#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kxp h ASP 303 N 0.00 -0.95 -0.69 -3.46 1.82 -2.04 1.34 116.42 112.44 2kxp h ASP 303 Ca 0.00 0.26 0.12 0.00 -0.39 0.00 0.00 57.03 57.02 2kxp h ASP 303 Cb 0.00 0.57 -0.04 0.00 0.68 0.00 0.00 39.33 40.54 2kxp h ASP 303 CO 0.00 -0.29 0.46 1.56 -1.61 0.00 0.00 179.24 179.36 2kxp h GLN 304 N -0.02 0.42 -0.09 0.28 1.08 -2.05 -1.34 115.11 113.38 2kxp h GLN 304 Ca 0.38 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.55 2kxp h GLN 304 Cb 0.61 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.94 2kxp h GLN 304 CO -0.87 0.28 0.06 1.96 -0.95 0.00 0.00 178.83 179.30 2kxp h GLN 305 N 0.43 0.13 -0.95 1.46 4.20 0.13 -0.25 115.11 120.26 2kxp h GLN 305 Ca 0.33 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 59.09 2kxp h GLN 305 Cb 0.69 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.37 2kxp h GLN 305 CO -0.10 0.12 0.61 1.25 -0.67 0.00 0.00 178.83 180.04 2kxp h LEU 306 N 0.09 0.96 -0.64 1.46 5.85 -0.74 0.21 115.31 122.50 2kxp h LEU 306 Ca 0.03 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 2kxp h LEU 306 Cb 0.03 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 2kxp h LEU 306 CO -0.01 0.61 0.13 -0.78 -0.34 0.00 0.00 178.44 178.05 2kxp h ASP 307 N 1.10 1.00 -0.24 1.25 3.58 -1.00 -1.40 116.42 120.70 2kxp h ASP 307 Ca 0.41 -0.25 -0.12 0.00 0.42 0.00 0.00 57.03 57.49 2kxp h ASP 307 Cb 0.17 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.94 2kxp h ASP 307 CO -0.17 0.99 -0.26 0.00 -2.88 0.00 0.00 179.24 176.91 2kxp h ALA 309 N 1.07 0.77 -0.45 0.00 0.00 -0.33 0.27 119.26 120.59 2kxp h ALA 309 Ca 0.08 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 2kxp h ALA 309 Cb 0.77 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2kxp h ALA 309 CO 0.06 0.44 -0.16 -0.07 0.00 0.00 0.00 179.25 179.52 2kxp h LEU 310 N 0.83 0.88 -0.91 0.00 3.38 -1.11 -1.78 115.31 116.60 2kxp h LEU 310 Ca 0.19 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 2kxp h LEU 310 Cb 0.30 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2kxp h LEU 310 CO -0.00 1.03 -0.35 -0.78 0.09 0.00 0.00 178.44 178.43 2kxp h ASP 311 N 0.77 0.38 -0.28 -0.43 3.58 -0.98 -2.38 116.42 117.08 2kxp h ASP 311 Ca 0.11 -0.15 -0.09 0.00 0.42 0.00 0.00 57.03 57.33 2kxp h ASP 311 Cb 0.69 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.63 2kxp h ASP 311 CO 0.05 0.71 -0.18 0.25 -2.88 0.00 0.00 179.24 177.20 2kxp h LEU 312 N 0.32 0.64 -1.91 2.28 5.85 -0.66 -2.55 115.31 119.29 2kxp h LEU 312 Ca 0.04 -0.43 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 2kxp h LEU 312 Cb 