 2bll h ILE 551 Ca 0.22 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.95 2bll h ILE 551 Cb 0.05 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 2bll h ILE 551 CO -0.03 0.07 0.63 -0.33 0.00 0.00 0.00 178.15 178.49 2bll h GLU 552 N 0.39 1.28 -6.23 2.37 4.39 -0.69 -3.47 114.58 112.62 2bll h GLU 552 Ca 0.12 -0.08 -0.45 0.00 0.34 0.00 0.00 59.36 59.29 2bll h GLU 552 Cb -0.01 -0.28 0.00 0.00 -0.10 0.00 0.00 28.75 28.36 2bll h GLU 552 CO -0.05 0.85 -0.80 -1.71 -1.16 0.00 0.00 179.01 176.14 2bll n ASN 553 N -4.40 -2.76 -4.64 1.42 4.05 0.80 -4.86 115.26 104.86 2bll n ASN 553 Ca 0.11 -0.82 -0.58 0.00 0.45 0.00 0.00 54.58 53.74 2bll n ASN 553 Cb 0.02 -3.88 -0.07 0.00 1.23 0.00 0.00 39.78 37.08 2bll n ASN 553 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2bll n ALA 554 N -4.47 -1.21 -0.97 5.20 0.00 -1.26 -0.74 120.51 117.05 2bll n ALA 554 Ca -0.14 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.78 2bll n ALA 554 Cb 0.61 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 18.01 2bll n ALA 554 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bll n GLY 555 N 3.18 0.34 2.44 0.00 0.00 -1.26 -2.40 105.19 107.49 2bll n GLY 555 Ca 0.24 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 2bll n GLY 555 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bll n ASN 556 N -0.35 -4.96 0.13 1.61 3.02 0.08 -4.88 115.26 109.90 2bll n ASN 556 Ca 0.00 0.07 0.13 0.00 -0.03 0.00 0.00 54.58 54.75 2bll n ASN 556 Cb 0.17 -4.16 0.45 0.00 -0.61 0.00 0.00 39.78 35.64 2bll n ASN 556 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2bll h ARG 557 N -0.03 0.00 -0.06 3.52 3.08 -1.63 -2.73 114.38 116.52 2bll h ARG 557 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 2bll h ARG 557 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.35 2bll h ARG 557 CO 0.47 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.37 2bll s ASP 559 N -1.87 6.77 -0.02 0.00 1.01 -1.03 -2.19 116.67 119.34 2bll s ASP 559 Ca 0.37 2.04 0.00 0.00 0.71 0.00 0.00 52.55 55.67 2bll s ASP 559 Cb 0.20 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.59 2bll s ASP 559 CO 0.31 -0.86 0.00 0.61 0.21 0.00 0.00 175.17 175.44 2bll n GLY 560 N 3.94 0.44 3.89 0.21 0.00 0.19 -5.00 105.19 108.85 2bll n GLY 560 Ca 0.16 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 2bll n GLY 560 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bll s GLU 561 N -0.43 3.73 -0.18 1.61 0.41 -0.93 -4.95 118.70 117.96 2bll s GLU 561 Ca 0.00 0.20 -0.01 0.00 -0.41 0.00 0.00 54.97 54.75 2bll s GLU 561 Cb 0.00 -2.60 0.00 0.00 -1.78 0.00 0.00 34.13 29.75 2bll s GLU 561 CO 0.00 0.22 -0.12 0.42 -0.49 0.00 0.00 175.26 175.28 2bll s ILE 562 N -2.02 2.79 -0.20 -1.63 1.01 -1.26 -1.09 121.20 118.80 2bll s ILE 562 Ca 0.47 -0.71 -0.00 0.00 0.00 0.00 0.00 60.65 60.41 2bll s ILE 562 Cb -0.11 -2.21 0.05 0.00 0.01 0.00 0.00 42.46 40.20 2bll s ILE 562 CO 0.26 0.49 -0.05 -0.63 0.00 0.00 0.00 174.94 175.01 2bll s ILE 563 N 1.14 1.26 0.16 2.92 1.01 0.02 -4.83 121.20 122.87 2bll s ILE 563 Ca 0.01 -0.89 -0.31 0.00 0.00 0.00 0.00 60.65 59.46 2bll s ILE 563 Cb -0.14 -1.50 -0.09 0.00 0.01 0.00 0.00 42.46 40.74 2bll s ILE 563 CO -0.04 0.00 1.43 0.20 0.00 0.00 0.00 174.94 176.53 2bll s ASN 564 N 