#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c0m s GLY 286 N 0.00 0.81 0.00 0.72 0.00 -1.26 -5.01 107.32 102.58 2c0m s GLY 286 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.02 2c0m s GLY 286 CO 0.00 -0.57 0.00 2.98 0.00 0.00 0.00 173.10 175.51 2c0m n TYR 287 N 2.72 0.00 -3.28 1.90 9.36 -1.26 -4.93 117.16 121.66 2c0m n TYR 287 Ca -0.15 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.64 2c0m n TYR 287 Cb 0.54 0.00 -0.08 0.00 -0.63 0.00 0.00 39.34 39.17 2c0m n TYR 287 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 2c0m s GLN 288 N 0.00 3.10 0.29 2.98 -0.21 -1.26 -5.06 119.66 119.50 2c0m s GLN 288 Ca 0.00 -0.82 -0.29 0.00 0.02 0.00 0.00 55.36 54.27 2c0m s GLN 288 Cb 0.00 -4.01 -0.10 0.00 1.00 0.00 0.00 33.01 29.90 2c0m s GLN 288 CO 0.00 -0.95 1.45 -0.06 -2.12 0.00 0.00 175.29 173.61 2c0m s PHE 289 N 2.23 2.90 -0.38 0.91 0.40 -1.26 -4.88 117.98 117.90 2c0m s PHE 289 Ca 0.13 1.07 -0.27 0.00 -0.60 0.00 0.00 56.93 57.26 2c0m s PHE 289 Cb -0.18 -3.88 -0.07 0.00 0.51 0.00 0.00 43.02 39.41 2c0m s PHE 289 CO 0.13 -2.75 2.33 -1.91 0.70 0.00 0.00 175.22 173.72 2c0m n GLU 290 N 1.71 1.41 -2.50 0.44 4.07 -1.26 -4.90 120.64 119.61 2c0m n GLU 290 Ca 0.05 0.24 -0.39 0.00 -0.06 0.00 0.00 57.16 57.00 2c0m n GLU 290 Cb 0.40 -3.28 -0.04 0.00 -0.06 0.00 0.00 31.44 28.46 2c0m n GLU 290 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2c0m s GLU 291 N 7.40 4.42 -0.44 5.31 2.02 -1.26 -3.75 118.70 132.40 2c0m s GLU 291 Ca 1.01 1.68 -0.05 0.00 0.02 0.00 0.00 54.97 57.62 2c0m s GLU 291 Cb -0.30 -2.90 0.01 0.00 0.10 0.00 0.00 34.13 31.04 2c0m s GLU 291 CO 0.31 0.05 0.48 -0.85 0.02 0.00 0.00 175.26 175.27 2c0m n GLU 292 N 0.63 -1.31 -3.61 1.61 -0.00 -1.26 -5.03 120.64 111.66 2c0m n GLU 292 Ca 0.02 1.43 -0.40 0.00 -0.00 0.00 0.00 57.16 58.21 2c0m n GLU 292 Cb 0.47 -4.58 -0.11 0.00 -0.00 0.00 0.00 31.44 27.23 2c0m n GLU 292 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 2c0m s ASN 293 N -2.48 5.64 0.42 -1.84 3.84 -1.25 -4.99 114.94 114.28 2c0m s ASN 293 Ca 0.08 -1.32 0.29 0.00 0.21 0.00 0.00 52.86 52.12 2c0m s ASN 293 Cb -0.02 -1.99 1.28 0.00 -0.55 0.00 0.00 41.25 39.97 2c0m s ASN 293 CO 0.55 -0.47 1.88 1.55 -2.79 0.00 0.00 177.10 177.81 2c0m h PRO 294 N 8.40 0.00 -0.46 0.43 0.13 -1.96 -2.83 132.00 135.71 2c0m h PRO 294 Ca -0.24 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.78 2c0m h PRO 294 Cb 1.09 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.15 2c0m h PRO 294 CO 0.72 0.00 0.08 1.28 -0.23 0.00 0.00 178.00 179.85 2c0m n LEU 295 N -2.65 4.78 0.04 1.56 4.77 -1.26 -4.63 117.00 119.60 2c0m n LEU 295 Ca 0.01 -3.25 -0.11 0.00 -0.03 0.00 0.00 56.01 52.63 2c0m n LEU 295 Cb 0.23 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.63 2c0m n LEU 295 CO 0.22 0.85 0.80 -0.09 -1.33 0.00 0.00 177.39 177.83 2c0m h ARG 296 N 1.99 -0.15 -0.43 3.23 9.65 -1.79 -3.12 114.38 123.77 2c0m h ARG 296 Ca 0.14 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 2c0m h ARG 296 Cb 1.83 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 30.44 2c0m h ARG 296 CO 0.45 -0.10 0.00 -0.25 2.80 0.00 0.00 179.97 182.87 2c0m n ASP 297 N -5.22 1.36 -4.70 -3.80 8.00 -1.26 -4.82 116.55 106.10 2c0m n ASP 297 Ca -0.05 -2.08 -0.42 0.00 0.71 0.00 0.00 54.79 52.95 2c0m n ASP 297 Cb 0.15 -0.27 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 2c0m n ASP 297 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2c0m s HIS 298 N -1.65 2.63 0.16 1.24 2.46 -1.18 -4.88 115.29 114.07 2c0m s HIS 298 Ca 0.12 0.35 -0.29 0.00 0.47 0.00 0.00 55.06 55.72 2c0m s HIS 298 Cb 0.07 -4.01 -0.02 0.00 -0.13 0.00 0.00 32.58 28.49 2c0m s HIS 298 CO 0.07 -3.97 1.55 -1.35 -2.47 0.00 0.00 174.74 168.57 2c0m h PRO 299 N 7.72 -0.20 -4.46 2.88 0.10 -1.93 -3.24 132.00 132.87 2c0m h PRO 299 Ca -0.43 0.01 -0.64 0.00 0.10 0.00 0.00 66.00 65.04 2c0m h PRO 299 Cb 1.21 0.05 -0.40 0.00 0.10 0.00 0.00 31.00 31.95 2c0m h PRO 299 CO 0.93 -0.13 -0.73 -1.14 0.10 0.00 0.00 178.00 177.02 2c0m s GLN 300 N -5.70 1.37 0.05 1.05 -0.44 -1.26 -5.01 119.66 109.71 2c0m s GLN 300 Ca -0.14 -1.67 -0.12 0.00 -2.50 0.00 0.00 55.36 50.93 2c0m s GLN 300 Cb 0.12 -2.93 -0.32 0.00 -1.64 0.00 0.00 33.01 28.24 2c0m s GLN 300 CO 0.64 -0.92 1.07 -1.00 0.50 0.00 0.00 175.29 175.58 2c0m h PRO 301 N 7.72 0.48 0.21 1.67 0.14 -1.85 -3.22 132.00 137.16 2c0m h PRO 301 Ca -0.07 -0.77 -0.01 0.00 0.14 0.00 0.00 66.00 65.28 2c0m h PRO 301 Cb 1.02 0.28 0.00 0.00 0.14 0.00 0.00 31.00 32.45 2c0m h PRO 301 CO 0.50 1.36 -0.10 0.35 0.14 0.00 0.00 178.00 180.26 2c0m h PHE 302 N 0.15 -0.27 -0.78 1.56 3.57 -1.94 0.94 116.94 120.17 2c0m h PHE 302 Ca -0.21 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.25 2c0m h PHE 302 Cb 2.06 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 40.85 2c0m h PHE 302 CO 0.11 -0.13 0.34 0.93 -2.23 0.00 0.00 178.31 177.33 2c0m h GLU 303 N -0.33 1.15 -0.49 1.11 3.07 -1.98 -1.15 114.58 115.96 2c0m h GLU 303 Ca -0.03 -0.19 -0.02 0.00 -0.50 0.00 0.00 59.36 58.62 2c0m h GLU 303 Cb 0.26 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 2c0m h GLU 303 CO 0.05 0.92 0.21 0.93 -1.40 0.00 0.00 179.01 179.71 2c0m h GLU 304 N 1.12 0.69 -0.54 2.33 4.39 -1.43 -2.46 114.58 118.68 2c0m h GLU 304 Ca 0.27 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 59.85 2c0m h GLU 304 Cb 0.17 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2c0m h GLU 304 CO -0.03 0.56 0.24 0.78 -1.16 0.00 0.00 179.01 179.40 2c0m h GLY 305 N 0.83 0.86 0.98 -3.84 0.00 0.16 -2.21 103.07 99.84 2c0m h GLY 305 Ca 0.17 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2c0m h GLY 305 CO -0.02 0.43 0.07 1.41 0.00 0.00 0.00 176.54 178.43 2c0m h LEU 306 N 0.74 0.12 0.29 3.11 3.38 -0.88 -1.24 115.31 120.83 2c0m h LEU 306 Ca 0.18 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2c0m h LEU 306 Cb 0.16 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2c0m h LEU 306 CO -0.02 0.09 -0.18 0.03 0.09 0.00 0.00 178.44 178.46 2c0m h ARG 307 N 0.16 -0.42 -0.86 1.13 3.08 -1.41 0.12 114.38 116.18 2c0m h ARG 307 Ca 0.05 0.03 0.15 0.00 0.07 0.00 0.00 59.98 60.27 2c0m h ARG 307 Cb -0.01 0.10 -0.15 0.00 0.08 0.00 0.00 29.97 29.99 2c0m h ARG 307 CO -0.02 -0.28 -0.29 0.54 -1.07 0.00 0.00 179.97 178.85 2c0m n ARG 308 N -3.36 -0.15 0.25 0.04 5.12 -0.84 -0.77 116.66 116.95 2c0m n ARG 308 Ca -0.05 1.33 -0.18 0.00 -1.93 0.00 0.00 57.85 57.01 2c0m n ARG 308 Cb 0.18 -1.97 -0.10 0.00 -1.16 0.00 0.00 32.46 29.41 2c0m n ARG 308 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2c0m h LEU 309 N 0.00 -1.46 -1.27 0.55 5.85 -1.07 0.15 115.31 118.06 2c0m h LEU 309 Ca 0.34 0.13 0.25 0.00 0.84 0.00 0.00 57.88 59.43 2c0m h LEU 309 Cb 0.55 0.50 -0.10 0.00 0.37 0.00 0.00 40.66 41.98 2c0m h LEU 309 CO -0.86 -0.65 0.64 1.56 -0.34 0.00 0.00 178.44 178.79 2c0m h GLN 310 N -0.96 0.46 -0.11 1.25 4.20 0.14 1.07 115.11 121.16 2c0m h GLN 310 Ca -0.05 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2c0m h GLN 310 Cb 0.86 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.53 2c0m h GLN 310 CO -0.12 0.30 0.00 0.39 -0.67 0.00 0.00 178.83 178.74 2c0m n GLU 311 N -4.68 1.30 -0.77 1.46 1.02 -0.62 -4.91 120.64 113.44 2c0m n GLU 311 Ca 0.25 -0.45 0.00 0.00 -0.02 0.00 0.00 57.16 56.93 2c0m n GLU 311 Cb 0.80 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 31.05 2c0m n GLU 311 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c0m n GLY 312 N 0.78 0.54 3.33 0.62 0.00 0.37 -5.01 105.19 105.81 2c0m n GLY 312 Ca 0.08 -0.64 -0.46 0.00 0.00 0.00 0.00 46.02 45.00 2c0m n GLY 312 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2c0m s ASP 313 N -2.58 7.00 -0.05 1.61 2.15 0.02 -4.91 116.67 119.91 2c0m s ASP 313 Ca 0.00 -3.17 -0.26 0.00 0.43 0.00 0.00 52.55 49.55 2c0m s ASP 313 Cb 0.00 -2.20 -0.22 0.00 -0.30 0.00 0.00 42.92 40.21 2c0m s ASP 313 CO 0.00 -0.42 1.13 -0.07 -0.17 0.00 0.00 175.17 175.65 2c0m h LEU 314 N 7.17 0.06 -0.72 -1.34 3.38 -1.88 -2.40 115.31 119.58 2c0m h LEU 314 Ca 0.14 -0.64 0.15 0.00 0.09 0.00 0.00 57.88 57.63 2c0m h LEU 314 Cb 0.95 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 41.58 2c0m h LEU 314 CO 0.88 0.68 0.18 -0.65 0.09 0.00 0.00 178.44 179.62 2c0m h PRO 315 N -0.57 0.27 0.10 1.13 0.11 -1.98 0.20 132.00 131.27 2c0m h PRO 315 Ca -0.00 -0.02 -0.26 0.00 0.11 0.00 0.00 66.00 65.83 2c0m h PRO 315 Cb 0.68 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.73 2c0m h PRO 315 CO 0.01 0.18 -1.18 -0.91 -0.21 0.00 0.00 178.00 175.89 2c0m h ASN 316 N 0.28 0.40 -0.64 -2.05 2.35 -1.97 -3.02 115.58 110.93 2c0m h ASN 316 Ca 0.40 -0.41 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2c0m h ASN 316 Cb 0.66 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 2c0m h ASN 316 CO -0.48 1.30 0.39 0.00 -1.65 0.00 0.00 177.43 176.99 2c0m h ALA 317 N 0.64 0.81 -0.10 -0.83 0.00 -0.85 -0.75 119.26 118.19 2c0m h ALA 317 Ca -0.12 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.77 2c0m h ALA 317 Cb 1.89 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 19.37 2c0m h ALA 317 CO 0.19 0.28 -0.24 0.28 0.00 0.00 0.00 179.25 179.76 2c0m h VAL 318 N 0.87 0.42 -0.17 0.00 2.07 -0.69 -0.39 116.25 118.35 2c0m h VAL 318 Ca 0.23 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.79 2c0m h VAL 318 Cb -0.04 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2c0m h VAL 318 CO -0.04 0.00 0.12 -0.07 0.02 0.00 0.00 177.57 177.60 2c0m h LEU 319 N -0.32 0.04 -0.04 2.57 3.38 -1.36 0.79 115.31 120.38 2c0m h LEU 319 Ca 0.09 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 2c0m h LEU 319 Cb 0.46 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.21 2c0m h LEU 319 CO -0.29 0.03 -0.65 -0.07 0.09 0.00 0.00 178.44 177.55 2c0m h LEU 320 N 0.04 0.63 -0.53 1.67 3.38 -0.56 -1.36 115.31 118.58 2c0m h LEU 320 Ca 0.08 -0.72 -0.12 0.00 0.09 0.00 0.00 57.88 57.21 2c0m h LEU 320 Cb 0.26 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2c0m h LEU 320 CO -0.01 1.26 -0.16 -0.26 0.09 0.00 0.00 178.44 179.37 2c0m h PHE 321 N 0.06 1.15 -0.57 1.13 0.05 -0.68 -1.43 116.94 116.65 2c0m h PHE 321 Ca -0.07 -0.26 0.07 0.00 3.82 0.00 0.00 57.97 61.53 2c0m h PHE 321 Cb 1.33 -0.28 -0.06 0.00 2.00 0.00 0.00 35.95 38.94 2c0m h PHE 321 CO 0.13 1.09 0.25 0.93 -0.18 0.00 0.00 178.31 180.53 2c0m h GLU 322 N 0.89 0.46 -0.80 1.51 5.08 -0.92 -1.44 114.58 119.37 2c0m h GLU 322 Ca 0.13 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2c0m h GLU 322 Cb 0.73 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.84 2c0m h GLU 322 CO 0.06 0.30 0.43 0.00 -1.00 0.00 0.00 179.01 178.80 2c0m h ALA 323 N 1.35 1.26 -0.27 3.43 0.00 -0.94 -2.13 119.26 121.96 2c0m h ALA 323 Ca 0.27 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 2c0m h ALA 323 Cb 0.26 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2c0m h ALA 323 CO -0.23 0.60 -0.39 0.00 0.00 0.00 0.00 179.25 179.22 2c0m h ALA 324 N 1.36 0.81 0.00 0.00 0.00 -0.76 -2.63 119.26 118.05 2c0m h ALA 324 Ca 0.28 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2c0m h ALA 324 Cb 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2c0m h ALA 324 CO -0.05 0.65 -0.18 1.33 0.00 0.00 0.00 179.25 181.00 2c0m n VAL 325 N -4.04 0.38 0.01 0.00 0.24 -0.59 -2.27 118.33 112.06 2c0m n VAL 325 Ca -0.02 -0.21 -0.05 0.00 -2.04 0.00 0.00 64.34 62.03 2c0m n VAL 325 Cb 0.52 -0.40 -0.11 0.00 -1.47 0.00 0.00 33.84 32.38 2c0m n VAL 325 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2c0m h GLN 326 N 0.00 0.00 0.16 7.34 4.20 -1.25 -2.67 115.11 122.90 2c0m h GLN 326 Ca 0.00 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.44 2c0m h GLN 326 Cb 0.68 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.49 2c0m h GLN 326 CO 0.00 0.47 -1.17 -0.56 -0.67 0.00 0.00 178.83 176.90 2c0m h GLN 327 N 0.00 0.51 -2.96 1.46 3.07 -1.55 -3.43 115.11 112.21 2c0m h GLN 327 Ca -0.20 -0.76 -0.59 0.00 0.09 0.00 0.00 58.65 57.18 2c0m h GLN 327 Cb 1.81 0.27 -0.40 0.00 0.08 0.00 0.00 27.48 29.24 2c0m h GLN 327 CO 0.07 1.35 -0.77 0.34 0.09 0.00 0.00 178.83 179.91 2c0m s ASP 328 N -7.32 3.51 0.60 0.06 2.15 -0.96 -5.00 116.67 109.71 2c0m s ASP 328 Ca -0.11 -2.29 0.34 0.00 0.43 0.00 0.00 52.55 50.92 2c0m s ASP 328 Cb 0.04 -0.80 1.91 0.00 -0.30 0.00 0.00 42.92 43.76 2c0m s ASP 328 CO 0.91 -0.31 2.24 -0.65 -0.17 0.00 0.00 175.17 177.19 2c0m h PRO 329 N 7.09 0.00 -0.00 4.34 0.11 -1.72 -1.56 132.00 140.26 2c0m h PRO 329 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2c0m h PRO 329 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2c0m h PRO 329 CO 0.42 0.02 -0.05 1.63 -0.21 0.00 0.00 178.00 179.81 2c0m n LYS 330 N -3.56 0.79 -1.90 1.05 5.02 -1.26 -4.70 118.16 113.60 2c0m n LYS 330 Ca -0.03 -0.19 -0.23 0.00 -2.02 0.00 0.00 58.31 55.84 2c0m n LYS 330 Cb 0.12 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.57 2c0m n LYS 330 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2c0m s HIS 331 N -2.35 1.63 0.24 2.13 2.46 -0.59 -4.77 115.29 114.05 2c0m s HIS 331 Ca 0.34 1.09 -0.07 0.00 0.47 0.00 0.00 55.06 56.89 2c0m s HIS 331 Cb 0.21 -3.81 0.25 0.00 -0.13 0.00 0.00 32.58 29.09 2c0m s HIS 331 CO 0.44 -1.42 1.91 1.98 -2.47 0.00 0.00 174.74 175.17 2c0m h MET 332 N 11.20 1.20 0.00 2.88 4.05 -1.88 -2.46 114.93 129.92 2c0m h MET 332 Ca 0.10 -0.07 -0.10 0.00 -0.28 0.00 0.00 59.70 59.34 2c0m h MET 332 Cb 0.99 -0.27 -0.01 0.00 -0.80 0.00 0.00 31.60 31.50 2c0m h MET 332 CO 1.15 0.79 -0.49 1.49 0.23 0.00 0.00 176.91 180.08 2c0m h GLU 333 N 1.24 0.00 -0.50 0.39 4.81 -1.96 -2.03 114.58 116.52 2c0m h GLU 333 Ca 0.35 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.49 2c0m h GLU 333 Cb -0.10 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2c0m h GLU 333 CO -0.09 0.49 -0.07 0.00 -0.73 0.00 0.00 179.01 178.62 2c0m h ALA 334 N 1.51 0.94 0.36 2.92 0.00 -1.82 -2.35 119.26 120.81 2c0m h ALA 334 Ca -0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2c0m h ALA 334 Cb 0.88 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2c0m h ALA 334 CO 0.06 0.63 -0.17 -1.49 0.00 0.00 0.00 179.25 178.28 2c0m h TRP 335 N 0.81 -0.45 -0.79 0.00 4.06 -1.40 -1.50 115.95 116.69 2c0m h TRP 335 Ca 0.14 -0.01 0.17 0.00 2.06 0.00 0.00 58.89 61.25 2c0m h TRP 335 Cb 0.58 0.15 -0.14 0.00 -1.00 0.00 0.00 29.16 28.74 2c0m h TRP 335 CO 0.03 -0.18 -0.09 0.37 -3.56 0.00 0.00 178.44 175.01 2c0m h GLN 336 N -0.65 0.04 -0.05 0.49 4.15 -1.18 0.33 115.11 118.24 2c0m h GLN 336 Ca -0.05 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.32 2c0m h GLN 336 Cb 0.47 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.15 2c0m h GLN 336 CO 0.08 0.03 -0.16 1.88 -1.93 0.00 0.00 178.83 178.72 2c0m h TYR 337 N 0.04 0.25 -1.03 3.99 -1.99 -1.47 -1.53 116.97 115.24 2c0m h TYR 337 Ca 0.41 -0.11 0.27 0.00 2.00 0.00 0.00 58.73 61.30 2c0m h TYR 337 Cb 0.70 -0.04 -0.12 0.00 2.00 0.00 0.00 36.73 39.27 2c0m h TYR 337 CO -0.53 0.79 0.63 1.25 -0.00 0.00 0.00 178.16 180.30 2c0m h LEU 338 N -0.36 0.57 0.77 3.88 5.85 -0.34 0.68 115.31 126.37 2c0m h LEU 338 Ca -0.01 0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 2c0m h LEU 338 Cb 0.80 0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.87 2c0m h LEU 338 CO 0.03 0.07 -0.37 1.23 -0.34 0.00 0.00 178.44 179.07 2c0m h GLY 339 N 0.48 -1.08 1.53 3.75 0.00 -0.21 -2.01 103.07 105.53 2c0m h GLY 339 Ca 0.64 0.40 -0.02 0.00 0.00 0.00 0.00 47.33 48.35 2c0m h GLY 339 CO -0.42 -0.39 0.19 -0.91 0.00 0.00 0.00 176.54 175.01 2c0m h THR 340 N -1.17 1.16 -0.01 4.70 1.35 -0.28 0.12 112.91 118.78 2c0m h THR 340 Ca -0.11 -0.47 -0.00 0.00 -0.55 0.00 0.00 66.41 65.28 2c0m h THR 340 Cb 0.79 0.63 -0.00 0.00 -1.73 0.00 0.00 68.15 67.84 2c0m h THR 340 CO 0.17 0.19 0.00 0.74 -0.25 0.00 0.00 175.52 176.37 2c0m h THR 341 N 0.61 1.24 -0.53 6.82 2.02 0.26 0.42 112.91 123.73 2c0m h THR 341 Ca 0.15 -0.71 -0.07 0.00 0.77 0.00 0.00 66.41 66.56 2c0m h THR 341 Cb 0.10 1.69 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 2c0m h THR 341 CO -0.02 0.19 0.06 1.56 0.37 0.00 0.00 175.52 177.67 2c0m h GLN 342 N -0.27 0.87 -0.15 6.66 1.08 -1.09 0.44 115.11 122.65 2c0m h GLN 342 Ca 0.00 -0.22 0.03 0.00 -1.45 0.00 0.00 58.65 57.02 2c0m h GLN 342 Cb 0.30 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 2c0m h GLN 342 CO 0.00 0.83 -0.05 0.00 -0.95 0.00 0.00 178.83 178.66 2c0m h ALA 343 N 1.24 0.08 -0.66 3.87 0.00 -0.62 0.24 119.26 123.42 2c0m h ALA 343 Ca 0.17 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2c0m h ALA 343 Cb 0.41 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2c0m h ALA 343 CO 0.01 -0.50 0.18 1.49 0.00 0.00 0.00 179.25 180.44 2c0m h GLU 344 N -0.02 1.02 0.00 0.00 4.81 -0.59 -2.23 114.58 117.56 2c0m h GLU 344 Ca 0.08 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2c0m h GLU 344 Cb 0.14 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2c0m h GLU 344 CO -0.17 0.89 0.00 -1.71 -0.73 0.00 0.00 179.01 177.29 2c0m n ASN 345 N -4.26 0.00 -0.72 1.04 5.15 0.15 -4.85 115.26 111.78 2c0m n ASN 345 Ca 0.05 -0.73 -0.09 0.00 -0.60 0.00 0.00 54.58 53.20 2c0m n ASN 345 Cb 0.23 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.44 2c0m n ASN 345 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2c0m n GLU 346 N -0.87 -0.77 -2.68 1.20 1.02 -0.09 -4.93 120.64 113.51 2c0m n GLU 346 Ca 0.10 0.80 -0.42 0.00 -0.02 0.00 0.00 57.16 57.62 2c0m n GLU 346 Cb 0.05 -4.73 0.01 0.00 -0.02 0.00 0.00 31.44 26.75 2c0m n GLU 346 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2c0m n GLN 347 N -2.49 4.30 0.08 3.49 1.13 0.65 -4.85 117.38 119.69 2c0m n GLN 347 Ca -0.09 -4.15 0.01 0.00 -1.94 0.00 0.00 57.00 50.82 2c0m n GLN 347 Cb 0.34 -2.65 0.35 0.00 0.11 0.00 0.00 30.24 28.38 2c0m n GLN 347 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 2c0m h GLU 348 N 5.36 0.32 0.10 -1.09 4.57 -1.87 -0.64 114.58 121.34 2c0m h GLU 348 Ca 0.33 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.42 2c0m h GLU 348 Cb 0.57 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 2c0m h GLU 348 CO 1.43 0.45 -0.05 -0.07 -1.18 0.00 0.00 179.01 179.59 2c0m h LEU 349 N 0.31 -0.12 -1.60 1.64 3.38 -1.95 -2.55 115.31 114.42 2c0m h LEU 349 Ca 0.06 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 2c0m h LEU 349 Cb 0.40 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2c0m h LEU 349 CO 0.02 0.31 -0.05 -0.07 0.09 0.00 0.00 178.44 178.75 2c0m h LEU 350 N -0.58 0.18 0.33 1.67 3.38 -1.89 -1.61 115.31 116.79 2c0m h LEU 350 Ca -0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2c0m h LEU 350 Cb 0.46 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2c0m h LEU 350 CO 0.02 0.26 -0.16 0.00 0.09 0.00 0.00 178.44 178.66 2c0m h ALA 351 N 1.76 -0.44 -0.10 1.53 0.00 -1.11 0.57 119.26 121.47 2c0m h ALA 351 Ca 0.04 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2c0m h ALA 351 Cb 0.22 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2c0m h ALA 351 CO 0.01 -0.71 -0.06 0.82 0.00 0.00 0.00 179.25 179.31 2c0m h ILE 352 N -0.51 0.81 -0.70 0.00 2.04 -1.27 0.47 117.51 118.34 2c0m h ILE 352 Ca -0.04 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.93 2c0m h ILE 352 Cb 0.39 0.81 -0.08 0.00 -0.74 0.00 0.00 36.82 37.19 2c0m h ILE 352 CO 0.07 0.00 0.28 -1.28 0.00 0.00 0.00 178.15 177.23 2c0m h SER 353 N -0.06 0.28 -0.13 1.72 0.87 -1.22 0.53 113.55 115.55 2c0m h SER 353 Ca 0.06 0.09 -0.11 0.00 -1.23 0.00 0.00 61.79 60.60 2c0m h SER 353 Cb 0.15 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2c0m h SER 353 CO -0.14 0.14 -0.35 0.00 -0.53 0.00 0.00 176.83 175.95 2c0m h ALA 354 N 1.49 0.22 0.00 6.23 0.00 -0.48 -2.72 119.26 124.00 2c0m h ALA 354 Ca 0.37 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2c0m h ALA 354 Cb 0.51 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2c0m h ALA 354 CO -0.35 0.28 -0.02 -0.07 0.00 0.00 0.00 179.25 179.08 2c0m h LEU 355 N 0.07 0.00 -0.15 0.00 3.38 0.65 -0.46 115.31 118.79 2c0m h LEU 355 Ca -0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2c0m h LEU 355 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2c0m h LEU 355 CO 0.08 0.02 -0.42 0.03 0.09 0.00 0.00 178.44 178.24 2c0m h ARG 356 N 0.00 0.55 -0.19 1.13 3.08 0.13 -2.82 114.38 116.25 2c0m h ARG 356 Ca -0.00 -0.39 -0.06 0.00 0.07 0.00 0.00 59.98 59.60 2c0m h ARG 356 Cb 0.07 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2c0m h ARG 356 CO 0.00 1.01 -0.13 0.00 -1.07 0.00 0.00 179.97 179.78 2c0m h ARG 357 N 0.18 0.31 0.55 0.04 2.47 -0.91 -2.12 114.38 114.90 2c0m h ARG 357 Ca -0.01 -0.08 -0.03 0.00 -1.26 0.00 0.00 59.98 58.61 2c0m h ARG 357 Cb 1.04 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 29.32 2c0m h ARG 357 CO 0.09 0.45 -0.26 0.00 0.56 0.00 0.00 179.97 180.81 2c0m h LEU 359 N -0.77 0.00 -1.08 0.00 3.38 -1.29 -0.50 115.31 115.05 2c0m h LEU 359 Ca -0.08 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.95 2c0m h LEU 359 Cb 0.58 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 2c0m h LEU 359 CO 0.12 0.20 0.62 -0.33 0.09 0.00 0.00 178.44 179.14 2c0m h GLU 360 N 0.00 1.11 0.12 1.13 5.08 -1.42 -1.66 114.58 118.94 2c0m h GLU 360 Ca -0.00 -0.07 -0.28 0.00 -1.00 0.00 