0.76 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 2kxp h LEU 312 CO 0.06 0.93 -0.12 0.24 -0.34 0.00 0.00 178.44 179.21 2kxp h MET 313 N 0.36 0.00 0.00 1.25 2.86 -1.20 0.17 114.93 118.37 2kxp h MET 313 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2kxp h MET 313 Cb 0.71 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.37 2kxp h MET 313 CO 0.05 0.12 -0.14 0.54 1.06 0.00 0.00 176.91 178.54 2kxp n ARG 314 N -3.75 0.13 -0.14 1.72 1.74 -0.91 -3.94 116.66 111.51 2kxp n ARG 314 Ca -0.02 0.09 -0.26 0.00 -0.77 0.00 0.00 57.85 56.89 2kxp n ARG 314 Cb 0.23 -1.63 -0.11 0.00 -1.02 0.00 0.00 32.46 29.93 2kxp n ARG 314 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2kxp n ARG 315 N -1.85 0.61 -1.94 5.56 5.12 -0.19 -4.97 116.66 119.00 2kxp n ARG 315 Ca 0.06 0.22 -0.37 0.00 -1.93 0.00 0.00 57.85 55.83 2kxp n ARG 315 Cb 0.38 -1.49 0.03 0.00 -1.16 0.00 0.00 32.46 30.22 2kxp n ARG 315 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2kxp s LEU 316 N -7.19 3.80 0.05 0.55 1.43 0.41 -4.89 118.68 112.84 2kxp s LEU 316 Ca -0.38 2.56 -0.37 0.00 -1.03 0.00 0.00 54.13 54.92 2kxp s LEU 316 Cb 0.13 -4.39 -0.16 0.00 0.03 0.00 0.00 46.19 41.80 2kxp s LEU 316 CO 0.52 -1.49 1.45 -2.65 0.23 0.00 0.00 176.35 174.41 2kxp n PRO 317 N -1.16 1.36 0.00 1.29 -0.02 -1.26 -4.83 135.00 130.37 2kxp n PRO 317 Ca 0.11 0.49 0.09 0.00 -2.02 0.00 0.00 63.50 62.17 2kxp n PRO 317 Cb 0.47 -2.17 0.47 0.00 -0.02 0.00 0.00 33.50 32.25 2kxp n PRO 317 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kxp n PRO 318 N 3.19 0.34 0.17 0.52 -0.02 -1.26 -2.47 135.00 135.47 2kxp n PRO 318 Ca 0.19 0.09 0.12 0.00 -2.02 0.00 0.00 63.50 61.88 2kxp n PRO 318 Cb 0.20 -1.50 0.26 0.00 -0.02 0.00 0.00 33.50 32.44 2kxp n PRO 318 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2kxp h GLN 319 N 0.00 0.00 -0.65 -0.52 4.20 -1.97 -3.28 115.11 112.90 2kxp h GLN 319 Ca 0.00 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 58.25 2kxp h GLN 319 Cb 0.12 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 27.49 2kxp h GLN 319 CO 0.00 0.00 -0.86 1.04 -0.67 0.00 0.00 178.83 178.34 2kxp n GLN 320 N -2.72 3.14 -0.27 1.46 6.02 -1.03 -4.81 117.38 119.17 2kxp n GLN 320 Ca 0.04 -3.98 -0.06 0.00 -0.01 0.00 0.00 57.00 52.99 2kxp n GLN 320 Cb 0.49 -2.10 0.05 0.00 1.02 0.00 0.00 30.24 29.70 2kxp n GLN 320 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2kxp h ILE 321 N 2.81 1.25 0.91 5.09 1.08 -1.68 0.00 117.51 126.98 2kxp h ILE 321 Ca 0.25 -0.81 -0.04 0.00 -0.39 0.00 0.00 64.86 63.86 2kxp h ILE 321 Cb 1.47 0.41 0.01 0.00 -3.07 0.00 0.00 36.82 