1.54 6.75 -0.32 3.58 0.01 -1.26 -0.56 114.94 124.68 2bll s ASN 564 Ca -0.02 2.45 0.03 0.00 -0.71 0.00 0.00 52.86 54.61 2bll s ASN 564 Cb -0.17 -2.60 0.09 0.00 0.41 0.00 0.00 41.25 38.99 2bll s ASN 564 CO -0.07 -0.68 0.03 -0.63 -1.51 0.00 0.00 177.10 174.24 2bll s ILE 565 N 0.83 2.09 0.30 0.60 1.01 0.58 -4.58 121.20 122.03 2bll s ILE 565 Ca 0.64 -2.13 -0.20 0.00 0.00 0.00 0.00 60.65 58.96 2bll s ILE 565 Cb -0.39 -2.50 0.03 0.00 0.01 0.00 0.00 42.46 39.60 2bll s ILE 565 CO 0.33 -0.53 0.73 -0.83 0.00 0.00 0.00 174.94 174.65 2bll s GLY 566 N 1.02 -0.00 -0.44 6.18 0.00 -1.26 -1.18 107.32 111.63 2bll s GLY 566 Ca 0.08 -0.40 -0.07 0.00 0.00 0.00 0.00 44.72 44.33 2bll s GLY 566 CO -0.09 -0.13 0.29 0.21 0.00 0.00 0.00 173.10 173.37 2bll s ASN 567 N -2.95 5.56 0.44 1.64 3.84 -1.26 -4.83 114.94 117.38 2bll s ASN 567 Ca 0.12 -1.86 0.30 0.00 0.21 0.00 0.00 52.86 51.63 2bll s ASN 567 Cb -0.06 -1.96 1.37 0.00 -0.55 0.00 0.00 41.25 40.05 2bll s ASN 567 CO 0.08 -0.62 1.91 1.55 -2.79 0.00 0.00 177.10 177.22 2bll h PRO 568 N 8.34 0.00 0.00 0.43 0.13 -1.91 -2.19 132.00 136.79 2bll h PRO 568 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2bll h PRO 568 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2bll h PRO 568 CO 0.80 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.50 2bll h GLU 569 N 0.00 0.00 -2.41 0.86 5.08 -1.94 -3.36 114.58 112.81 2bll h GLU 569 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 2bll h GLU 569 Cb 0.32 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.47 2bll h GLU 569 CO 0.00 0.00 1.65 0.09 -1.00 0.00 0.00 179.01 179.75 2bll n ASN 570 N -2.66 7.29 -4.80 1.42 4.13 -0.82 -4.95 115.26 114.85 2bll n ASN 570 Ca 0.05 -2.95 -0.38 0.00 1.68 0.00 0.00 54.58 52.98 2bll n ASN 570 Cb 0.47 -1.37 -0.06 0.00 -1.54 0.00 0.00 39.78 37.28 2bll n ASN 570 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2bll s GLU 571 N -0.38 4.00 -0.12 3.52 2.12 -1.26 -1.59 118.70 124.98 2bll s GLU 571 Ca 0.60 0.29 -0.22 0.00 0.36 0.00 0.00 54.97 56.00 2bll s GLU 571 Cb 0.26 -3.29 0.05 0.00 0.26 0.00 0.00 34.13 31.41 2bll s GLU 571 CO -0.11 0.52 0.55 0.00 -0.54 0.00 0.00 175.26 175.68 2bll s ALA 572 N -0.48 -1.40 0.77 6.30 0.00 -0.01 -4.97 121.76 121.97 2bll s ALA 572 Ca 0.22 1.26 -0.11 0.00 0.00 0.00 0.00 51.96 53.33 2bll s ALA 572 Cb -0.15 -0.44 0.05 0.00 0.00 0.00 0.00 23.12 22.58 2bll s ALA 572 CO 0.10 -0.30 1.10 -1.54 0.00 0.00 0.00 175.76 175.12 2bll s SER 573 N -0.49 4.48 0.37 0.00 1.04 -1.26 -0.70 113.70 117.14 2bll s SER 573 Ca -0.06 1.88 0.08 0.00 0.48 0.00 0.00 55.95 58.33 2bll s SER 573 Cb -0.03 -2.53 0.81 0.00 0.10 0.00 0.00 66.02 64.37 2bll s SER 573 CO 0.04 -2.06 1.92 0.40 0.98 0.00 0.00 173.24 174.53 2bll h ILE 574 N -1.02 0.92 0.17 -1.02 1.08 -1.24 0.08 117.51 116.49 2bll h ILE 574 Ca -0.44 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 2bll h ILE 574 Cb 1.24 0.17 -0.02 0.00 -3.07 0.00 0.00 36.82 35.14 2bll h ILE 574 CO 0.51 0.13 -0.18 -0.08 -0.69 0.00 0.00 178.15 177.84 2bll h GLU 575 N 0.69 -0.37 -0.62 2.37 4.81 -1.66 0.69 114.58 120.49 2bll h GLU 575 Ca 0.37 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.57 2bll h GLU 575 Cb 0.51 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 2bll h