0.00 59.36 58.01 2c0m h GLU 360 Cb 0.61 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 2c0m h GLU 360 CO 0.03 0.73 -1.32 -0.07 -1.00 0.00 0.00 179.01 177.38 2c0m h LEU 361 N 1.14 0.39 -6.58 1.33 3.38 -1.15 -3.42 115.31 110.41 2c0m h LEU 361 Ca 0.39 -0.45 -0.52 0.00 0.09 0.00 0.00 57.88 57.39 2c0m h LEU 361 Cb 0.10 -0.13 -0.38 0.00 0.09 0.00 0.00 40.66 40.35 2c0m h LEU 361 CO -0.14 1.36 -0.80 -0.75 0.09 0.00 0.00 178.44 178.20 2c0m s LYS 362 N -2.65 0.48 0.22 1.13 2.20 -0.46 -5.02 119.74 115.65 2c0m s LYS 362 Ca -0.05 -1.05 0.21 0.00 -0.36 0.00 0.00 55.97 54.72 2c0m s LYS 362 Cb 0.07 -1.14 0.92 0.00 -1.51 0.00 0.00 37.83 36.16 2c0m s LYS 362 CO 0.87 -1.17 1.63 -0.35 -0.36 0.00 0.00 175.35 175.98 2c0m n PRO 363 N 4.36 0.15 -0.57 4.03 -0.04 -0.64 -2.43 135.00 139.85 2c0m n PRO 363 Ca 0.08 0.44 0.09 0.00 -0.04 0.00 0.00 63.50 64.07 2c0m n PRO 363 Cb 0.40 -1.82 0.33 0.00 -0.04 0.00 0.00 33.50 32.37 2c0m n PRO 363 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2c0m n ASP 364 N -2.10 4.56 -4.55 3.54 5.68 -1.26 -4.91 116.55 117.50 2c0m n ASP 364 Ca 0.02 -2.51 -0.33 0.00 -0.50 0.00 0.00 54.79 51.46 2c0m n ASP 364 Cb 0.18 -0.55 -0.04 0.00 -1.14 0.00 0.00 41.12 39.57 2c0m n ASP 364 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2c0m s ASN 365 N -1.04 5.15 0.27 -1.12 3.84 -1.02 -4.85 114.94 116.17 2c0m s ASN 365 Ca 0.48 -0.03 0.03 0.00 0.21 0.00 0.00 52.86 53.55 2c0m s ASN 365 Cb 0.32 -2.54 0.38 0.00 -0.55 0.00 0.00 41.25 38.86 2c0m s ASN 365 CO 0.21 -2.58 1.68 1.56 -2.79 0.00 0.00 177.10 175.19 2c0m h GLN 366 N 13.69 0.40 -0.24 0.43 4.20 -1.91 -0.21 115.11 131.48 2c0m h GLN 366 Ca -0.12 -0.18 -0.17 0.00 0.06 0.00 0.00 58.65 58.25 2c0m h GLN 366 Cb 1.10 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.87 2c0m h GLN 366 CO 1.21 0.71 -0.49 1.79 -0.67 0.00 0.00 178.83 181.37 2c0m h THR 367 N 0.34 1.30 0.00 -0.54 1.35 -1.99 -2.23 112.91 111.14 2c0m h THR 367 Ca 0.04 -1.69 -0.03 0.00 -0.55 0.00 0.00 66.41 64.18 2c0m h THR 367 Cb 0.79 1.75 -0.00 0.00 -1.73 0.00 0.00 68.15 68.95 2c0m h THR 367 CO 0.06 0.54 -0.14 0.00 -0.25 0.00 0.00 175.52 175.74 2c0m h ALA 368 N 0.64 1.66 0.42 6.62 0.00 -1.79 0.33 119.26 127.14 2c0m h ALA 368 Ca 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2c0m h ALA 368 Cb 1.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2c0m h ALA 368 CO 0.11 0.17 -0.20 -0.07 0.00 0.00 0.00 179.25 179.26 2c0m h LEU 369 N 0.00 -0.48 -1.53 0.00 3.38 -1.02 -2.30 115.31 113.36 2c0m h LEU 369 Ca -0.00 0.02 0.17 0.00 0.09 0.00 0.00 57.88 58.15 2c0m h LEU 369 Cb 0.26 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 2c0m h LEU 369 CO 0.02 -0.09 0.55 -0.03 0.09 0.00 0.00 178.44 178.97 2c0m h MET 370 N -1.07 0.42 -0.28 1.13 4.05 -1.03 0.19 114.93 118.34 2c0m h MET 370 Ca -0.06 -0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.24 2c0m h MET 370 Cb 0.43 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.13 2c0m h MET 370 CO 0.10 0.28 -0.21 0.00 0.23 0.00 0.00 176.91 177.31 2c0m h ALA 371 N 1.63 0.40 -0.25 0.39 0.00 -0.45 -1.84 119.26 119.15 2c0m h ALA 371 Ca 0.42 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2c0m h ALA 371 Cb 0.96 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2c0m h ALA 371 CO -0.15 0.35 -0.00 1.25 0.00 0.00 0.00 179.25 180.70 2c0m h LEU 372 N 0.36 0.33 -0.10 0.00 5.85 -0.36 -2.48 115.31 118.91 2c0m h LEU 372 Ca 0.05 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2c0m h LEU 372 Cb 0.75 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 2c0m h LEU 372 CO 0.06 0.40 -0.10 0.00 -0.34 0.00 0.00 178.44 178.45 2c0m h ALA 373 N 1.65 0.15 -0.32 1.25 0.00 -0.50 -2.47 119.26 119.02 2c0m h ALA 373 Ca 0.08 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.75 2c0m h ALA 373 Cb 0.24 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 2c0m h ALA 373 CO 0.01 -0.01 -0.04 0.28 0.00 0.00 0.00 179.25 179.49 2c0m h VAL 374 N -0.16 0.73 -0.74 0.00 2.07 -1.27 -1.71 116.25 115.16 2c0m h VAL 374 Ca 0.02 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.61 2c0m h VAL 374 Cb 0.62 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 2c0m h VAL 374 CO 0.03 0.01 0.40 0.28 0.02 0.00 0.00 177.57 178.30 2c0m h SER 375 N 0.05 0.56 0.29 0.57 0.02 -1.43 -0.77 113.55 112.84 2c0m h SER 375 Ca 0.15 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2c0m h SER 375 Cb 0.22 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2c0m h SER 375 CO -0.29 0.33 -0.14 -0.26 -1.14 0.00 0.00 176.83 175.33 2c0m h PHE 376 N 0.69 -0.36 -0.52 3.45 0.05 -0.94 -1.52 116.94 117.78 2c0m h PHE 376 Ca 0.36 -0.01 0.10 0.00 3.82 0.00 0.00 57.97 62.24 2c0m h PHE 376 Cb 0.33 0.12 -0.10 0.00 2.00 0.00 0.00 35.95 38.30 2c0m h PHE 376 CO -0.08 -0.23 -0.15 2.41 -0.18 0.00 0.00 178.31 180.08 2c0m n THR 377 N -3.08 -0.23 0.16 -1.55 -1.04 -0.69 0.63 114.28 108.47 2c0m n THR 377 Ca -0.05 1.21 0.03 0.00 -2.04 0.00 0.00 64.05 63.19 2c0m n THR 377 Cb 0.15 -1.65 0.39 0.00 -1.82 0.00 0.00 70.33 67.41 2c0m n THR 377 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 2c0m h ASN 378 N 0.00 0.11 -0.34 8.00 2.35 -0.84 -1.03 115.58 123.83 2c0m h ASN 378 Ca 0.24 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2c0m h ASN 378 Cb 0.37 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.71 2c0m h ASN 378 CO -0.54 0.35 0.00 -0.62 -1.65 0.00 0.00 177.43 174.98 2c0m n GLU 379 N -4.22 2.20 -1.23 0.81 -0.58 0.20 -4.92 120.64 112.91 2c0m n GLU 379 Ca -0.02 -1.39 -0.09 0.00 -0.42 0.00 0.00 57.16 55.24 2c0m n GLU 379 Cb 0.32 -1.48 -0.04 0.00 -0.57 0.00 0.00 31.44 29.67 2c0m n GLU 379 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2c0m n SER 380 N 0.48 -5.63 -3.70 1.62 7.64 -0.39 -4.88 113.62 108.76 2c0m n SER 380 Ca 0.13 0.21 -0.42 0.00 1.01 0.00 0.00 58.87 59.80 2c0m n SER 380 Cb 0.44 -3.98 -0.00 0.00 -1.01 0.00 0.00 64.21 59.66 2c0m n SER 380 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2c0m n LEU 381 N -0.99 7.14 -0.25 -3.43 4.77 -1.02 -4.76 117.00 118.45 2c0m n LEU 381 Ca -0.09 -4.42 -0.05 0.00 -0.03 0.00 0.00 56.01 51.42 2c0m n LEU 381 Cb 0.56 -1.55 0.05 0.00 -2.33 0.00 0.00 43.42 40.15 2c0m n LEU 381 CO 0.13 1.42 1.13 1.56 -1.33 0.00 0.00 177.39 180.30 2c0m h GLN 382 N 5.65 0.95 -0.16 3.23 1.08 -1.89 -2.88 115.11 121.10 2c0m h GLN 382 Ca 0.56 -0.08 0.02 0.00 -1.45 0.00 0.00 58.65 57.70 2c0m h GLN 382 Cb 0.56 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.75 2c0m h GLN 382 CO 1.75 0.67 -0.32 -0.09 -0.95 0.00 0.00 178.83 179.89 2c0m h ARG 383 N 0.95 -0.28 -1.00 1.46 2.43 -1.98 -2.28 114.38 113.69 2c0m h ARG 383 Ca 0.25 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.50 2c0m h ARG 383 Cb -0.03 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.51 2c0m h ARG 383 CO -0.05 -0.18 0.64 1.96 -1.51 0.00 0.00 179.97 180.83 2c0m h GLN 384 N -0.29 1.15 -0.79 0.20 7.50 -1.93 -0.10 115.11 120.86 2c0m h GLN 384 Ca 0.03 -0.07 0.11 0.00 0.50 0.00 0.00 58.65 59.22 2c0m h GLN 384 Cb 0.37 -0.26 -0.05 0.00 0.05 0.00 0.00 27.48 27.59 2c0m h GLN 384 CO -0.30 0.76 0.51 0.00 -1.50 0.00 0.00 178.83 178.31 2c0m h ALA 385 N 1.44 1.86 -0.36 3.87 0.00 -1.29 0.11 119.26 124.90 2c0m h ALA 385 Ca 0.42 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 55.17 2c0m h ALA 385 Cb 0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2c0m h ALA 385 CO -0.16 -0.05 -0.42 0.00 0.00 0.00 0.00 179.25 178.63 2c0m h GLU 387 N 0.74 1.08 -0.15 0.00 5.08 -0.85 0.26 114.58 120.74 2c0m h GLU 387 Ca 0.05 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 58.11 2c0m h GLU 387 Cb 1.01 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2c0m h GLU 387 CO 0.10 0.87 -0.37 0.82 -1.00 0.00 0.00 179.01 179.43 2c0m h ILE 388 N 1.05 1.36 -0.10 3.13 1.08 -0.77 -0.43 117.51 122.83 2c0m h ILE 388 Ca 0.25 -1.65 -0.02 0.00 -0.39 0.00 0.00 64.86 63.05 2c0m h ILE 388 Cb 0.17 2.02 -0.01 0.00 -3.07 0.00 0.00 36.82 35.93 2c0m h ILE 388 CO -0.03 0.50 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.81 2c0m h LEU 389 N 0.14 0.13 -0.09 1.44 3.38 -0.57 0.18 115.31 119.92 2c0m h LEU 389 Ca -0.00 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2c0m h LEU 389 Cb 0.98 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 2c0m h LEU 389 CO 0.08 0.20 -0.12 -0.09 0.09 0.00 0.00 178.44 178.61 2c0m h ARG 390 N 0.14 0.24 -0.93 1.13 2.43 -0.43 -3.02 114.38 113.93 2c0m h ARG 390 Ca 0.03 -0.14 0.07 0.00 -0.81 0.00 0.00 59.98 59.13 2c0m h ARG 390 Cb 0.18 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.68 2c0m h ARG 390 CO 0.01 0.69 0.59 -0.44 -1.51 0.00 0.00 179.97 179.31 2c0m h ASP 391 N -0.20 0.93 -0.61 -3.80 3.32 -0.38 -0.94 116.42 114.74 2c0m h ASP 391 Ca 0.01 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.12 2c0m h ASP 391 Cb 0.66 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 2c0m h ASP 391 CO 0.03 0.58 0.41 -0.25 -1.72 0.00 0.00 179.24 178.29 2c0m h TRP 392 N 1.06 0.65 -0.01 4.55 7.01 -0.72 -2.22 115.95 126.27 2c0m h TRP 392 Ca 0.41 0.02 -0.19 0.00 2.11 0.00 0.00 58.89 61.24 2c0m h TRP 392 Cb 0.19 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.03 2c0m h TRP 392 CO -0.02 0.36 -0.83 1.25 -2.79 0.00 0.00 178.44 176.41 2c0m h LEU 393 N 0.66 0.26 0.00 0.65 5.85 -1.04 -3.06 115.31 118.63 2c0m h LEU 393 Ca 0.25 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 2c0m h LEU 393 Cb 0.18 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2c0m h LEU 393 CO -0.07 0.98 -0.56 0.08 -0.34 0.00 0.00 178.44 178.53 2c0m h ARG 394 N 0.12 0.00 -0.54 1.25 0.11 -1.31 -2.75 114.38 111.26 2c0m h ARG 394 Ca -0.04 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.04 2c0m h ARG 394 Cb 1.44 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.52 2c0m h ARG 394 CO 0.13 0.21 0.00 0.66 0.10 0.00 0.00 179.97 181.06 2c0m n TYR 395 N -3.03 0.79 -3.84 4.08 0.53 -0.85 -4.47 117.16 110.36 2c0m n TYR 395 Ca 0.01 -0.34 -0.34 0.00 -1.02 0.00 0.00 57.90 56.21 2c0m n TYR 395 Cb 0.65 -0.11 -0.12 0.00 -1.03 0.00 0.00 39.34 38.72 2c0m n TYR 395 CO 0.00 0.00 0.00 0.99 -1.02 0.00 0.00 176.86 176.83 2c0m s THR 396 N -1.61 3.05 0.30 -0.72 2.01 -1.16 -4.90 115.64 112.61 2c0m s THR 396 Ca 0.30 -2.50 0.20 0.00 0.31 0.00 0.00 61.69 60.00 2c0m s THR 396 Cb 0.18 -3.10 0.32 0.00 0.01 0.00 0.00 72.50 69.91 2c0m s THR 396 CO 0.17 -0.73 1.12 -2.65 -0.69 0.00 0.00 174.62 171.84 2c0m n PRO 397 N 4.06 -0.03 0.09 4.92 -0.02 -1.26 0.13 135.00 142.88 2c0m n PRO 397 Ca 0.02 0.93 -0.06 0.00 -2.02 0.00 0.00 63.50 62.38 2c0m n PRO 397 Cb 0.39 -1.77 0.09 0.00 -0.02 0.00 0.00 33.50 32.19 2c0m n PRO 397 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c0m h ALA 398 N 1.25 0.77 -0.10 3.55 0.00 -1.95 -3.32 119.26 119.46 2c0m h ALA 398 Ca 0.62 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2c0m h ALA 398 Cb 1.87 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.58 2c0m h ALA 398 CO -0.42 0.78 0.00 0.66 0.00 0.00 0.00 179.25 180.27 2c0m n TYR 399 N -3.82 0.11 -0.28 0.00 4.01 0.34 -4.59 117.16 112.93 2c0m n TYR 399 Ca -0.03 -0.07 0.02 0.00 -0.16 0.00 0.00 57.90 57.66 2c0m n TYR 399 Cb 0.66 -0.00 0.23 0.00 -0.31 0.00 0.00 39.34 39.92 2c0m n TYR 399 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2c0m h ALA 400 N 3.59 1.48 0.00 -0.72 0.00 -0.97 -2.48 119.26 120.16 2c0m h ALA 400 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2c0m h ALA 400 Cb 0.79 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2c0m h ALA 400 CO 0.00 0.43 -0.05 1.12 0.00 0.00 0.00 179.25 180.75 2c0m h HIS 401 N 1.06 0.00 0.00 0.00 2.07 -1.82 -2.15 115.15 114.31 2c0m h HIS 401 Ca 0.35 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.85 2c0m h HIS 401 Cb 0.06 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.04 2c0m h HIS 401 CO -0.00 0.05 -0.07 -0.07 -3.07 0.00 0.00 177.93 174.77 2c0m h LEU 402 N 0.00 0.00 -9.16 6.12 3.38 -1.77 -3.54 115.31 110.34 2c0m h LEU 402 Ca -0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 2c0m h LEU 402 Cb 0.25 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.87 2c0m h LEU 402 CO 0.01 0.07 -0.51 -0.69 0.09 0.00 0.00 178.44 177.41 2c0m s VAL 403 N -3.67 5.29 -0.08 1.22 1.01 -0.81 -5.08 120.40 118.29 2c0m s VAL 403 Ca 0.01 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.17 2c0m s VAL 403 Cb 0.09 -3.43 0.09 0.00 0.00 0.00 0.00 36.38 33.13 2c0m s VAL 403 CO 0.58 0.40 0.79 0.54 0.00 0.00 0.00 175.10 177.41 2c0m n ARG 420 N 3.88 0.30 0.00 2.72 1.74 -1.26 -5.14 116.66 118.90 2c0m n ARG 420 Ca -0.16 -0.64 0.00 0.00 -0.77 0.00 0.00 57.85 56.28 2c0m n ARG 420 Cb 0.52 0.41 0.00 0.00 -1.02 0.00 0.00 32.46 32.37 2c0m n ARG 420 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2c0m n ILE 421 N -0.35 0.00 -1.31 0.55 5.41 -1.26 -5.17 119.36 117.24 2c0m n ILE 421 Ca -0.14 0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.27 2c0m n ILE 421 Cb 0.60 0.00 0.11 0.00 -0.71 0.00 0.00 39.64 39.63 2c0m n ILE 421 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2c0m s LEU 422 N -2.97 3.24 0.00 1.39 1.43 -1.26 -4.82 118.68 115.69 2c0m s LEU 422 Ca 0.00 2.34 0.00 0.00 -1.03 0.00 0.00 54.13 55.44 2c0m s LEU 422 Cb 0.00 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 41.63 2c0m s LEU 422 CO 0.00 -2.41 0.00 0.61 0.23 0.00 0.00 176.35 174.78 2c0m n GLY 423 N 0.36 0.00 3.17 -3.19 0.00 -1.26 -4.42 105.19 99.85 2c0m n GLY 423 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 2c0m n GLY 423 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c0m s SER 424 N -1.22 0.30 0.00 1.61 0.01 -1.26 -5.15 113.70 107.99 2c0m s SER 424 Ca 0.00 -1.07 0.00 0.00 1.31 0.00 0.00 55.95 56.19 2c0m s SER 424 Cb 0.00 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.53 2c0m s SER 424 CO 0.00 -0.72 0.48 0.18 0.41 0.00 0.00 173.24 173.59 2c0m n LEU 425 N -0.06 0.56 -4.63 2.44 4.77 -1.26 -4.94 117.00 113.87 2c0m n LEU 425 Ca -0.08 0.55 -0.42 0.00 -0.03 0.00 0.00 56.01 56.02 2c0m n LEU 425 Cb 0.63 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 2c0m n LEU 425 CO 0.28 -0.22 1.66 -0.76 -1.33 0.00 0.00 177.39 177.03 2c0m s LEU 426 N -2.31 3.98 -0.34 2.23 1.43 -1.26 -4.84 118.68 117.57 2c0m s LEU 426 Ca 0.00 2.21 0.04 0.00 -1.03 0.00 0.00 54.13 55.35 2c0m s LEU 426 Cb 0.00 -3.52 0.18 0.00 0.03 0.00 0.00 46.19 42.87 2c0m s LEU 426 CO 0.00 -1.43 1.17 -1.54 0.23 0.00 0.00 176.35 174.78 2c0m n SER 427 N 9.25 -1.39 -4.67 2.29 3.41 -1.26 -4.97 113.62 116.27 2c0m n SER 427 Ca 0.23 -1.95 -0.31 0.00 -0.26 0.00 0.00 58.87 56.59 2c0m n SER 427 Cb 0.43 1.05 0.16 0.00 -0.26 0.00 0.00 64.21 65.59 2c0m n SER 427 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2c0m s ASP 428 N -0.49 3.02 -0.06 4.04 1.11 -1.26 -4.71 116.67 118.32 2c0m s ASP 428 Ca 0.10 1.98 -0.21 0.00 0.18 0.00 0.00 52.55 54.61 2c0m s ASP 428 Cb 0.18 -2.50 -0.30 0.00 1.07 0.00 0.00 42.92 41.37 2c0m s ASP 428 CO -0.05 -3.00 0.81 0.28 1.18 0.00 0.00 175.17 174.39 2c0m h SER 429 N -1.80 0.43 -0.40 0.27 0.02 -2.02 -2.91 113.55 107.16 2c0m h SER 429 Ca -0.46 -0.93 0.03 0.00 -0.84 0.00 0.00 61.79 59.60 2c0m h SER 429 Cb 1.27 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.63 2c0m h SER 429 CO 0.45 1.43 0.19 0.25 -1.14 0.00 0.00 176.83 178.02 2c0m h LEU 430 N -0.38 0.27 -0.34 5.07 5.85 -1.99 1.00 115.31 124.79 2c0m h LEU 430 Ca -0.18 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.59 2c0m h LEU 430 Cb 1.65 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.62 2c0m h LEU 430 CO 0.12 0.20 0.16 0.15 -0.34 0.00 0.00 178.44 178.73 2c0m h PHE 431 N 0.39 0.30 -0.33 1.25 3.57 -1.95 -1.90 116.94 118.26 2c0m h PHE 431 Ca 0.17 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.55 2c0m h PHE 431 Cb 0.09 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 2c0m h PHE 431 CO -0.11 0.15 -0.35 1.25 -2.23 0.00 0.00 178.31 177.03 2c0m h LEU 432 N 0.34 0.78 0.42 0.59 5.85 -1.25 -1.80 115.31 120.24 2c0m h LEU 432 Ca 0.15 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 2c0m h LEU 432 Cb 0.07 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 2c0m h LEU 432 CO -0.11 1.05 -0.38 -0.08 -0.34 0.00 0.00 178.44 178.58 2c0m h GLU 433 N 0.62 -0.76 -0.48 1.25 4.81 -0.69 -1.97 114.58 117.36 2c0m h GLU 433 Ca 0.06 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.43 2c0m h GLU 433 Cb 0.88 0.17 -0.08 0.00 0.63 0.00 0.00 28.75 30.36 2c0m h GLU 433 CO 0.08 -0.51 0.03 0.28 -0.73 0.00 0.00 179.01 178.16 2c0m h VAL 434 N -0.79 0.66 -0.37 0.32 2.07 -1.26 -1.06 116.25 115.81 2c0m h VAL 434 Ca -0.05 -0.05 0.07 0.00 0.82 0.00 0.00 66.70 67.49 2c0m h VAL 434 Cb 0.68 0.50 -0.09 0.00 -1.52 0.00 0.00 31.29 30.85 2c0m h VAL 434 CO -0.02 0.03 -0.38 0.50 0.02 0.00 0.00 177.57 177.71 2c0m h LYS 435 N 0.15 -0.30 0.00 1.57 3.64 -1.24 -0.07 116.57 120.32 2c0m h LYS 435 Ca 0.24 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 2c0m h LYS 435 Cb 0.35 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2c0m h LYS 435 CO -0.37 -0.20 -0.05 0.93 -2.27 0.00 0.00 179.45 177.49 2c0m h GLU 436 N -0.31 0.00 -0.21 1.90 4.39 -0.51 0.24 114.58 120.08 2c0m h GLU 436 Ca 0.15 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.79 2c0m h GLU 436 Cb 0.57 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.21 2c0m h GLU 436 CO -0.54 0.05 -0.08 -0.07 -1.16 0.00 0.00 179.01 177.21 2c0m h LEU 437 N 0.00 0.43 -0.94 1.33 3.38 0.14 -1.75 115.31 117.90 2c0m h LEU 437 Ca -0.00 -0.40 -0.10 0.00 0.09 0.00 0.00 57.88 57.47 2c0m h LEU 437 Cb 0.49 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2c0m h LEU 437 CO 0.01 0.73 -0.34 -0.26 0.09 0.00 0.00 178.44 178.67 2c0m h PHE 438 N 0.12 0.42 0.00 1.13 -1.00 -0.35 -1.60 116.94 115.66 2c0m h PHE 438 Ca 0.05 -0.10 -0.06 0.00 2.81 0.00 0.00 57.97 60.66 2c0m h PHE 438 Cb 0.56 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 40.02 2c0m h PHE 438 CO 0.06 0.66 -0.30 -0.07 -1.61 0.00 0.00 178.31 177.05 2c0m h LEU 439 N 0.31 0.00 0.04 1.54 3.38 -0.92 -2.78 115.31 116.88 2c0m h LEU 439 Ca 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2c0m h LEU 439 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2c0m h LEU 439 CO 0.06 0.30 -0.02 0.00 0.09 0.00 0.00 178.44 178.87 2c0m h ALA 440 N 1.70 -0.06 -0.45 1.53 0.00 -0.88 -3.30 119.26 117.80 2c0m h ALA 440 Ca -0.00 -0.30 0.09 0.00 0.00 0.00 0.00 54.91 54.70 2c0m h ALA 440 Cb 0.66 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.38 2c0m h ALA 440 CO 0.04 -0.21 -0.21 0.00 0.00 0.00 0.00 179.25 178.87 2c0m h ALA 441 N 0.17 0.11 -0.95 0.00 0.00 -1.18 0.13 119.26 117.55 2c0m h ALA 441 Ca -0.01 0.16 0.15 0.00 0.00 0.00 0.00 54.91 55.21 2c0m h ALA 441 Cb 0.61 0.52 -0.15 0.00 0.00 0.00 0.00 17.79 18.76 2c0m h ALA 441 CO 0.01 -0.56 -0.36 0.28 0.00 0.00 0.00 179.25 178.62 2c0m n VAL 442 N -5.39 -0.49 0.52 0.00 0.31 -1.06 -1.29 118.33 110.93 2c0m n VAL 442 Ca 0.03 2.21 0.12 0.00 -0.01 0.00 0.00 64.34 66.70 2c0m n VAL 442 Cb 0.30 -2.94 0.45 0.00 -0.91 0.00 0.00 33.84 30.75 2c0m n VAL 442 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2c0m n ARG 443 N -5.41 0.20 -0.04 5.55 1.74 0.40 -3.00 116.66 116.11 2c0m n ARG 443 Ca 0.10 0.31 -0.09 0.00 -0.77 0.00 0.00 57.85 57.40 2c0m n ARG 443 Cb 0.39 -1.81 -0.03 0.00 -1.02 0.00 0.00 32.46 29.99 2c0m n ARG 443 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2c0m h LEU 444 N 0.00 -0.95 -6.68 0.55 3.38 -0.54 -3.37 115.31 107.70 2c0m h LEU 444 Ca 0.00 0.15 -0.55 0.00 0.09 0.00 0.00 57.88 57.57 2c0m h LEU 444 Cb 0.51 0.42 -0.39 0.00 0.09 0.00 0.00 40.66 41.29 2c0m h LEU 444 CO 0.00 -0.33 -0.81 -0.62 0.09 0.00 0.00 178.44 176.77 2c0m s ASP 445 N -4.99 3.23 0.00 -0.43 2.15 -1.16 -5.01 116.67 110.46 2c0m s ASP 445 Ca -0.15 -1.73 0.16 0.00 0.43 0.00 0.00 52.55 51.25 2c0m s ASP 445 Cb 0.12 -0.36 0.67 0.00 -0.30 0.00 0.00 42.92 43.05 2c0m s ASP 445 CO 0.67 -0.37 1.47 -0.81 -0.17 0.00 0.00 175.17 175.95 2c0m n PRO 446 N 4.65 1.44 -0.00 4.34 -0.04 -1.20 -3.60 135.00 140.58 2c0m n PRO 446 Ca 0.03 -0.67 -0.17 0.00 -0.04 0.00 0.00 63.50 62.66 2c0m n PRO 446 Cb 0.40 -1.29 -0.12 0.00 -0.04 0.00 0.00 33.50 32.45 2c0m n PRO 446 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 2c0m h THR 447 N 1.25 1.50 -1.67 0.52 1.35 -1.95 -3.46 112.91 110.45 2c0m h THR 447 Ca 0.00 -2.12 -0.43 0.00 -0.55 0.00 0.00 66.41 63.31 2c0m h THR 447 Cb 0.28 2.79 0.01 0.00 -1.73 0.00 0.00 68.15 69.50 2c0m h THR 447 CO 0.00 0.60 -0.31 -0.94 -0.25 0.00 0.00 175.52 174.62 2c0m s SER 448 N -6.61 5.86 -0.19 5.36 1.04 -1.24 -5.11 113.70 112.81 2c0m s SER 448 Ca -0.14 -0.27 -0.00 0.00 0.48 0.00 0.00 55.95 56.01 2c0m s SER 448 Cb 0.02 -1.03 0.01 0.00 0.10 0.00 0.00 66.02 65.12 2c0m s SER 448 CO 0.79 -0.55 -0.16 -0.63 0.98 0.00 0.00 173.24 173.68 2c0m s ILE 449 N -2.24 2.45 -0.34 -1.02 1.01 -1.26 -4.97 121.20 114.84 2c0m s ILE 449 Ca 0.49 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 60.11 2c0m s ILE 449 Cb -0.10 -2.06 0.00 0.00 0.01 0.00 0.00 42.46 40.32 2c0m s ILE 449 CO 0.32 0.51 0.69 -0.62 0.00 0.00 0.00 174.94 175.83 2c0m s ASP 450 N 1.30 6.51 0.40 3.58 -1.08 -1.26 -4.96 116.67 121.15 2c0m s ASP 450 Ca 0.04 0.35 0.22 0.00 -0.52 0.00 0.00 52.55 52.63 2c0m s ASP 450 Cb -0.14 -2.35 0.54 0.00 -1.46 0.00 0.00 42.92 39.51 2c0m s ASP 450 CO -0.09 -0.59 1.66 1.55 0.52 0.00 0.00 175.17 178.22 2c0m h PRO 451 N 8.33 0.00 0.00 4.34 0.13 -1.92 -2.40 132.00 140.48 2c0m h PRO 451 Ca -0.26 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.75 2c0m h PRO 451 Cb 1.11 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 2c0m h PRO 451 CO 0.85 0.25 -0.56 -0.44 -0.23 0.00 0.00 178.00 177.86 2c0m h ASP 452 N 0.00 0.00 0.16 1.44 3.45 -1.95 0.41 116.42 119.93 2c0m h ASP 452 Ca -0.00 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 2c0m h ASP 452 Cb 1.