35.64 2kxp h ILE 321 CO 0.61 0.33 -0.45 -0.08 -0.69 0.00 0.00 178.15 177.87 2kxp h GLU 322 N 1.06 -1.19 0.06 2.37 4.81 -1.89 0.64 114.58 120.43 2kxp h GLU 322 Ca 0.24 0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.58 2kxp h GLU 322 Cb 0.23 0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 2kxp h GLU 322 CO -0.02 -0.80 -0.26 0.87 -0.73 0.00 0.00 179.01 178.07 2kxp h LYS 323 N -1.24 -0.42 0.17 1.92 1.57 -1.93 -0.32 116.57 116.32 2kxp h LYS 323 Ca -0.12 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2kxp h LYS 323 Cb 0.95 0.10 -0.04 0.00 0.08 0.00 0.00 32.23 33.32 2kxp h LYS 323 CO 0.20 -0.28 -0.33 -0.91 -0.57 0.00 0.00 179.45 177.56 2kxp h ASN 324 N -0.44 -0.93 -0.68 0.86 -0.26 -0.97 -0.69 115.58 112.47 2kxp h ASN 324 Ca 0.05 0.10 0.14 0.00 -0.56 0.00 0.00 56.30 56.03 2kxp h ASN 324 Cb 0.49 0.34 -0.12 0.00 -1.06 0.00 0.00 38.32 37.97 2kxp h ASN 324 CO -0.19 -0.42 -0.08 0.25 -1.06 0.00 0.00 177.43 175.92 2kxp h LEU 325 N -0.58 -0.47 -0.18 1.61 5.85 0.58 0.73 115.31 122.86 2kxp h LEU 325 Ca 0.02 0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.96 2kxp h LEU 325 Cb 0.59 0.36 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 2kxp h LEU 325 CO -0.16 -0.19 -0.01 -1.28 -0.34 0.00 0.00 178.44 176.46 2kxp h SER 326 N 0.05 -0.09 -0.79 1.25 0.87 -0.44 -1.43 113.55 112.97 2kxp h SER 326 Ca 0.35 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.92 2kxp h SER 326 Cb 0.57 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.57 2kxp h SER 326 CO -0.65 -0.02 0.38 0.44 -0.53 0.00 0.00 176.83 176.45 2kxp h ASP 327 N 0.05 1.04 -0.92 6.23 3.32 0.57 -2.30 116.42 124.40 2kxp h ASP 327 Ca 0.08 -0.14 0.10 0.00 0.02 0.00 0.00 57.03 57.09 2kxp h ASP 327 Cb 0.11 -0.27 -0.08 0.00 0.22 0.00 0.00 39.33 39.31 2kxp h ASP 327 CO -0.15 0.88 0.57 0.25 -1.72 0.00 0.00 179.24 179.07 2kxp h LEU 328 N 1.12 0.84 -0.59 1.55 5.85 0.10 -1.02 115.31 123.17 2kxp h LEU 328 Ca 0.27 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.95 2kxp h LEU 328 Cb 0.12 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2kxp h LEU 328 CO -0.03 0.48 0.07 0.40 -0.34 0.00 0.00 178.44 179.02 2kxp h ILE 329 N 0.95 1.26 -0.85 4.05 2.04 -0.75 -2.27 117.51 121.94 2kxp h ILE 329 Ca 0.44 -1.03 0.06 0.00 1.00 0.00 0.00 64.86 65.32 2kxp h ILE 329 Cb 0.36 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 2kxp h ILE 329 CO -0.23 0.38 0.55 0.44 0.00 0.00 0.00 178.15 179.29 2kxp h ASP 330 N 0.89 0.85 0.61 1.72 3.32 -0.74 0.11 116.42 123.18 2kxp h ASP 330 Ca 0.18 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.12 2kxp h