GLU 575 CO -0.14 -0.25 0.14 0.93 -0.73 0.00 0.00 179.01 178.96 2bll h GLU 576 N -0.38 0.98 -0.48 1.92 5.08 -1.61 -0.64 114.58 119.44 2bll h GLU 576 Ca 0.00 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 2bll h GLU 576 Cb 0.36 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2bll h GLU 576 CO -0.05 0.87 0.21 1.25 -1.00 0.00 0.00 179.01 180.30 2bll h LEU 577 N 0.93 0.65 -0.28 1.33 6.46 -0.92 0.69 115.31 124.18 2bll h LEU 577 Ca 0.20 -0.15 0.06 0.00 -0.12 0.00 0.00 57.88 57.87 2bll h LEU 577 Cb 0.34 -0.17 -0.08 0.00 -0.73 0.00 0.00 40.66 40.03 2bll h LEU 577 CO 0.00 0.62 -0.42 1.23 -0.62 0.00 0.00 178.44 179.25 2bll h GLY 578 N 0.64 -0.62 1.06 3.75 0.00 -0.36 -0.66 103.07 106.88 2bll h GLY 578 Ca 0.16 0.53 -0.05 0.00 0.00 0.00 0.00 47.33 47.97 2bll h GLY 578 CO -0.02 -0.20 0.28 0.83 0.00 0.00 0.00 176.54 177.43 2bll h GLU 579 N -0.40 1.19 -0.31 4.80 4.39 -0.72 -1.29 114.58 122.24 2bll h GLU 579 Ca 0.11 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.58 2bll h GLU 579 Cb 0.60 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 2bll h GLU 579 CO -0.49 0.98 0.20 0.52 -1.16 0.00 0.00 179.01 179.06 2bll h MET 580 N 1.15 0.42 -0.34 2.33 2.86 -0.65 -0.69 114.93 120.01 2bll h MET 580 Ca 0.26 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 2bll h MET 580 Cb 0.26 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.81 2bll h MET 580 CO -0.01 0.30 0.22 -0.07 1.06 0.00 0.00 176.91 178.41 2bll h LEU 581 N 0.42 0.39 -0.50 1.22 3.38 -0.93 -1.62 115.31 117.65 2bll h LEU 581 Ca 0.11 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.09 2bll h LEU 581 Cb -0.02 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2bll h LEU 581 CO -0.02 0.28 0.31 0.25 0.09 0.00 0.00 178.44 179.35 2bll h LEU 582 N 0.46 0.52 -0.45 1.67 5.85 -1.06 0.27 115.31 122.58 2bll h LEU 582 Ca 0.13 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.85 2bll h LEU 582 Cb -0.05 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 2bll h LEU 582 CO -0.03 0.37 0.29 0.00 -0.34 0.00 0.00 178.44 178.73 2bll h ALA 583 N 1.21 0.57 -0.48 1.25 0.00 -1.00 -0.08 119.26 120.73 2bll h ALA 583 Ca 0.19 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2bll h ALA 583 Cb -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2bll h ALA 583 CO -0.07 -0.00 -0.09 1.03 0.00 0.00 0.00 179.25 180.12 2bll h SER 584 N 0.59 0.85 0.31 0.00 0.87 -0.60 -2.66 113.55 112.90 2bll h SER 584 Ca 0.17 -0.25 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 2bll h SER 584 Cb -0.04 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.69 2bll h SER 584 CO -0.05 0.96 -0.17 0.15 -0.53 0.00 0.00 176.83 177.19 2bll h PHE 585 N 0.78 -0.44 0.00 2.24 3.57 -0.10 -2.80 116.94 120.18 2bll h PHE 585 Ca 0.13 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 2bll h PHE 585 Cb 0.59 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 2bll h PHE 585 CO 0.03 -0.27 -0.19 0.93 -2.23 0.00 0.00 178.31 176.59 2bll h GLU 586 N -0.45 0.00 0.00 1.11 4.39 -0.97 -0.17 114.58 118.49 2bll h GLU 586 Ca -0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2bll h GLU 586 Cb 0.