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.77 2c0m h ASP 452 CO 0.03 0.56 -0.08 0.58 -1.57 0.00 0.00 179.24 178.77 2c0m h VAL 453 N 0.00 0.95 -0.28 -1.35 2.07 -1.94 -2.65 116.25 113.05 2c0m h VAL 453 Ca -0.01 -1.04 -0.03 0.00 0.82 0.00 0.00 66.70 66.45 2c0m h VAL 453 Cb 1.10 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 2c0m h VAL 453 CO 0.07 0.22 0.06 1.56 0.02 0.00 0.00 177.57 179.50 2c0m h GLN 454 N -0.76 0.40 0.73 1.57 1.08 -1.42 0.35 115.11 117.06 2c0m h GLN 454 Ca -0.02 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.09 2c0m h GLN 454 Cb 0.52 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.88 2c0m h GLN 454 CO 0.04 0.38 -0.39 0.00 -0.95 0.00 0.00 178.83 177.91 2c0m h GLY 456 N -1.03 -0.63 0.32 0.00 0.00 -1.07 0.25 103.07 100.91 2c0m h GLY 456 Ca -0.10 0.50 0.14 0.00 0.00 0.00 0.00 47.33 47.87 2c0m h GLY 456 CO 0.14 -0.22 0.49 -2.00 0.00 0.00 0.00 176.54 174.96 2c0m h LEU 457 N -0.44 0.64 -0.13 3.11 5.85 -0.34 0.16 115.31 124.16 2c0m h LEU 457 Ca 0.09 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2c0m h LEU 457 Cb 0.61 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2c0m h LEU 457 CO -0.43 0.30 0.08 1.23 -0.34 0.00 0.00 178.44 179.29 2c0m h GLY 458 N 0.73 0.19 0.02 3.75 0.00 0.83 -1.73 103.07 106.86 2c0m h GLY 458 Ca 0.47 -0.07 0.12 0.00 0.00 0.00 0.00 47.33 47.84 2c0m h GLY 458 CO -0.33 0.07 -0.00 -2.08 0.00 0.00 0.00 176.54 174.21 2c0m h VAL 459 N 0.16 0.53 0.11 4.60 2.07 0.13 -2.06 116.25 121.79 2c0m h VAL 459 Ca 0.05 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 2c0m h VAL 459 Cb 0.01 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2c0m h VAL 459 CO -0.01 0.02 -0.05 -0.07 0.02 0.00 0.00 177.57 177.48 2c0m h LEU 460 N 0.12 -0.12 -2.04 2.57 3.38 -0.72 -2.28 115.31 116.21 2c0m h LEU 460 Ca 0.30 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.25 2c0m h LEU 460 Cb 0.47 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2c0m h LEU 460 CO -0.49 -0.01 0.13 -0.26 0.09 0.00 0.00 178.44 177.90 2c0m h PHE 461 N -0.23 0.00 -0.15 1.13 -1.00 -1.04 -1.80 116.94 113.84 2c0m h PHE 461 Ca -0.02 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.73 2c0m h PHE 461 Cb 0.19 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.74 2c0m h PHE 461 CO -0.04 0.00 -0.06 -0.97 -1.61 0.00 0.00 178.31 175.63 2c0m h ASN 462 N 0.00 0.31 -0.43 2.17 -1.24 -0.82 -1.49 115.58 114.08 2c0m h ASN 462 Ca 0.08 -0.39 0.03 0.00 0.71 0.00 0.00 56.30 56.73 2c0m h ASN 462 Cb 0.35 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 39.28 2c0m h ASN 462 CO -0.00 0.63 0.23 -0.07 -1.29 0.00 0.00 177.43 176.94 2c0m h LEU 463 N -0.01 0.35 0.00 0.34 3.38 -0.97 -2.19 115.31 116.22 2c0m h LEU 463 Ca 0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2c0m h LEU 463 Cb 0.51 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2c0m h LEU 463 CO 0.02 0.25 0.00 -1.54 0.09 0.00 0.00 178.44 177.26 2c0m n SER 464 N -4.89 0.00 0.00 -0.43 3.41 -0.74 -4.87 113.62 106.10 2c0m n SER 464 Ca 0.02 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 2c0m n SER 464 Cb 0.09 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 2c0m n SER 464 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c0m n GLY 465 N -0.02 1.57 3.58 5.00 0.00 -0.82 -4.96 105.19 109.53 2c0m n GLY 465 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2c0m n GLY 465 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c0m s GLU 466 N -0.34 3.77 0.02 1.61 2.02 -0.60 -4.81 118.70 120.37 2c0m s GLU 466 Ca 0.00 -1.84 -0.19 0.00 0.02 0.00 0.00 54.97 52.96 2c0m s GLU 466 Cb 0.00 -5.49 -0.21 0.00 0.10 0.00 0.00 34.13 28.52 2c0m s GLU 466 CO 0.00 -2.48 1.15 1.88 0.02 0.00 0.00 175.26 175.83 2c0m h TYR 467 N 7.98 0.63 0.00 1.61 0.99 -1.90 -3.00 116.97 123.28 2c0m h TYR 467 Ca 0.41 -0.32 -0.03 0.00 2.00 0.00 0.00 58.73 60.79 2c0m h TYR 467 Cb 0.89 -0.08 -0.00 0.00 1.00 0.00 0.00 36.73 38.53 2c0m h TYR 467 CO 1.39 1.12 -0.13 0.38 -0.00 0.00 0.00 178.16 180.92 2c0m h ASP 468 N -0.03 0.00 0.26 3.88 3.04 -1.87 -0.24 116.42 121.46 2c0m h ASP 468 Ca -0.06 0.00 -0.17 0.00 -3.24 0.00 0.00 57.03 53.56 2c0m h ASP 468 Cb 1.24 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.53 2c0m h ASP 468 CO 0.11 0.13 -0.68 0.11 -2.04 0.00 0.00 179.24 176.88 2c0m h LYS 469 N 0.00 0.37 -0.05 4.15 1.57 -1.94 -2.69 116.57 117.97 2c0m h LYS 469 Ca -0.00 -0.29 -0.15 0.00 -1.87 0.00 0.00 60.65 58.34 2c0m h LYS 469 Cb 0.31 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2c0m h LYS 469 CO 0.02 0.91 -0.65 0.00 -0.57 0.00 0.00 179.45 179.16 2c0m h ALA 470 N 1.01 0.80 0.62 3.86 0.00 -1.18 -2.52 119.26 121.85 2c0m h ALA 470 Ca -0.02 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 2c0m h ALA 470 Cb 1.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2c0m h ALA 470 CO 0.11 0.77 -0.46 0.28 0.00 0.00 0.00 179.25 179.95 2c0m h VAL 471 N 0.15 0.08 -1.06 0.00 2.07 -1.08 0.18 116.25 116.59 2c0m h VAL 471 Ca -0.01 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.81 2c0m h VAL 471 Cb 1.18 0.08 -0.12 0.00 -1.52 0.00 0.00 31.29 30.90 2c0m h VAL 471 CO 0.10 0.00 0.65 0.44 0.02 0.00 0.00 177.57 178.78 2c0m h ASP 472 N -1.04 0.50 0.26 0.57 5.19 -1.32 0.35 116.42 120.93 2c0m h ASP 472 Ca -0.08 0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.46 2c0m h ASP 472 Cb 0.87 0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.46 2c0m h ASP 472 CO 0.02 -0.02 -0.13 0.00 -3.12 0.00 0.00 179.24 176.00 2c0m h PHE 474 N -0.94 0.21 -0.07 0.00 -1.00 0.13 -1.51 116.94 113.77 2c0m h PHE 474 Ca -0.04 0.01 -0.22 0.00 2.81 0.00 0.00 57.97 60.53 2c0m h PHE 474 Cb 0.49 -0.07 0.01 0.00 3.61 0.00 0.00 35.95 39.99 2c0m h PHE 474 CO 0.05 0.12 -0.85 1.15 -1.61 0.00 0.00 178.31 177.16 2c0m h THR 475 N 0.21 1.33 -0.23 -1.55 2.02 -1.01 -2.12 112.91 111.56 2c0m h THR 475 Ca 0.14 -2.18 -0.05 0.00 0.77 0.00 0.00 66.41 65.09 2c0m h THR 475 Cb 0.27 2.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 2c0m h THR 475 CO -0.02 0.67 -0.06 0.00 0.37 0.00 0.00 175.52 176.47 2c0m h ALA 476 N 0.67 0.32 -0.78 6.16 0.00 -0.95 -2.08 119.26 122.60 2c0m h ALA 476 Ca -0.07 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.68 2c0m h ALA 476 Cb 1.47 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.11 2c0m h ALA 476 CO 0.16 0.12 0.42 0.00 0.00 0.00 0.00 179.25 179.95 2c0m h ALA 477 N 0.75 1.11 -0.15 0.00 0.00 -1.31 -2.13 119.26 117.53 2c0m h ALA 477 Ca 0.06 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 2c0m h ALA 477 Cb 0.52 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2c0m h ALA 477 CO 0.02 0.01 -0.34 -0.07 0.00 0.00 0.00 179.25 178.87 2c0m h LEU 478 N 0.68 0.33 0.00 0.00 3.38 -1.28 0.17 115.31 118.59 2c0m h LEU 478 Ca 0.39 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2c0m h LEU 478 Cb 0.41 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2c0m h LEU 478 CO -0.27 0.66 0.00 -1.54 0.09 0.00 0.00 178.44 177.37 2c0m n SER 479 N -4.07 0.00 -0.09 -0.43 3.41 -0.79 -0.76 113.62 110.89 2c0m n SER 479 Ca -0.01 0.40 -0.11 0.00 -0.26 0.00 0.00 58.87 58.89 2c0m n SER 479 Cb 0.44 -0.44 -0.09 0.00 -0.26 0.00 0.00 64.21 63.87 2c0m n SER 479 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2c0m n VAL 480 N -1.44 1.00 -3.70 -3.33 0.31 -0.80 -4.79 118.33 105.59 2c0m n VAL 480 Ca 0.03 -0.42 -0.28 0.00 -0.01 0.00 0.00 64.34 63.66 2c0m n VAL 480 Cb 0.09 -1.05 -0.10 0.00 -0.91 0.00 0.00 33.84 31.86 2c0m n VAL 480 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2c0m n ARG 481 N -2.94 2.14 0.00 5.55 1.74 -0.02 -4.93 116.66 118.21 2c0m n ARG 481 Ca -0.30 -4.57 0.07 0.00 -0.77 0.00 0.00 57.85 52.28 2c0m n ARG 481 Cb 0.85 -2.28 0.37 0.00 -1.02 0.00 0.00 32.46 30.38 2c0m n ARG 481 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2c0m n PRO 482 N 1.50 0.22 -0.32 5.56 -0.04 0.06 -1.93 135.00 140.04 2c0m n PRO 482 Ca 0.24 0.14 0.09 0.00 -0.04 0.00 0.00 63.50 63.93 2c0m n PRO 482 Cb 0.37 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.59 2c0m n PRO 482 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2c0m n ASN 483 N -1.27 3.62 -4.50 3.54 3.02 -1.26 -4.88 115.26 113.53 2c0m n ASN 483 Ca 0.07 -2.11 -0.43 0.00 -0.03 0.00 0.00 54.58 52.09 2c0m n ASN 483 Cb 0.11 -0.39 -0.03 0.00 -0.61 0.00 0.00 39.78 38.86 2c0m n ASN 483 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2c0m s ASP 484 N -1.04 6.53 0.49 6.41 -1.08 -0.81 -4.83 116.67 122.33 2c0m s ASP 484 Ca 0.38 -1.67 0.19 0.00 -0.52 0.00 0.00 52.55 50.93 2c0m s ASP 484 Cb 0.21 -2.47 1.23 0.00 -1.46 0.00 0.00 42.92 40.43 2c0m s ASP 484 CO 0.24 -1.30 2.07 0.10 0.52 0.00 0.00 175.17 176.80 2c0m h TYR 485 N 9.32 0.00 -0.36 -5.34 -0.00 -1.89 -0.25 116.97 118.45 2c0m h TYR 485 Ca 0.13 0.00 0.07 0.00 0.00 0.00 0.00 58.73 58.93 2c0m h TYR 485 Cb 1.02 0.00 -0.07 0.00 0.00 0.00 0.00 36.73 37.68 2c0m h TYR 485 CO 1.20 0.11 -0.10 1.25 -0.00 0.00 0.00 178.16 180.62 2c0m h LEU 486 N 0.00 -0.35 -0.39 0.10 7.12 -1.97 -2.43 115.31 117.39 2c0m h LEU 486 Ca -0.00 0.11 -0.14 0.00 0.13 0.00 0.00 57.88 57.98 2c0m h LEU 486 Cb 0.22 0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 40.56 2c0m h LEU 486 CO 0.01 -0.13 -0.64 -0.07 -0.13 0.00 0.00 178.44 177.49 2c0m h LEU 487 N -0.01 0.00 0.43 2.25 3.38 -1.50 -2.75 115.31 117.11 2c0m h LEU 487 Ca 0.17 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2c0m h LEU 487 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2c0m h LEU 487 CO -0.37 0.64 -0.21 -0.50 0.09 0.00 0.00 178.44 178.09 2c0m h TRP 488 N 0.00 -0.54 -0.63 1.13 4.06 -1.05 0.45 115.95 119.38 2c0m h TRP 488 Ca -0.01 -0.01 0.12 0.00 2.06 0.00 0.00 58.89 61.06 2c0m h TRP 488 Cb 1.32 0.18 -0.09 0.00 -1.00 0.00 0.00 29.16 29.56 2c0m h TRP 488 CO 0.00 -0.26 0.11 -0.97 -3.56 0.00 0.00 178.44 173.76 2c0m h ASN 489 N -0.74 -0.06 -0.48 -3.49 -1.24 -1.47 0.19 115.58 108.30 2c0m h ASN 489 Ca -0.06 0.13 0.02 0.00 0.71 0.00 0.00 56.30 57.10 2c0m h ASN 489 Cb 0.52 0.19 -0.03 0.00 0.73 0.00 0.00 38.32 39.73 2c0m h ASN 489 CO 0.10 -0.03 0.28 0.11 -1.29 0.00 0.00 177.43 176.60 2c0m h LYS 490 N 0.23 0.55 -0.74 6.67 1.57 -1.40 0.24 116.57 123.70 2c0m h LYS 490 Ca 0.33 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 59.13 2c0m h LYS 490 Cb 0.52 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 2c0m h LYS 490 CO -0.45 0.36 0.49 1.25 -0.57 0.00 0.00 179.45 180.53 2c0m h LEU 491 N 0.57 0.75 -0.36 2.94 5.85 0.11 -0.48 115.31 124.69 2c0m h LEU 491 Ca 0.19 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 2c0m h LEU 491 Cb 0.