ASP 330 Cb 0.46 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2kxp h ASP 330 CO 0.02 0.56 -0.51 -0.07 -1.72 0.00 0.00 179.24 177.51 2kxp h LEU 331 N 0.97 0.00 -6.23 1.55 3.38 -1.01 -3.38 115.31 110.59 2kxp h LEU 331 Ca 0.36 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.85 2kxp h LEU 331 Cb 0.17 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 40.58 2kxp h LEU 331 CO -0.12 0.51 -0.82 0.68 0.09 0.00 0.00 178.44 178.78 2kxp s VAL 332 N -3.73 -0.05 -1.44 1.22 -7.23 -0.11 -4.97 120.40 104.10 2kxp s VAL 332 Ca -0.01 -1.83 0.12 0.00 -1.81 0.00 0.00 61.98 58.45 2kxp s VAL 332 Cb 0.13 -0.91 0.22 0.00 0.56 0.00 0.00 36.38 36.37 2kxp s VAL 332 CO 0.74 -0.87 1.30 -0.81 -0.31 0.00 0.00 175.10 175.15 2kxp n PRO 333 N 3.45 0.18 0.00 4.82 -0.04 0.18 -1.77 135.00 141.82 2kxp n PRO 333 Ca 0.20 0.17 0.13 0.00 -0.04 0.00 0.00 63.50 63.96 2kxp n PRO 333 Cb 0.46 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.79 2kxp n PRO 333 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2kxp n SER 334 N -1.28 0.79 -0.21 3.54 7.64 -1.26 -3.71 113.62 119.14 2kxp n SER 334 Ca 0.06 -0.64 0.09 0.00 1.01 0.00 0.00 58.87 59.39 2kxp n SER 334 Cb 0.10 0.13 0.16 0.00 -1.01 0.00 0.00 64.21 63.58 2kxp n SER 334 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2kxp n LEU 335 N -0.94 2.55 0.25 -3.43 4.77 -0.73 -4.76 117.00 114.71 2kxp n LEU 335 Ca 0.10 -3.16 -0.15 0.00 -0.03 0.00 0.00 56.01 52.78 2kxp n LEU 335 Cb 0.34 -0.45 -0.08 0.00 -2.33 0.00 0.00 43.42 40.89 2kxp n LEU 335 CO 0.28 0.77 0.57 0.00 -1.33 0.00 0.00 177.39 177.68 2kxp h GLU 337 N -0.84 -0.05 -0.67 0.00 4.81 -1.87 0.75 114.58 116.72 2kxp h GLU 337 Ca -0.06 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.20 2kxp h GLU 337 Cb 0.57 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.92 2kxp h GLU 337 CO 0.11 -0.01 0.44 -0.44 -0.73 0.00 0.00 179.01 178.37 2kxp h ASP 338 N -0.07 0.68 1.09 1.04 3.32 -1.87 -1.17 116.42 119.44 2kxp h ASP 338 Ca -0.00 -0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.86 2kxp h ASP 338 Cb 0.06 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2kxp h ASP 338 CO 0.01 0.47 -0.82 -0.07 -1.72 0.00 0.00 179.24 177.10 2kxp h LEU 339 N 0.79 0.00 -0.44 1.55 3.38 0.00 -1.55 115.31 119.04 2kxp h LEU 339 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2kxp h LEU 339 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2kxp h LEU 339 CO -0.08 0.82 0.00 0.18 0.09 0.00 0.00 178.44 179.46 2kxp n LEU 340 N -3.36 0.55 0.00 1.67 4.77 0.26 -1.76 117.00 119.13 2kxp n LEU 340 Ca 0.00 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 