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 2bll h GLU 586 CO 0.05 0.19 0.00 1.17 -1.16 0.00 0.00 179.01 179.25 2bll n LYS 587 N -4.29 0.05 -2.84 2.33 4.81 -1.01 -4.91 118.16 112.30 2bll n LYS 587 Ca -0.02 0.07 -0.40 0.00 -0.87 0.00 0.00 58.31 57.08 2bll n LYS 587 Cb 0.25 -1.57 -0.05 0.00 0.02 0.00 0.00 35.03 33.68 2bll n LYS 587 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 2bll s HIS 588 N -3.03 3.85 0.64 5.64 2.46 -0.08 -4.94 115.29 119.83 2bll s HIS 588 Ca 0.13 1.72 0.44 0.00 0.47 0.00 0.00 55.06 57.81 2bll s HIS 588 Cb 0.17 -2.93 2.40 0.00 -0.13 0.00 0.00 32.58 32.09 2bll s HIS 588 CO 0.52 0.33 2.36 -1.00 -2.47 0.00 0.00 174.74 174.48 2bll h PRO 589 N 5.08 0.00 -0.66 2.88 0.13 -1.91 -1.80 132.00 135.71 2bll h PRO 589 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2bll h PRO 589 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2bll h PRO 589 CO 0.70 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.75 2bll n LEU 590 N -3.06 3.85 -0.06 1.56 4.32 -1.26 -4.60 117.00 117.74 2bll n LEU 590 Ca -0.03 -2.04 0.07 0.00 -0.02 0.00 0.00 56.01 53.99 2bll n LEU 590 Cb 0.07 -0.45 0.43 0.00 -1.62 0.00 0.00 43.42 41.85 2bll n LEU 590 CO 0.20 0.94 1.18 -0.09 -1.22 0.00 0.00 177.39 178.40 2bll h ARG 591 N 3.89 0.54 0.00 3.23 1.12 -1.57 -2.40 114.38 119.20 2bll h ARG 591 Ca 0.00 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 58.84 2bll h ARG 591 Cb 0.98 -0.12 0.00 0.00 -0.01 0.00 0.00 29.97 30.82 2bll h ARG 591 CO 0.02 0.36 0.00 -2.39 -3.11 0.00 0.00 179.97 174.84 2bll n HIS 592 N -4.47 0.52 1.66 2.20 1.44 -1.26 -1.24 115.22 114.07 2bll n HIS 592 Ca 0.07 0.23 0.15 0.00 -2.01 0.00 0.00 57.72 56.16 2bll n HIS 592 Cb 0.18 -0.88 0.83 0.00 0.12 0.00 0.00 29.99 30.24 2bll n HIS 592 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2bll n HIS 593 N -2.00 0.00 -4.39 -1.40 8.25 -0.90 -4.88 115.22 109.90 2bll n HIS 593 Ca 0.01 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.24 2bll n HIS 593 Cb 0.12 -0.13 -0.11 0.00 1.12 0.00 0.00 29.99 30.99 2bll n HIS 593 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2bll s PHE 594 N -2.27 2.02 0.98 4.41 0.40 -0.37 -5.13 117.98 118.03 2bll s PHE 594 Ca 0.37 -0.43 -0.12 0.00 -0.60 0.00 0.00 56.93 56.15 2bll s PHE 594 Cb 0.20 -0.95 0.18 0.00 0.51 0.00 0.00 43.02 42.96 2bll s PHE 594 CO 0.40 0.48 1.10 -2.14 0.70 0.00 0.00 175.22 175.75 2bll s PRO 595 N -3.15 0.59 0.92 0.24 0.02 -1.26 -4.99 135.00 127.36 2bll s PRO 595 Ca 0.22 0.50 -0.10 0.00 0.02 0.00 0.00 61.00 61.63 2bll s PRO 595 Cb -0.05 -1.76 0.15 0.00 0.02 0.00 0.00 34.50 32.86 2bll s PRO 595 CO 0.10 -2.62 1.13 -2.14 -0.33 0.00 0.00 177.00 173.13 2bll s PRO 596 N -5.01 1.02 -0.12 5.54 0.02 -1.26 -4.79 135.00 130.40 2bll s PRO 596 Ca 0.65 1.42 -0.29 0.00 0.02 0.00 0.00 61.00 62.79 2bll s PRO 596 Cb -0.18 -1.74 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 2bll s PRO 596 CO 0.57 -2.58 1.60 0.12 -0.33 0.00 0.00 177.00 176.37 2bll s PHE 597 N -2.68 2.12 -0.39 6.54 5.36 -1.26 -4.69 117.98 122.99 2bll s PHE 597 Ca 0.66 0.40 0.26 0.00 -0.96 0.00 0.00 56.93 57.30 2bll s PHE 597 Cb -0.22 -3.87 0.98 0.00 -0.34 0.00 0.00 43.02 39.56 2bll s PHE 597 CO 0.58 -3.31 1.78 0.00 -1.46 0.00 0.00 175.22 172.81 2bll h ALA 598 N 9.73 1.00 0.00 11.12 0.00 -1.79 -3.49 119.26 135.83 2bll h ALA 598 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2bll