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 2c0m h LEU 491 CO -0.09 0.50 0.03 1.23 -0.34 0.00 0.00 178.44 179.77 2c0m h GLY 492 N 0.86 0.66 0.92 3.75 0.00 0.26 -1.02 103.07 108.49 2c0m h GLY 492 Ca 0.30 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 2c0m h GLY 492 CO -0.09 0.43 -0.10 0.00 0.00 0.00 0.00 176.54 176.77 2c0m h ALA 493 N 0.88 -0.28 -0.92 3.60 0.00 -0.51 0.61 119.26 122.63 2c0m h ALA 493 Ca 0.10 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2c0m h ALA 493 Cb 0.41 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 2c0m h ALA 493 CO 0.01 -0.62 0.60 1.15 0.00 0.00 0.00 179.25 180.40 2c0m h THR 494 N -0.37 1.05 -0.55 0.00 2.02 -1.09 0.10 112.91 114.07 2c0m h THR 494 Ca -0.03 -0.35 -0.11 0.00 0.77 0.00 0.00 66.41 66.69 2c0m h THR 494 Cb 0.29 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.60 2c0m h THR 494 CO 0.05 0.19 -0.07 -0.07 0.37 0.00 0.00 175.52 175.99 2c0m h LEU 495 N 1.03 1.01 -1.32 2.58 3.38 -1.00 -2.48 115.31 118.52 2c0m h LEU 495 Ca 0.41 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2c0m h LEU 495 Cb 0.24 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2c0m h LEU 495 CO -0.16 1.11 -0.06 0.00 0.09 0.00 0.00 178.44 179.42 2c0m h ALA 496 N 0.94 1.44 0.00 1.53 0.00 0.27 0.20 119.26 123.64 2c0m h ALA 496 Ca 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2c0m h ALA 496 Cb 0.63 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2c0m h ALA 496 CO 0.04 0.39 -0.16 -0.91 0.00 0.00 0.00 179.25 178.62 2c0m h ASN 497 N 0.37 0.00 -0.45 0.00 2.35 -0.66 -2.39 115.58 114.81 2c0m h ASN 497 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2c0m h ASN 497 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.71 2c0m h ASN 497 CO 0.01 0.16 0.00 0.61 -1.65 0.00 0.00 177.43 176.56 2c0m n GLY 498 N 0.17 2.36 3.74 2.83 0.00 -0.84 -4.93 105.19 108.53 2c0m n GLY 498 Ca 0.00 -0.65 -0.28 0.00 0.00 0.00 0.00 46.02 45.09 2c0m n GLY 498 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c0m n ASN 499 N 0.59 -4.94 -3.69 1.61 3.02 -0.90 -4.93 115.26 106.02 2c0m n ASN 499 Ca 0.20 -0.67 -0.38 0.00 -0.03 0.00 0.00 54.58 53.70 2c0m n ASN 499 Cb 0.84 -3.95 -0.01 0.00 -0.61 0.00 0.00 39.78 36.05 2c0m n ASN 499 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c0m n GLN 500 N -4.53 4.29 -0.01 3.52 1.13 0.66 -4.89 117.38 117.55 2c0m n GLN 500 Ca 0.02 -4.64 -0.00 0.00 -1.94 0.00 0.00 57.00 50.43 2c0m n GLN 500 Cb 0.54 -2.43 0.29 0.00 0.11 0.00 0.00 30.24 28.75 2c0m n GLN 500 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2c0m h SER 501 N 4.61 0.50 -0.14 1.08 0.02 -1.89 -1.51 113.55 116.22 2c0m h SER 501 Ca 0.29 -0.10 -0.21 0.00 -0.84 0.00 0.00 61.79 60.93 2c0m h SER 501 Cb 0.53 -0.13 0.01 0.00 0.14 0.00 0.00 62.40 62.94 2c0m h SER 501 CO 1.15 0.58 -0.74 -0.08 -1.14 0.00 0.00 176.83 176.60 2c0m h GLU 502 N 0.51 0.75 -0.08 3.45 4.57 -1.91 -1.46 114.58 120.41 2c0m h GLU 502 Ca 0.11 -0.62 -0.07 0.00 -1.18 0.00 0.00 59.36 57.60 2c0m h GLU 502 Cb 0.34 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 2c0m h GLU 502 CO 0.01 1.23 -0.27 0.93 -1.18 0.00 0.00 179.01 179.73 2c0m h GLU 503 N 0.47 0.15 0.12 1.92 3.07 -1.93 -2.91 114.58 115.47 2c0m h GLU 503 Ca -0.05 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 2c0m h GLU 503 Cb 1.37 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 2c0m h GLU 503 CO 0.15 0.41 -0.06 0.00 -1.40 0.00 0.00 179.01 178.11 2c0m h ALA 504 N 1.60 -0.16 -0.91 3.43 0.00 -1.13 -2.76 119.26 119.33 2c0m h ALA 504 Ca 0.02 -0.25 0.11 0.00 0.00 0.00 0.00 54.91 54.79 2c0m h ALA 504 Cb 0.55 0.06 -0.13 0.00 0.00 0.00 0.00 17.79 18.27 2c0m h ALA 504 CO 0.04 -0.28 -0.50 0.28 0.00 0.00 0.00 179.25 178.79 2c0m h VAL 505 N -0.78 0.01 -0.79 0.00 2.07 -1.31 0.62 116.25 116.08 2c0m h VAL 505 Ca -0.02 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.66 2c0m h VAL 505 Cb 0.55 0.01 -0.10 0.00 -1.52 0.00 0.00 31.29 30.23 2c0m h VAL 505 CO 0.03 0.00 0.31 0.00 0.02 0.00 0.00 177.57 177.93 2c0m h ALA 506 N 0.80 1.13 -0.43 1.67 0.00 -1.54 0.18 119.26 121.07 2c0m h ALA 506 Ca 0.22 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 2c0m h ALA 506 Cb 0.51 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2c0m h ALA 506 CO -0.91 -0.24 0.18 0.00 0.00 0.00 0.00 179.25 178.28 2c0m h ALA 507 N 1.59 0.56 -0.49 0.00 0.00 -0.74 -1.98 119.26 118.20 2c0m h ALA 507 Ca 0.45 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 2c0m h ALA 507 Cb 0.72 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2c0m h ALA 507 CO -0.44 0.15 0.12 1.88 0.00 0.00 0.00 179.25 180.96 2c0m h TYR 508 N 0.55 0.82 -0.85 0.00 0.99 0.11 -1.79 116.97 116.80 2c0m h TYR 508 Ca 0.14 -0.10 0.06 0.00 2.00 0.00 0.00 58.73 60.84 2c0m h TYR 508 Cb 0.17 -0.23 -0.06 0.00 1.00 0.00 0.00 36.73 37.61 2c0m h TYR 508 CO -0.00 0.73 0.53 0.00 -0.00 0.00 0.00 178.16 179.41 2c0m h ARG 509 N 0.67 0.94 -0.46 4.88 3.08 -0.62 -0.30 114.38 122.57 2c0m h ARG 509 Ca 0.15 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 2c0m h ARG 509 Cb 0.32 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2c0m h ARG 509 CO 0.00 0.62 0.10 -0.09 -1.07 0.00 0.00 179.97 179.53 2c0m h ARG 510 N 0.97 0.69 -0.17 0.04 9.65 -0.61 0.00 114.38 124.95 2c0m h ARG 510 Ca 0.37 -0.13 -0.04 0.00 -1.10 0.00 0.00 59.98 59.08 2c0m h ARG 510 Cb 0.16 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 2c0m h ARG 510 CO -0.17 0.63 -0.05 0.00 2.80 0.00 0.00 179.97 183.18 2c0m h ALA 511 N 1.45 0.24 -0.87 2.80 0.00 -0.53 -2.44 119.26 119.90 2c0m h ALA 511 Ca 0.15 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2c0m h ALA 511 Cb 0.26 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2c0m h ALA 511 CO -0.00 0.02 0.52 -0.07 0.00 0.00 0.00 179.25 179.71 2c0m h LEU 512 N 0.04 1.05 -0.32 0.00 3.38 -0.52 0.36 115.31 119.30 2c0m h LEU 512 Ca 0.04 -0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.02 2c0m h LEU 512 Cb 0.50 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.91 2c0m h LEU 512 CO 0.02 0.81 -0.32 -0.33 0.09 0.00 0.00 178.44 178.71 2c0m h GLU 513 N 1.20 -0.28 0.00 1.13 5.08 -1.01 -1.43 114.58 119.27 2c0m h GLU 513 Ca 0.31 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.62 2c0m h GLU 513 Cb -0.04 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2c0m h GLU 513 CO -0.06 -0.19 -0.32 -0.07 -1.00 0.00 0.00 179.01 177.37 2c0m h LEU 514 N -0.29 0.00 -6.14 1.33 3.38 -0.32 -3.37 115.31 109.90 2c0m h LEU 514 Ca 0.15 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.94 2c0m h LEU 514 Cb 0.53 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.05 2c0m h LEU 514 CO -0.48 0.32 -0.54 -1.58 0.09 0.00 0.00 178.44 176.26 2c0m s GLN 515 N -3.61 0.72 0.56 1.13 -0.44 0.10 -5.00 119.66 113.13 2c0m s GLN 515 Ca 0.00 -0.43 0.27 0.00 -2.50 0.00 0.00 55.36 52.71 2c0m s GLN 515 Cb 0.11 -0.21 1.48 0.00 -1.64 0.00 0.00 33.01 32.75 2c0m s GLN 515 CO 0.67 -1.18 1.98 -1.35 0.50 0.00 0.00 175.29 175.91 2c0m h PRO 516 N 7.12 0.00 -0.59 1.67 0.11 -1.44 -1.59 132.00 137.27 2c0m h PRO 516 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2c0m h PRO 516 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2c0m h PRO 516 CO 0.15 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.35 2c0m n GLY 517 N -1.55 1.16 2.94 -0.55 0.00 -1.26 -4.57 105.19 101.36 2c0m n GLY 517 Ca 0.08 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 2c0m n GLY 517 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2c0m n TYR 518 N 0.20 3.48 -0.30 1.61 9.36 -0.60 -4.83 117.16 126.08 2c0m n TYR 518 Ca 0.09 -2.92 -0.05 0.00 3.32 0.00 0.00 57.90 58.34 2c0m n TYR 518 Cb 0.40 -2.22 -0.03 0.00 -0.63 0.00 0.00 39.34 36.87 2c0m n TYR 518 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 2c0m n ILE 519 N 4.25 -0.46 -0.32 2.97 2.08 -1.26 -0.97 119.36 125.66 2c0m n ILE 519 Ca 0.44 1.79 0.14 0.00 0.56 0.00 0.00 62.75 65.68 2c0m n ILE 519 Cb 0.39 -2.27 0.30 0.00 -0.75 0.00 0.00 39.64 37.30 2c0m n ILE 519 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 2c0m h ARG 520 N 0.00 0.08 -0.18 0.38 2.43 -1.95 0.53 114.38 115.67 2c0m h ARG 520 Ca 0.18 -0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.25 2c0m h ARG 520 Cb 0.37 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2c0m h ARG 520 CO -0.72 0.05 -0.30 0.77 -1.51 0.00 0.00 179.97 178.26 2c0m h SER 521 N 0.08 0.35 0.40 -3.80 0.02 -1.43 0.22 113.55 109.39 2c0m h SER 521 Ca 0.58 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 61.28 2c0m h SER 521 Cb 1.22 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 2c0m h SER 521 CO -0.80 0.65 -0.55 -0.09 -1.14 0.00 0.00 176.83 174.90 2c0m h ARG 522 N 0.30 0.16 0.29 3.45 2.43 0.05 0.11 114.38 121.18 2c0m h ARG 522 Ca 0.04 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2c0m h ARG 522 Cb 0.69 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 2c0m h ARG 522 CO 0.05 0.67 -0.14 -0.92 -1.51 0.00 0.00 179.97 178.13 2c0m h TYR 523 N 0.13 -0.35 -0.72 2.20 3.20 -0.42 -2.26 116.97 118.73 2c0m h TYR 523 Ca -0.00 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.95 2c0m h TYR 523 Cb 1.01 0.12 -0.11 0.00 1.54 0.00 0.00 36.73 39.28 2c0m h TYR 523 CO 0.01 -0.08 -0.50 -0.91 -1.64 0.00 0.00 178.16 175.04 2c0m h ASN 524 N -1.03 -1.75 -0.93 -2.11 2.35 -0.62 0.24 115.58 111.73 2c0m h ASN 524 Ca -0.04 0.28 0.24 0.00 -0.55 0.00 0.00 56.30 56.23 2c0m h ASN 524 Cb 0.43 0.79 -0.13 0.00 0.05 0.00 0.00 38.32 39.46 2c0m h ASN 524 CO 0.06 -0.31 0.45 0.25 -1.65 0.00 0.00 177.43 176.23 2c0m h LEU 525 N -0.16 0.42 -0.49 1.61 5.85 -0.83 0.20 115.31 121.91 2c0m h LEU 525 Ca 0.18 0.15 -0.15 0.00 0.84 0.00 0.00 57.88 58.91 2c0m h LEU 525 Cb 0.53 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 2c0m h LEU 525 CO -0.78 0.01 -0.34 1.23 -0.34 0.00 0.00 178.44 178.22 2c0m h GLY 526 N 0.43 0.96 0.72 3.75 0.00 -0.01 -2.16 103.07 106.76 2c0m h GLY 526 Ca 0.60 -0.93 