2kxp n LEU 340 Cb 0.85 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 2kxp n LEU 340 CO 0.45 0.12 0.00 -1.54 -1.33 0.00 0.00 177.39 175.09 2kxp n SER 341 N -0.24 0.00 -0.00 -1.43 3.41 -0.99 -4.46 113.62 109.91 2kxp n SER 341 Ca 0.02 -0.63 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 2kxp n SER 341 Cb 0.11 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2kxp n SER 341 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2kxp n SER 342 N 0.00 2.67 -4.45 4.04 2.88 -0.59 -4.98 113.62 113.18 2kxp n SER 342 Ca 0.00 -0.23 -0.37 0.00 -1.33 0.00 0.00 58.87 56.94 2kxp n SER 342 Cb 0.16 1.02 -0.12 0.00 -0.75 0.00 0.00 64.21 64.51 2kxp n SER 342 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2kxp s VAL 343 N -1.61 4.36 -0.10 2.46 1.01 -0.72 -5.04 120.40 120.76 2kxp s VAL 343 Ca -0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 61.98 61.60 2kxp s VAL 343 Cb 0.00 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 2kxp s VAL 343 CO 0.03 0.34 0.65 -1.81 0.00 0.00 0.00 175.10 174.31 2kxp s ASP 344 N 1.61 6.88 0.25 3.32 1.01 -1.26 -4.85 116.67 123.63 2kxp s ASP 344 Ca 0.06 1.06 0.04 0.00 0.71 0.00 0.00 52.55 54.43 2kxp s ASP 344 Cb -0.15 -2.38 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 2kxp s ASP 344 CO 0.04 -0.13 -0.01 0.00 0.21 0.00 0.00 175.17 175.28 2kxp s GLN 345 N 1.01 1.43 -0.16 8.23 -2.07 -1.26 -5.04 119.66 121.81 2kxp s GLN 345 Ca 0.34 -1.73 -0.41 0.00 -1.82 0.00 0.00 55.36 51.74 2kxp s GLN 345 Cb -0.17 -0.79 -0.18 0.00 -1.09 0.00 0.00 33.01 30.79 2kxp s GLN 345 CO 0.15 -0.07 1.44 -2.30 -1.32 0.00 0.00 175.29 173.18 2kxp n PRO 346 N -0.49 0.63 -2.01 9.60 -0.02 -1.26 -4.84 135.00 136.61 2kxp n PRO 346 Ca -0.05 0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 61.24 2kxp n PRO 346 Cb 0.64 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 32.28 2kxp n PRO 346 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2kxp s LEU 347 N 1.71 4.34 0.25 2.45 1.43 -1.26 -4.99 118.68 122.60 2kxp s LEU 347 Ca 0.94 2.31 -0.13 0.00 -1.03 0.00 0.00 54.13 56.22 2kxp s LEU 347 Cb -1.18 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.42 2kxp s LEU 347 CO 0.62 -0.88 0.63 -0.54 0.23 0.00 0.00 176.35 176.40 2kxp s LYS 348 N 3.34 3.93 -0.13 1.70 1.02 -1.26 -4.93 119.74 123.41 2kxp s LYS 348 Ca 0.72 0.49 -0.06 0.00 0.02 0.00 0.00 55.97 57.15 2kxp s LYS 348 Cb -0.35 -2.63 -0.04 0.00 -0.52 0.00 0.00 37.83 34.28 2kxp s LYS 348 CO 0.30 0.29 0.08 -1.50 -0.92 0.00 0.00 175.35 173.60 2kxp s ILE 349 N -1.80 4.97 0.21 2.17 2.07 -1.26 -1.30 121.20 126.25 2kxp