h ALA 598 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2bll h ALA 598 CO 0.97 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.63 2bll n GLY 599 N 0.39 2.12 3.75 0.00 0.00 -1.26 -4.74 105.19 105.45 2bll n GLY 599 Ca 0.03 -2.01 -0.40 0.00 0.00 0.00 0.00 46.02 43.63 2bll n GLY 599 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bll s PHE 600 N -2.36 3.89 -0.19 1.61 0.40 -1.26 -1.07 117.98 119.00 2bll s PHE 600 Ca 0.00 1.77 0.00 0.00 -0.60 0.00 0.00 56.93 58.11 2bll s PHE 600 Cb 0.00 -2.94 0.04 0.00 0.51 0.00 0.00 43.02 40.63 2bll s PHE 600 CO 0.00 0.37 -0.08 0.50 0.70 0.00 0.00 175.22 176.71 2bll s ARG 601 N -0.67 1.79 -0.14 0.44 3.52 0.73 -4.91 118.95 119.71 2bll s ARG 601 Ca 0.42 -0.74 -0.29 0.00 -0.13 0.00 0.00 55.73 54.98 2bll s ARG 601 Cb -0.24 -2.29 -0.01 0.00 -1.56 0.00 0.00 34.95 30.86 2bll s ARG 601 CO 0.29 -0.44 1.05 0.54 -0.81 0.00 0.00 175.30 175.93 2bll s VAL 602 N 1.48 4.67 0.00 7.11 0.11 -1.26 -0.07 120.40 132.44 2bll s VAL 602 Ca -0.01 1.97 0.00 0.00 -2.93 0.00 0.00 61.98 61.01 2bll s VAL 602 Cb -0.16 -4.27 0.00 0.00 -1.53 0.00 0.00 36.38 30.42 2bll s VAL 602 CO -0.08 -0.06 0.00 0.52 -3.33 0.00 0.00 175.10 172.15 2bll n VAL 603 N 4.84 0.00 -0.05 2.04 0.31 -0.59 -4.92 118.33 119.96 2bll n VAL 603 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 2bll n VAL 603 Cb 0.47 -0.46 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 2bll n VAL 603 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2bll n VAL 616 N -1.75 -0.00 0.63 2.52 0.31 -1.26 -4.28 118.33 114.50 2bll n VAL 616 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.45 2bll n VAL 616 Cb 0.00 -0.04 0.14 0.00 -0.91 0.00 0.00 33.84 33.04 2bll n VAL 616 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2bll n GLU 617 N 1.46 0.25 -3.57 5.55 1.02 -1.26 -4.72 120.64 119.37 2bll n GLU 617 Ca 0.00 0.05 -0.17 0.00 -0.02 0.00 0.00 57.16 57.02 2bll n GLU 617 Cb 0.00 -1.64 -0.07 0.00 -0.02 0.00 0.00 31.44 29.72 2bll n GLU 617 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 2bll s HIS 618 N -3.15 -0.64 -0.49 -0.32 -3.43 -1.26 -1.67 115.29 104.33 2bll s HIS 618 Ca 0.06 1.22 0.06 0.00 -0.80 0.00 0.00 55.06 55.60 2bll s HIS 618 Cb 0.14 0.35 0.21 0.00 -1.43 0.00 0.00 32.58 31.85 2bll s HIS 618 CO 0.74 -0.53 0.75 -2.13 -2.00 0.00 0.00 174.74 171.57 2bll n ARG 619 N 1.35 0.61 -4.46 -0.38 0.63 -1.11 -4.96 116.66 108.34 2bll n ARG 619 Ca -0.18 -2.06 -0.34 0.00 -0.92 0.00 0.00 57.85 54.35 2bll n ARG 619 Cb 0.57 -1.47 -0.14 0.00 0.45 0.00 0.00 32.46 31.87 2bll n ARG 619 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2bll s LYS 620 N 0.65 3.47 0.20 -0.14 2.20 -1.26 -3.78 119.74 121.08 2bll s LYS 620 Ca 0.31 -0.62 -0.28 0.00 -0.36 0.00 0.00 55.97 55.02 2bll s LYS 620 Cb 0.10 -2.80 -0.08 0.00 -1.51 0.00 0.00 37.83 33.53 2bll s LYS 620 CO -0.14 0.13 0.87 -1.25 -0.36 0.00 0.00 175.35 174.60 2bll s PRO 621 N 0.61 4.73 0.19 4.03 0.04 -1.26 0.07 135.00 143.40 2bll s PRO 621 Ca -0.05 1.34 -0.30 0.00 0.04 0.00 0.00 61.00 62.03 2bll s PRO 621 Cb -0.15 -3.28 -0.09 0.00 0.04 0.00 0.00 34.50 31.02 2bll s PRO 621 CO 0.03 0.53 1.39 0.45 0.04 0.00 0.00 177.00 179.43 2bll s SER 622 N -1.10 6.78 -0.14 6.66 0.15 -0.41 -4.66 113.70 120.98 