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 2c0m h GLY 526 CO -0.53 0.84 -0.38 -2.22 0.00 0.00 0.00 176.54 174.25 2c0m h ILE 527 N 0.73 0.23 -0.55 2.60 2.04 0.15 -2.54 117.51 120.17 2c0m h ILE 527 Ca 0.07 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.09 2c0m h ILE 527 Cb 0.91 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2c0m h ILE 527 CO 0.08 0.00 0.40 0.28 0.00 0.00 0.00 178.15 178.91 2c0m h SER 528 N -0.85 0.00 -0.59 1.72 0.02 -0.96 0.32 113.55 113.21 2c0m h SER 528 Ca -0.05 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 2c0m h SER 528 Cb 0.73 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.24 2c0m h SER 528 CO -0.00 0.00 0.24 0.00 -1.14 0.00 0.00 176.83 175.93 2c0m h ILE 530 N 0.81 1.26 0.00 0.00 1.08 -0.02 0.39 117.51 121.04 2c0m h ILE 530 Ca 0.20 -0.59 0.00 0.00 -0.39 0.00 0.00 64.86 64.07 2c0m h ILE 530 Cb 0.19 -0.04 0.00 0.00 -3.07 0.00 0.00 36.82 33.90 2c0m h ILE 530 CO -0.02 0.28 0.00 0.59 -0.69 0.00 0.00 178.15 178.31 2c0m n ASN 531 N -4.34 0.26 -0.43 1.72 3.02 -0.89 -2.48 115.26 112.11 2c0m n ASN 531 Ca 0.10 0.58 0.05 0.00 -0.03 0.00 0.00 54.58 55.28 2c0m n ASN 531 Cb 0.07 -0.63 0.06 0.00 -0.61 0.00 0.00 39.78 38.68 2c0m n ASN 531 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2c0m n LEU 532 N -1.80 2.05 0.00 3.41 4.77 0.05 -4.97 117.00 120.50 2c0m n LEU 532 Ca 0.02 -1.23 0.00 0.00 -0.03 0.00 0.00 56.01 54.77 2c0m n LEU 532 Cb 0.13 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2c0m n LEU 532 CO 0.12 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 2c0m n GLY 533 N 0.52 0.94 2.77 -0.72 0.00 -0.83 -4.94 105.19 102.92 2c0m n GLY 533 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2c0m n GLY 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c0m n ALA 534 N 0.46 5.61 -0.11 4.61 0.00 -0.71 -4.77 120.51 125.60 2c0m n ALA 534 Ca 0.00 -4.10 -0.12 0.00 0.00 0.00 0.00 53.44 49.22 2c0m n ALA 534 Cb 0.00 -3.21 -0.03 0.00 0.00 0.00 0.00 19.45 16.21 2c0m n ALA 534 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2c0m h HIS 535 N 5.75 0.76 0.76 0.00 3.86 -1.91 -1.67 115.15 122.70 2c0m h HIS 535 Ca 0.50 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.49 2c0m h HIS 535 Cb 0.60 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.89 2c0m h HIS 535 CO 1.38 0.87 -0.46 -0.09 0.86 0.00 0.00 177.93 180.49 2c0m h ARG 536 N 0.42 -1.10 -0.85 2.45 2.43 -1.89 0.83 114.38 116.68 2c0m h ARG 536 Ca 0.07 0.07 0.20 0.00 -0.81 0.00 0.00 59.98 59.51 2c0m h ARG 536 Cb 0.67 0.25 -0.06 0.00 -0.42 0.00 0.00 29.97 30.41 2c0m h ARG 536 CO 0.04 -0.73 0.57 1.49 -1.51 0.00 0.00 179.97 179.83 2c0m h GLU 537 N -1.14 0.32 0.02 0.20 4.81 -1.95 0.37 114.58 117.22 2c0m h GLU 537 Ca -0.10 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2c0m h GLU 537 Cb 0.91 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.22 2c0m h GLU 537 CO 0.10 0.21 -0.01 0.00 -0.73 0.00 0.00 179.01 178.59 2c0m h ALA 538 N 1.62 -0.03 -0.61 2.92 0.00 -0.74 -2.00 119.26 120.41 2c0m h ALA 538 Ca 0.43 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 55.31 2c0m h ALA 538 Cb 1.16 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.85 2c0m h ALA 538 CO -0.13 -0.37 -0.13 0.28 0.00 0.00 0.00 179.25 178.90 2c0m h VAL 539 N -0.33 0.40 -0.17 0.00 2.07 0.21 -0.26 116.25 118.17 2c0m h VAL 539 Ca -0.00 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.54 2c0m h VAL 539 Cb 0.32 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 2c0m h VAL 539 CO 0.01 0.00 -0.03 -0.33 0.02 0.00 0.00 177.57 177.24 2c0m h GLU 540 N 0.02 0.01 -0.70 1.57 5.08 -0.88 -1.91 114.58 117.78 2c0m h GLU 540 Ca 0.30 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2c0m h GLU 540 Cb 0.47 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2c0m h GLU 540 CO -0.62 0.01 0.43 0.45 -1.00 0.00 0.00 179.01 178.28 2c0m h HIS 541 N 0.01 0.91 -0.23 4.33 3.86 -0.32 -1.06 115.15 122.64 2c0m h HIS 541 Ca 0.08 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.15 2c0m h HIS 541 Cb 0.12 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.28 2c0m h HIS 541 CO -0.19 0.60 -0.45 0.74 0.86 0.00 0.00 177.93 179.49 2c0m h PHE 542 N 0.96 0.71 -0.45 2.45 0.05 -0.87 -1.63 116.94 118.16 2c0m h PHE 542 Ca 0.25 -0.22 -0.09 0.00 3.82 0.00 0.00 57.97 61.73 2c0m h PHE 542 Cb -0.05 -0.15 -0.02 0.00 2.00 0.00 0.00 35.95 37.74 2c0m h PHE 542 CO 0.00 0.94 -0.05 -0.07 -0.18 0.00 0.00 178.31 178.95 2c0m h LEU 543 N 0.47 0.83 -0.79 1.54 3.38 -0.68 -0.42 115.31 119.64 2c0m h LEU 543 Ca 0.03 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.58 2c0m h LEU 543 Cb 0.98 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2c0m h LEU 543 CO 0.09 0.97 0.03 -0.33 0.09 0.00 0.00 178.44 179.29 2c0m h GLU 544 N 0.68 0.94 0.24 1.13 4.39 -1.10 -0.84 114.58 120.01 2c0m h GLU 544 Ca 0.12 -0.26 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 2c0m h GLU 544 Cb 0.58 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 2c0m h GLU 544 CO 0.03 0.91 -0.11 0.00 -1.16 0.00 0.00 179.01 178.69 2c0m h ALA 545 N 1.15 -0.32 -0.60 3.43 0.00 -1.08 -1.30 119.26 120.54 2c0m h ALA 545 Ca 0.17 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.11 2c0m h ALA 545 Cb 0.48 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.28 2c0m h ALA 545 CO 0.02 -0.65 -0.04 -0.07 0.00 0.00 0.00 179.25 178.52 2c0m h LEU 546 N -0.38 -0.34 -0.12 0.00 3.38 -0.91 -1.99 115.31 114.96 2c0m h LEU 546 Ca -0.03 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2c0m h LEU 546 Cb 0.29 0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2c0m h LEU 546 CO 0.05 -0.13 0.07 -1.13 0.09 0.00 0.00 178.44 177.39 2c0m h ASN 547 N 0.08 0.15 -0.78 -0.43 -0.73 -0.95 -0.76 115.58 112.17 2c0m h ASN 547 Ca 0.31 -0.07 0.07 0.00 1.87 0.00 0.00 56.30 58.48 2c0m h ASN 547 Cb 0.49 -0.04 -0.05 0.00 0.27 0.00 0.00 38.32 38.99 2c0m h ASN 547 CO -0.54 0.18 0.51 0.24 -0.37 0.00 0.00 177.43 177.45 2c0m h MET 548 N 0.11 0.78 -0.33 6.67 2.86 -0.88 0.56 114.93 124.70 2c0m h MET 548 Ca 0.04 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 2c0m h MET 548 Cb 0.06 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 2c0m h MET 548 CO -0.01 0.52 0.01 1.96 1.06 0.00 0.00 176.91 180.45 2c0m h GLN 549 N 0.81 0.58 -0.36 1.72 4.20 -0.80 -2.24 115.11 119.02 2c0m h GLN 549 Ca 0.34 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 2c0m h GLN 549 Cb 0.28 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 2c0m h GLN 549 CO -0.12 0.70 0.20 -0.09 -0.67 0.00 0.00 178.83 178.85 2c0m h ARG 550 N 0.39 0.51 0.00 1.46 2.43 -0.08 -2.81 114.38 116.28 2c0m h ARG 550 Ca 0.09 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2c0m h ARG 550 Cb 0.44 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2c0m h ARG 550 CO 0.02 0.42 -0.02 0.87 -1.51 0.00 0.00 179.97 179.75 2c0m h LYS 551 N 0.46 0.00 -6.29 0.20 1.57 0.20 -3.19 116.57 109.52 2c0m h LYS 551 Ca 0.13 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.38 2c0m h LYS 551 Cb 0.06 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.30 2c0m h LYS 551 CO -0.02 0.02 1.13 0.45 -0.57 0.00 0.00 179.45 180.46 2c0m s SER 552 N -6.09 5.97 -0.15 0.86 0.15 -0.85 -4.89 113.70 108.70 2c0m s SER 552 Ca -0.05 -0.15 -0.18 0.00 0.70 0.00 0.00 55.95 56.28 2c0m s SER 552 Cb 0.15 -2.55 -0.15 0.00 -1.71 0.00 0.00 66.02 61.75 2c0m s SER 552 CO 0.54 -1.93 0.29 0.03 1.20 0.00 0.00 173.24 173.37 2c0m h ARG 553 N 11.26 0.00 0.00 5.44 2.47 -1.74 -3.38 114.38 128.43 2c0m h ARG 553 Ca -0.27 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 2c0m h ARG 553 Cb 1.08 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.40 2c0m h ARG 553 CO 1.25 0.65 0.00 0.41 0.56 0.00 0.00 179.97 182.83 2c0m n GLY 554 N 1.59 1.22 0.18 0.04 0.00 -1.26 -4.13 105.19 102.82 2c0m n GLY 554 Ca -0.15 -2.19 0.14 0.00 0.00 0.00 0.00 46.02 43.83 2c0m n GLY 554 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2c0m n PRO 555 N -0.31 0.93 -3.59 1.61 -0.04 -1.26 -4.60 135.00 127.74 2c0m n PRO 555 Ca 0.00 -0.36 -0.24 0.00 -0.04 0.00 0.00 63.50 62.86 2c0m n PRO 555 Cb 0.00 -1.49 -0.16 0.00 -0.04 0.00 0.00 33.50 31.81 2c0m n PRO 555 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2c0m s ARG 556 N -2.32 0.08 0.00 0.54 0.52 -1.26 -5.05 118.95 111.46 2c0m s ARG 556 Ca 0.33 0.01 0.00 0.00 -0.52 0.00 0.00 55.73 55.54 2c0m s ARG 556 Cb 0.20 -1.63 0.00 0.00 0.52 0.00 0.00 34.95 34.05 2c0m s ARG 556 CO 0.44 -0.65 0.00 0.41 0.02 0.00 0.00 175.30 175.52 2c0m n GLY 557 N 5.29 0.00 0.00 -3.53 0.00 -1.26 -4.54 105.19 101.14 2c0m n GLY 557 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2c0m n GLY 557 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2c0m n GLU 558 N 0.00 0.00 0.00 1.61 2.13 -1.26 -4.83 120.64 118.29 2c0m n GLU 558 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2c0m n GLU 558 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2c0m n GLU 558 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2c0m n GLY 559 N 0.00 -0.58 2.78 8.31 0.00 -1.26 -5.05 105.19 109.38 2c0m n GLY 559 Ca 0.00 -2.17 -0.16 0.00 0.00 0.00 0.00 46.02 43.69 2c0m n GLY 559 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c0m s GLY 560 N 0.00 0.10 -0.28 -0.02 0.00 -1.20 -4.27 107.32 101.64 2c0m s GLY 560 Ca 0.00 0.37 -0.29 0.00 0.00 0.00 0.00 44.72 44.80 2c0m s GLY 560 CO 0.00 1.03 1.42 0.00 0.00 0.00 0.00 173.10 175.55 2c0m s ALA 561 N 1.51 3.30 0.11 3.20 0.00 -1.25 -4.09 121.76 124.53 2c0m s ALA 561 Ca -0.04 0.20 -0.03 0.00 0.00 0.00 0.00 51.96 52.09 2c0m s ALA 561 Cb -0.12 -3.82 -0.05 0.00 0.00 0.00 0.00 23.12 19.13 2c0m s ALA 561 CO -0.04 -1.89 0.32 -1.64 0.00 0.00 0.00 175.76 172.50 2c0m s MET 562 N 4.42 3.55 -0.01 0.00 -1.94 -1.26 -4.66 119.30 119.40 2c0m s MET 562 Ca 0.62 -0.21 -0.19 0.00 -1.71 0.00 0.00 55.69 54.20 2c0m s MET 562 Cb -0.19 -2.92 -0.05 0.00 2.01 0.00 0.00 34.83 33.68 2c0m s MET 562 CO 0.26 0.52 0.54 -1.12 -0.01 0.00 0.00 175.02 175.20 2c0m s SER 563 N -2.46 6.90 0.32 3.03 0.01 -1.26 -4.97 113.70 115.28 2c0m s SER 563 Ca 0.39 1.08 0.08 0.00 1.31 0.00 0.00 55.95 58.80 2c0m s SER 563 Cb -0.12 -2.33 0.53 0.00 0.21 0.00 0.00 66.02 64.31 2c0m s SER 563 CO 0.26 0.15 1.74 -0.33 0.41 0.00 0.00 173.24 175.47 2c0m h GLU 564 N 5.51 0.20 -0.46 12.44 4.39 -1.99 -2.36 114.58 132.32 2c0m h GLU 564 Ca -0.46 -0.09 0.09 0.00 0.34 0.00 0.00 59.36 59.25 2c0m h GLU 564 Cb 1.20 -0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 29.75 2c0m h GLU 564 CO 0.68 0.55 -0.22 -0.97 -1.16 0.00 0.00 179.01 177.89 2c0m h ASN 565 N 0.17 -0.75 0.42 1.42 -1.24 -2.00 0.03 115.58 113.64 2c0m h ASN 565 Ca 0.02 0.17 -0.16 0.00 0.71 0.00 0.00 56.30 57.04 2c0m h ASN 565 Cb 0.74 0.41 -0.01 0.00 0.73 0.00 0.00 38.32 40.19 2c0m h ASN 565 CO 0.06 -0.25 -0.69 0.40 -1.29 0.00 0.00 177.43 175.66 2c0m h ILE 566 N -0.12 1.42 -0.22 2.57 2.04 -1.91 -2.81 117.51 118.48 2c0m h ILE 566 Ca 0.22 -2.17 -0.02 0.00 1.00 0.00 0.00 64.86 63.88 2c0m h ILE 566 Cb 0.46 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 2c0m h ILE 566 CO -0.54 0.64 0.05 -0.50 0.00 0.00 0.00 178.15 177.80 2c0m h TRP 567 N 0.16 0.38 -0.41 1.37 4.06 -0.85 -1.88 115.95 118.78 2c0m h TRP 567 Ca -0.02 -0.05 -0.00 0.00 2.06 0.00 0.00 58.89 60.88 2c0m h TRP 567 Cb 1.23 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 29.26 2c0m h TRP 567 CO 0.02 0.47 0.24 0.66 -3.56 0.00 0.00 178.44 176.28 2c0m h SER 568 N 0.18 0.50 -0.73 -3.49 4.64 -1.02 -1.19 113.55 112.44 2c0m h SER 568 Ca 0.07 -0.06 0.04 0.00 -0.47 0.00 0.00 61.79 61.37 2c0m h SER 568 Cb 0.28 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 62.21 2c0m h SER 568 CO 0.00 0.41 0.48 0.74 -0.87 0.00 0.00 176.83 177.60 2c0m h THR 569 N 0.54 1.09 -0.41 2.95 2.02 -1.46 -2.63 112.91 115.01 2c0m h THR 569 Ca 0.15 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 66.99 2c0m h THR 569 Cb 0.01 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.56 2c0m h THR 569 CO -0.03 0.16 0.10 0.25 0.37 0.00 0.00 175.52 176.37 2c0m h LEU 570 N 0.86 0.62 -1.21 2.58 5.85 -0.54 -0.98 115.31 122.49 2c0m h LEU 570 Ca 0.30 -0.23 0.09 0.00 0.84 0.00 0.00 57.88 58.87 2c0m h LEU 570 Cb 0.11 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 2c0m h LEU 570 CO -0.09 0.69 0.57 0.03 -0.34 0.00 0.00 178.44 179.30 2c0m h ARG 571 N 0.52 0.87 -0.09 1.25 2.47 -0.88 -0.12 114.38 118.39 2c0m h ARG 571 Ca 0.13 -0.05 -0.10 0.00 -1.26 0.00 0.00 59.98 58.69 2c0m h ARG 571 Cb 0.31 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.44 2c0m h ARG 571 CO 0.00 0.58 -0.34 1.25 0.56 0.00 0.00 179.97 182.02 2c0m h LEU 572 N 0.90 0.46 -0.72 3.04 6.46 -1.31 -1.30 115.31 122.85 2c0m h LEU 572 Ca 0.39 -0.62 0.05 0.00 -0.12 0.00 0.00 57.88 57.59 2c0m h LEU 572 Cb 0.35 -0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 40.09 2c0m h LEU 572 CO -0.16 1.01 0.42 0.00 -0.62 0.00 0.00 178.44 179.09 2c0m h ALA 573 N 0.47 0.96 -0.53 1.25 0.00 -0.75 -0.96 119.26 119.70 2c0m h ALA 573 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c0m h ALA 573 Cb 0.97 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2c0m h ALA 573 CO 0.07 0.14 0.35 -0.07 0.00 0.00 0.00 179.25 179.74 2c0m h LEU 574 N 0.79 0.61 -0.05 0.00 3.38 -0.88 -2.10 115.31 117.06 2c0m h LEU 574 Ca 0.31 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 2c0m h LEU 574 Cb 0.14 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2c0m h LEU 574 CO -0.16 0.45 0.02 0.28 0.09 0.00 0.00 178.44 179.11 2c0m h SER 575 N 0.72 0.07 0.98 -0.43 0.02 0.00 -0.28 113.55 114.64 2c0m h SER 575 Ca 0.19 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2c0m h SER 575 Cb -0.08 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.44 2c0m h SER 575 CO -0.04 0.25 0.00 0.24 -1.14 0.00 0.00 176.83 176.14 2c0m h MET 576 N -0.10 0.00 0.23 3.45 2.86 -1.07 0.01 114.93 120.31 2c0m h MET 576 Ca 0.02 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.35 2c0m h MET 576 Cb 0.20 0.00 0.04 0.00 0.06 0.00 0.00 31.60 31.90 2c0m h MET 576 CO -0.00 0.00 -1.34 1.25 1.06 0.00 0.00 176.91 177.88 2c0m h LEU 577 N 0.00 0.77 0.00 1.22 5.85 -1.20 -3.49 115.31 118.46 2c0m h LEU 577 Ca 0.00 -0.93 0.00 0.00 0.84 0.00 0.00 57.88 57.79 2c0m h LEU 577 Cb 0.49 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.27 2c0m h LEU 577 CO 0.00 1.65 0.00 0.61 -0.34 0.00 0.00 178.44 180.36 2c0m n GLY 578 N 1.71 0.71 2.80 3.75 0.00 -0.01 -4.98 105.19 109.16 2c0m n GLY 578 Ca -0.16 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 2c0m n GLY 578 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2c0m n GLN 579 N -2.53 2.38 -0.32 1.61 -0.06 -1.18 -4.80 117.38 112.49 2c0m n GLN 579 Ca 0.00 -2.15 0.19 0.00 -2.00 0.00 0.00 57.00 53.04 2c0m n GLN 579 Cb 0.00 -3.00 0.39 0.00 -4.06 0.00 0.00 30.24 23.57 2c0m n GLN 579 CO 0.00 0.00 0.00 0.77 -0.20 0.00 0.00 177.06 177.63 2c0m h SER 580 N 6.59 0.16 0.32 1.69 0.02 -1.94 0.07 113.55 120.47 2c0m h SER 580 Ca 0.55 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.71 2c0m h SER 580 Cb 0.55 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.34 2c0m h SER 580 CO 1.85 -0.21 0.00 -0.90 -1.14 0.00 0.00 176.83 176.43 2c0m n ASP 581 N -5.20 0.00 -0.50 3.07 3.85 -1.26 -1.81 116.55 114.69 2c0m n ASP 581 Ca 0.27 0.18 0.12 0.00 -0.71 0.00 0.00 54.79 54.66 2c0m n ASP 581 Cb 0.87 -0.34 0.20 0.00 -1.35 0.00 0.00 41.12 40.51 2c0m n ASP 581 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2c0m n ALA 582 N -1.34 3.09 0.03 2.12 0.00 0.01 -4.48 120.51 119.94 2c0m n ALA 582 Ca 0.06 -0.55 -0.20 0.00 0.00 0.00 0.00 53.44 52.75 2c0m n ALA 582 Cb 0.13 -0.95 -0.11 0.00 0.00 0.00 0.00 19.45 18.52 2c0m n ALA 582 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2c0m h TYR 583 N 2.46 0.92 -0.75 0.00 -1.99 -1.47 -2.98 116.97 113.16 2c0m h TYR 583 Ca 0.00 -0.51 0.04 0.00 2.00 0.00 0.00 58.73 60.26 2c0m h TYR 583 Cb 0.69 -0.10 -0.05 0.00 2.00 0.00 0.00 36.73 39.27 2c0m h TYR 583 CO 0.00 1.34 0.47 0.78 -0.00 0.00 0.00 178.16 180.75 2c0m h GLY 584 N 0.24 1.09 0.94 3.88 0.00 -1.79 -2.19 103.07 105.26 2c0m h GLY 584 Ca -0.12 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2c0m h GLY 584 CO 0.18 0.29 0.16 0.00 0.00 0.00 0.00 176.54 177.17 2c0m h ALA 585 N 1.33 0.49 -1.00 3.60 0.00 -1.84 -2.15 119.26 119.70 2c0m h ALA 585 Ca 0.31 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.17 2c0m h ALA 585 Cb 0.05 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.62 2c0m h ALA 585 CO -0.12 0.08 0.64 0.00 0.00 0.00 0.00 179.25 179.85 2c0m h ALA 586 N 1.01 1.46 0.00 0.00 0.00 -1.31 -1.30 119.26 119.11 2c0m h ALA 586 Ca 0.13 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 2c0m h ALA 586 Cb 0.17 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2c0m h ALA 586 CO -0.01 0.36 -0.69 -0.44 0.00 0.00 0.00 179.25 178.47 2c0m h ASP 587 N 1.10 0.00 0.20 0.00 3.32 -1.32 -2.78 116.42 116.94 2c0m h ASP 587 Ca 0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.50 2c0m h ASP 587 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2c0m h ASP 587 CO -0.20 0.69 -0.05 0.00 -1.72 0.00 0.00 179.24 177.96 2c0m n ALA 588 N -2.38 2.69 -2.52 3.45 0.00 -0.59 -4.93 120.51 116.22 2c0m n ALA 588 Ca -0.01 -0.27 -0.16 0.00 0.00 0.00 0.00 53.44 53.01 2c0m n ALA 588 Cb 0.70 -1.37 0.01 0.00 0.00 0.00 0.00 19.45 18.78 2c0m n ALA 588 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2c0m n ARG 589 N -0.79 -2.25 -3.33 0.00 3.00 -0.59 -4.97 116.66 107.74 2c0m n ARG 589 Ca 0.18 0.71 -0.46 0.00 -0.01 0.00 0.00 57.85 58.27 2c0m n ARG 589 Cb 0.24 -5.05 -0.01 0.00 0.00 0.00 0.00 32.46 27.63 2c0m n ARG 589 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2c0m s ASP 590 N -2.52 7.03 0.16 0.55 2.15 -0.60 -4.88 116.67 118.56 2c0m s ASP 590 Ca 0.10 -3.11 -0.12 0.00 0.43 0.00 0.00 52.55 49.85 2c0m s ASP 590 Cb -0.04 -2.21 0.06 0.00 -0.30 0.00 0.00 42.92 40.42 2c0m s ASP 590 CO 0.12 -0.45 1.69 0.25 -0.17 0.00 0.00 175.17 176.61 2c0m h LEU 591 N 7.31 0.83 -0.54 -1.34 5.85 -1.93 -2.77 115.31 122.72 2c0m h LEU 591 Ca 0.14 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.70 2c0m h LEU 591 Cb 0.96 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 2c0m h LEU 591 CO 0.88 0.83 0.28 0.28 -0.34 0.00 0.00 178.44 180.37 2c0m h SER 592 N 0.79 0.41 -0.29 1.25 0.02 -1.99 0.24 113.55 113.97 2c0m h SER 592 Ca 0.18 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 2c0m h SER 592 Cb 0.30 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2c0m h SER 592 CO -0.00 0.28 0.10 0.74 -1.14 0.00 0.00 176.83 176.80 2c0m h THR 593 N 0.54 1.20 0.20 -2.27 2.02 -1.96 -2.86 112.91 109.78 2c0m h THR 593 Ca 0.24 -0.63 0.01 0.00 0.77 0.00 0.00 66.41 66.80 2c0m h THR 593 Cb 0.14 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 2c0m h THR 593 CO -0.16 0.21 -0.31 -0.07 0.37 0.00 0.00 175.52 175.56 2c0m h LEU 594 N 0.32 -0.88 -0.59 2.58 3.38 -1.07 -1.56 115.31 117.49 2c0m h LEU 594 Ca 0.10 0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.26 2c0m h LEU 594 Cb 0.23 0.32 -0.11 0.00 0.09 0.00 0.00 40.66 41.19 2c0m h LEU 594 CO -0.00 -0.42 -0.35 -0.07 0.09 0.00 0.00 178.44 177.69 2c0m h LEU 595 N -0.58 -1.21 -1.15 1.67 3.38 -0.53 0.12 115.31 117.01 2c0m h LEU 595 Ca 0.01 0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 2c0m h LEU 595 Cb 0.58 0.59 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 2c0m h LEU 595 CO -0.13 -0.31 0.47 0.74 0.09 0.00 0.00 178.44 179.30 2c0m h THR 596 N -0.17 1.21 -0.80 0.22 2.02 -1.25 0.19 112.91 114.33 2c0m h THR 596 Ca 0.23 -0.46 0.01 0.00 0.77 0.00 0.00 66.41 66.95 2c0m h THR 596 Cb 0.55 0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.04 2c0m h THR 596 CO -0.68 0.22 0.53 0.24 0.37 0.00 0.00 175.52 176.20 2c0m h MET 597 N 1.07 1.05 -0.45 6.66 2.86 0.22 -2.11 114.93 124.23 2c0m h MET 597 Ca 0.28 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 2c0m h MET 597 Cb -0.05 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.37 2c0m h MET 597 CO -0.05 0.70 0.00 1.19 1.06 0.00 0.00 176.91 179.80 2c0m n PHE 598 N -4.41 0.60 -2.88 -0.22 3.01 -0.57 -4.95 117.46 108.03 2c0m n PHE 598 Ca 0.09 -0.30 -0.10 0.00 1.01 0.00 0.00 57.45 58.15 2c0m n PHE 598 Cb 0.03 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.54 2c0m n PHE 598 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2c0m n GLY 599 N 1.43 0.13 3.55 1.37 0.00 -0.21 -5.04 105.19 106.41 2c0m n GLY 599 Ca 0.19 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2c0m n GLY 599 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c0m s LEU 600 N -4.14 2.93 0.24 0.99 1.02 -0.12 -5.00 118.68 114.61 2c0m s LEU 600 Ca 0.15 -0.38 -0.30 0.00 0.02 0.00 0.00 54.13 53.62 2c0m s LEU 600 Cb -0.07 -1.73 -0.10 0.00 0.02 0.00 0.00 46.19 44.31 2c0m s LEU 600 CO 0.36 0.21 1.37 -2.16 0.02 0.00 0.00 176.35 176.15 2c0m s PRO 601 N -1.95 4.33 0.00 1.29 0.04 -1.26 -4.20 135.00 133.24 2c0m s PRO 601 Ca 0.19 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2c0m s PRO 601 Cb -0.11 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.30 2c0m s PRO 601 CO 0.11 -0.32 0.20 1.04 0.04 0.00 0.00 177.00 178.06