s ILE 349 Ca 0.48 0.01 0.09 0.00 -1.41 0.00 0.00 60.65 59.83 2kxp s ILE 349 Cb -0.12 -3.17 -0.05 0.00 0.13 0.00 0.00 42.46 39.25 2kxp s ILE 349 CO 0.20 0.56 -0.18 0.00 -1.91 0.00 0.00 174.94 173.60 2kxp s ALA 350 N -0.49 2.26 0.00 1.50 0.00 0.11 -4.92 121.76 120.22 2kxp s ALA 350 Ca 0.11 -1.65 0.05 0.00 0.00 0.00 0.00 51.96 50.46 2kxp s ALA 350 Cb -0.12 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 2kxp s ALA 350 CO 0.02 0.22 -0.14 0.50 0.00 0.00 0.00 175.76 176.36 2kxp s ARG 351 N -3.20 2.32 -0.84 0.00 3.52 -1.26 0.15 118.95 119.63 2kxp s ARG 351 Ca 0.22 -0.83 -0.01 0.00 -0.13 0.00 0.00 55.73 54.97 2kxp s ARG 351 Cb -0.04 -2.32 0.21 0.00 -1.56 0.00 0.00 34.95 31.24 2kxp s ARG 351 CO 0.09 0.58 0.71 0.34 -0.81 0.00 0.00 175.30 176.21 2kxp s ASP 352 N -1.22 5.78 0.10 -2.12 -1.08 0.64 -4.91 116.67 113.85 2kxp s ASP 352 Ca 0.14 -3.65 -0.19 0.00 -0.52 0.00 0.00 52.55 48.34 2kxp s ASP 352 Cb -0.11 -1.87 -0.04 0.00 -1.46 0.00 0.00 42.92 39.44 2kxp s ASP 352 CO 0.04 -0.19 1.19 0.29 0.52 0.00 0.00 175.17 177.02 2kxp n LYS 353 N 2.41 -0.27 -0.37 4.34 5.02 -1.26 0.93 118.16 128.97 2kxp n LYS 353 Ca 0.20 1.17 0.01 0.00 -2.02 0.00 0.00 58.31 57.67 2kxp n LYS 353 Cb 0.37 -1.73 0.07 0.00 -0.02 0.00 0.00 35.03 33.72 2kxp n LYS 353 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2kxp n VAL 354 N -4.42 -0.48 0.01 -0.18 0.31 -1.26 -0.61 118.33 111.70 2kxp n VAL 354 Ca 0.01 2.27 0.00 0.00 -0.01 0.00 0.00 64.34 66.61 2kxp n VAL 354 Cb 0.16 -3.04 -0.10 0.00 -0.91 0.00 0.00 33.84 29.94 2kxp n VAL 354 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2kxp n VAL 355 N -5.49 1.06 -1.59 2.52 0.31 0.15 -4.98 118.33 110.31 2kxp n VAL 355 Ca 0.12 -0.69 -0.05 0.00 -0.01 0.00 0.00 64.34 63.71 2kxp n VAL 355 Cb 0.43 -0.59 -0.01 0.00 -0.91 0.00 0.00 33.84 32.75 2kxp n VAL 355 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kxp n GLY 356 N 1.43 0.48 3.55 2.92 0.00 5.78 -4.99 105.19 114.37 2kxp n GLY 356 Ca -0.12 -0.76 -0.26 0.00 0.00 0.00 0.00 46.02 44.87 2kxp n GLY 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kxp s LYS 357 N -3.28 2.00 0.03 1.61 1.02 -1.10 -4.76 119.74 115.26 2kxp s LYS 357 Ca 0.00 -1.32 -0.11 0.00 0.02 0.00 0.00 55.97 54.56 2kxp s LYS 357 Cb 0.00 -2.11 -0.05 0.00 -0.52 0.00 0.00 37.83 35.14 2kxp s LYS 357 CO 0.00 0.42 0.37 -0.51 -0.92 0.00 0.00 175.35 174.71 2kxp s ASP 358 N -2.89 6.66 -0.01 2.83 1.01 -1.25 0.23 116.67 123.26 2kxp s ASP 358 Ca 0.25 0.79 0.00 0.00 0.71 0.00 0.00 52.55 54.30 2kxp s ASP 358 Cb -0.08 -2.18 0.01 0.00 1.01 0.00 0.00 42.92 41.68 2kxp s ASP 358 CO 0.15 0.25 