2bll s SER 622 Ca 0.39 2.48 0.19 0.00 0.70 0.00 0.00 55.95 59.70 2bll s SER 622 Cb -0.25 -2.61 0.33 0.00 -1.71 0.00 0.00 66.02 61.78 2bll s SER 622 CO 0.29 -0.63 1.19 2.30 1.20 0.00 0.00 173.24 177.59 2bll n ILE 623 N 2.98 1.95 -0.35 6.45 -5.35 -1.26 -4.65 119.36 119.13 2bll n ILE 623 Ca 0.08 -2.23 -0.00 0.00 -0.27 0.00 0.00 62.75 60.33 2bll n ILE 623 Cb 0.42 -0.24 0.15 0.00 -1.74 0.00 0.00 39.64 38.22 2bll n ILE 623 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 2bll h ARG 624 N 0.28 1.22 -0.82 6.28 3.08 -1.93 -0.43 114.38 122.06 2bll h ARG 624 Ca 0.00 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 2bll h ARG 624 Cb 1.07 -0.28 -0.04 0.00 0.08 0.00 0.00 29.97 30.80 2bll h ARG 624 CO 0.03 0.81 0.37 -0.91 -1.07 0.00 0.00 179.97 179.20 2bll h ASN 625 N 1.26 1.10 -0.47 7.04 4.21 -1.91 0.72 115.58 127.53 2bll h ASN 625 Ca 0.37 -0.15 -0.13 0.00 1.21 0.00 0.00 56.30 57.60 2bll h ASN 625 Cb -0.06 -0.28 -0.01 0.00 -1.12 0.00 0.00 38.32 36.85 2bll h ASN 625 CO -0.10 0.94 -0.23 0.00 -1.29 0.00 0.00 177.43 176.75 2bll h ALA 626 N 1.20 0.69 0.00 -0.83 0.00 -1.73 0.51 119.26 119.11 2bll h ALA 626 Ca 0.28 -0.40 0.02 0.00 0.00 0.00 0.00 54.91 54.81 2bll h ALA 626 Cb 0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2bll h ALA 626 CO -0.03 0.68 -0.13 0.45 0.00 0.00 0.00 179.25 180.22 2bll h HIS 627 N 0.85 -0.32 0.17 0.00 3.86 -0.67 -1.37 115.15 117.67 2bll h HIS 627 Ca 0.11 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 2bll h HIS 627 Cb 0.81 0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.42 2bll h HIS 627 CO 0.05 -0.19 -0.08 -0.09 0.86 0.00 0.00 177.93 178.48 2bll h ARG 628 N -0.22 -0.22 0.11 2.45 2.43 -0.68 -2.08 114.38 116.17 2bll h ARG 628 Ca 0.04 0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 58.96 2bll h ARG 628 Cb 0.27 0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2bll h ARG 628 CO -0.12 0.11 -1.18 0.00 -1.51 0.00 0.00 179.97 177.26 2bll n LEU 630 N -3.59 0.77 -4.02 0.00 4.77 -0.54 -4.72 117.00 109.67 2bll n LEU 630 Ca -0.08 -0.65 -0.28 0.00 -0.03 0.00 0.00 56.01 54.96 2bll n LEU 630 Cb 0.98 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.05 2bll n LEU 630 CO 0.54 0.17 -0.17 0.47 -1.33 0.00 0.00 177.39 177.06 2bll n ASP 631 N -0.69 -1.26 -4.36 -1.43 8.00 -0.78 -4.95 116.55 111.07 2bll n ASP 631 Ca 0.03 -1.00 -0.32 0.00 0.71 0.00 0.00 54.79 54.21 2bll n ASP 631 Cb 0.15 -3.00 -0.15 0.00 -0.02 0.00 0.00 41.12 38.10 2bll n ASP 631 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2bll s TRP 632 N -3.77 2.49 -0.00 1.24 -0.00 -1.11 -4.98 118.94 112.81 2bll s TRP 632 Ca 0.22 -0.40 -0.08 0.00 -0.00 0.00 0.00 56.10 55.84 2bll s TRP 632 Cb -0.12 -1.57 0.00 0.00 -0.00 0.00 0.00 33.47 31.78 2bll s TRP 632 CO 0.90 0.00 0.16 -1.83 -0.00 0.00 0.00 176.95 176.18 2bll s GLU 633 N -0.54 0.50 0.34 5.86 -1.05 -1.26 -3.75 118.70 118.79 2bll s GLU 633 Ca 0.08 -0.35 -0.28 0.00 -0.15 0.00 0.00 54.97 54.26 2bll s GLU 633 Cb -0.11 0.21 -0.10 0.00 -0.44 0.00 0.00 34.13 33.69 2bll s GLU 633 CO 0.00 -0.12 1.23 -1.25 0.95 0.00 0.00 175.26 176.08 2bll s PRO 634 N -1.33 4.30 -0.01 -4.83 0.05 -1.26 -4.96 135.00 126.97 2bll s PRO 634 Ca -0.14 2.04 0.08 0.00 0.05 0.00 0.00 61.00 63.03 2bll s PRO 634 Cb -0.07 -2.97 -0.12 0.00 0.05 0.00 0.00 34.50 31.39 2bll s PRO 634 CO 0.02 -0.17 0.21 1.63 0.05 0.00 0.00 177.00 178.74 2bll n LYS 635 N 0.64 1.15 -3.52 4.56 5.02 -1.26 -4.99 118.16 119.75 2bll n LYS 635 Ca 0.01 -0.06 -0.38 0.00 -2.02 0.00 0.00 58.31 55.86 2bll n LYS 635 Cb 0.44 -1.12 -0.10 0.00 -0.02 0.00 0.00 35.03 34.22 2bll n LYS 635 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2bll s ILE 636 N -2.39 5.27 0.74 -0.18 -1.09 -1.26 -5.09 121.20 117.21 2bll s ILE 636 Ca -0.02 0.33 -0.15 0.00 -2.23 0.00 0.00 60.65 58.59 2bll s ILE 636 Cb 0.05 -3.59 0.04 0.00 -1.58 0.00 0.00 42.46 37.39 2bll s ILE 636 CO 0.33 0.24 1.23 1.51 -1.23 0.00 0.00 174.94 177.02 2bll s ASP 637 N 1.56 4.06 0.30 3.58 -4.77 -1.26 -4.80 116.67 115.34 2bll s ASP 637 Ca 0.10 2.42 0.02 0.00 -3.30 0.00 0.00 52.55 51.80 2bll s ASP 637 Cb -0.15 -2.60 0.75 0.00 -1.09 0.00 0.00 42.92 39.83 2bll s ASP 637 CO 0.09 -2.36 1.60 0.24 0.70 0.00 0.00 175.17 175.45 2bll h MET 638 N -0.33 0.07 -0.14 2.11 2.86 -1.92 -2.69 114.93 114.89 2bll h MET 638 Ca -0.48 -0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 56.97 2bll h MET 638 Cb 1.31 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.96 2bll h MET 638 CO 0.49 0.05 -0.65 0.37 1.06 0.00 0.00 176.91 178.23 2bll h GLN 639 N 0.07 0.69 -0.41 1.72 5.75 -1.99 -1.54 115.11 119.40 2bll h GLN 639 Ca 0.58 -0.55 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 2bll h GLN 639 Cb 1.22 0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.86 2bll h GLN 639 CO -0.81 1.17 -0.09 1.49 -2.65 0.00 0.00 178.83 177.94 2bll h GLU 640 N 0.37 0.72 -0.28 1.69 4.81 -1.86 -1.21 114.58 118.82 2bll h GLU 640 Ca -0.04 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 58.89 2bll h GLU 640 Cb 1.29 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 2bll h GLU 640 CO 0.14 0.79 -0.10 0.00 -0.73 0.00 0.00 179.01 179.10 2bll h THR 641 N 0.65 1.29 0.10 0.32 1.03 -1.39 -1.10 112.91 113.82 2bll h THR 641 Ca 0.12 -1.17 0.01 0.00 -0.01 0.00 0.00 66.41 65.36 2bll h THR 641 Cb 0.54 1.47 -0.02 0.00 -1.07 0.00 0.00 68.15 69.07 2bll h THR 641 CO 0.03 0.37 -0.17 0.40 -0.01 0.00 0.00 175.52 176.14 2bll h ILE 642 N 0.30 0.60 -0.88 0.00 1.08 -1.23 0.57 117.51 117.96 2bll h ILE 642 Ca 0.07 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.53 2bll h ILE 642 Cb 0.60 0.60 -0.04 0.00 -3.07 0.00 0.00 36.82 34.91 2bll h ILE 642 CO 0.03 0.00 0.54 0.44 -0.69 0.00 0.00 178.15 178.48 2bll h ASP 643 N -0.34 1.04 -0.14 1.72 5.19 -1.22 -1.22 116.42 121.46 2bll h ASP 643 Ca 0.02 -0.06 -0.23 0.00 -0.62 0.00 0.00 57.03 56.15 2bll h ASP 643 Cb 0.36 -0.26 0.01 0.00 0.18 0.00 0.00 39.33 39.61 2bll h ASP 643 CO -0.10 0.79 -0.81 -0.08 -3.12 0.00 0.00 179.24 175.93 2bll h GLU 644 N 1.20 0.80 -0.11 3.56 4.81 -0.92 -1.55 114.58 122.37 2bll h GLU 644 Ca 0.32 -0.67 -0.01 0.00 -0.13 0.00 0.00 59.36 58.87 2bll h GLU 644 Cb -0.07 0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 2bll h GLU 644 CO -0.06 1.27 0.04 1.15 -0.73 0.00 0.00 179.01 180.68 2bll h THR 645 N 0.54 1.15 -0.11 0.32 2.02 -0.74 -2.45 112.91 113.64 2bll h THR 645 Ca -0.06 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 2bll h THR 645 Cb 1.44 1.25 -0.00 0.00 -1.74 0.00 0.00 68.15 69.10 2bll h THR 645 CO 0.17 0.14 0.04 0.25 0.37 0.00 0.00 175.52 176.49 2bll h LEU 646 N 0.02 0.15 0.18 2.58 5.85 -1.27 -2.34 115.31 120.49 2bll h LEU 646 Ca 0.04 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.61 2bll h LEU 646 Cb 0.18 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2bll h LEU 646 CO -0.00 0.27 -0.41 -0.78 -0.34 0.00 0.00 178.44 177.17 2bll h ASP 647 N 0.02 -1.20 -0.88 1.25 3.58 -1.25 -0.58 116.42 117.36 2bll h ASP 647 Ca 0.04 0.13 0.11 0.00 0.42 0.00 0.00 57.03 57.73 2bll h ASP 647 Cb 0.16 0.44 -0.08 0.00 1.72 0.00 0.00 39.33 41.58 2bll h ASP 647 CO -0.00 -0.50 0.51 0.15 -2.88 0.00 0.00 179.24 176.52 2bll h PHE 648 N -0.69 0.92 0.25 0.28 3.57 -1.50 -1.37 116.94 118.40 2bll h PHE 648 Ca 0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 2bll h PHE 648 Cb 0.69 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.15 2bll h PHE 648 CO -0.33 0.34 -0.12 0.35 -2.23 0.00 0.00 178.31 176.32 2bll h PHE 649 N 0.81 -0.31 -0.77 0.41 3.57 -0.80 -2.77 116.94 117.08 2bll h PHE 649 Ca 0.44 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.96 2bll h PHE 649 Cb 0.47 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.27 2bll h PHE 649 CO -0.05 -0.14 0.50 -0.07 -2.23 0.00 0.00 178.31 176.32 2bll h LEU 650 N -0.40 0.84 -1.99 0.59 3.38 -0.89 -2.21 115.31 114.63 2bll h LEU 650 Ca -0.03 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2bll h LEU 650 Cb 0.31 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2bll h LEU 650 CO 0.06 0.60 -0.00 0.03 0.09 0.00 0.00 178.44 179.21 2bll h ARG 651 N 0.99 0.00 -0.01 1.13 3.08 -1.17 -2.91 114.38 115.49 2bll h ARG 651 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2bll h ARG 651 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.00 2bll h ARG 651 CO -0.09 0.00 -0.34 0.25 -1.07 0.00 0.00 179.97 178.73 2bll n THR 652 N -3.10 0.00 -1.69 2.04 -2.24 -0.94 -4.94 114.28 103.41 2bll n THR 652 Ca -0.01 -0.33 -0.44 0.00 -2.27 0.00 0.00 64.05 61.00 2bll n THR 652 Cb 0.23 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.53 2bll n THR 652 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2bll n VAL 653 N -0.52 0.59 -2.63 2.28 0.31 -0.88 -4.94 118.33 112.54 2bll n VAL 653 Ca 0.04 -0.15 -0.42 0.00 -0.01 0.00 0.00 64.34 63.80 2bll n VAL 653 Cb 0.24 -1.67 -0.03 0.00 -0.91 0.00 0.00 33.84 31.46 2bll n VAL 653 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2bll s ASP 654 N 0.62 6.44 0.47 4.52 -1.08 -1.26 -4.92 116.67 121.45 2bll s ASP 654 Ca 0.71 0.05 0.26 0.00 -0.52 0.00 0.00 52.55 53.05 2bll s ASP 654 Cb -0.60 -2.53 0.87 0.00 -1.46 0.00 0.00 42.92 39.20 2bll s ASP 654 CO 0.44 -1.42 1.80 -0.07 0.52 0.00 0.00 175.17 176.43 2bll h LEU 655 N 11.72 0.00 -0.31 -1.34 3.38 -1.96 -2.25 115.31 124.55 2bll h LEU 655 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2bll h LEU 655 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2bll h LEU 655 CO 1.17 0.12 0.00 0.71 0.09 0.00 0.00 178.44 180.53 2bll h THR 656 N 0.00 0.00 0.00 0.22 1.35 -2.03 -3.54 112.91 108.91 2bll h THR 656 Ca -0.00 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 2bll h THR 656 Cb 0.78 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2bll h THR 656 CO 0.02 0.00 0.00 -0.67 -0.25 0.00 0.00 175.52 174.62