0.01 -0.72 0.21 0.00 0.00 175.17 175.07 2kxp s TYR 359 N -1.26 0.05 0.70 4.23 1.13 0.39 -4.82 117.35 117.78 2kxp s TYR 359 Ca 0.28 0.04 -0.13 0.00 -1.41 0.00 0.00 57.07 55.85 2kxp s TYR 359 Cb -0.15 -0.13 0.02 0.00 -1.10 0.00 0.00 41.96 40.61 2kxp s TYR 359 CO 0.15 -0.04 1.11 -0.51 -2.51 0.00 0.00 175.55 173.75 2kxp s LEU 360 N 0.44 3.26 0.23 -3.49 1.43 -1.26 0.06 118.68 119.36 2kxp s LEU 360 Ca -0.04 1.97 0.08 0.00 -1.03 0.00 0.00 54.13 55.10 2kxp s LEU 360 Cb -0.06 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.58 2kxp s LEU 360 CO -0.01 -1.82 0.10 -0.76 0.23 0.00 0.00 176.35 174.09 2kxp s LEU 361 N -5.25 3.57 0.10 1.79 1.43 -0.42 -4.84 118.68 115.06 2kxp s LEU 361 Ca 0.65 -0.37 -0.26 0.00 -1.03 0.00 0.00 54.13 53.12 2kxp s LEU 361 Cb -0.20 -2.12 0.08 0.00 0.03 0.00 0.00 46.19 43.98 2kxp s LEU 361 CO 0.47 0.01 1.01 0.00 0.23 0.00 0.00 176.35 178.06 2kxp n ASP 363 N -0.44 0.04 0.10 0.00 5.75 -1.26 -2.26 116.55 118.47 2kxp n ASP 363 Ca -0.07 0.51 0.12 0.00 -0.01 0.00 0.00 54.79 55.34 2kxp n ASP 363 Cb 0.61 -0.52 0.08 0.00 -1.03 0.00 0.00 41.12 40.26 2kxp n ASP 363 CO 0.00 0.00 0.00 1.88 -0.11 0.00 0.00 177.20 178.97 2kxp h TYR 364 N 0.00 0.00 0.00 2.11 -1.99 -1.95 -3.33 116.97 111.81 2kxp h TYR 364 Ca 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2kxp h TYR 364 Cb 0.40 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.10 2kxp h TYR 364 CO 0.00 0.00 -0.32 0.27 -0.00 0.00 0.00 178.16 178.11 2kxp n ASN 365 N -2.53 1.80 -4.22 3.88 0.23 -1.04 -4.94 115.26 108.44 2kxp n ASN 365 Ca 0.02 -3.24 -0.32 0.00 -0.53 0.00 0.00 54.58 50.50 2kxp n ASN 365 Cb 0.51 -0.44 -0.17 0.00 -2.08 0.00 0.00 39.78 37.60 2kxp n ASN 365 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2kxp s ARG 366 N -2.57 3.05 -0.34 -3.83 3.52 -0.96 0.02 118.95 117.84 2kxp s ARG 366 Ca 0.32 -0.88 0.03 0.00 -0.13 0.00 0.00 55.73 55.07 2kxp s ARG 366 Cb 0.30 -2.31 0.10 0.00 -1.56 0.00 0.00 34.95 31.48 2kxp s ARG 366 CO -0.03 0.17 0.07 0.34 -0.81 0.00 0.00 175.30 175.04 2kxp s ASP 367 N 0.36 4.61 0.00 -2.12 -1.08 0.51 -4.94 116.67 114.01 2kxp s ASP 367 Ca -0.18 -2.11 0.00 0.00 -0.52 0.00 0.00 52.55 49.74 2kxp s ASP 367 Cb -0.18 -1.49 0.00 0.00 -1.46 0.00 0.00 42.92 39.79 2kxp s ASP 367 CO 0.09 -0.38 0.00 0.61 0.52 0.00 0.00 175.17 176.01 2kxp n GLY 368 N 4.30 2.13 0.00 2.66 0.00 -1.26 -2.78 105.19 110.23 2kxp n GLY 368 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2kxp n GLY 368 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kxp n ASP 369 N 6.84 1.27 -4.44 1.61 2.03 -1.26 -5.06 116.55 117.54 2kxp n ASP 369 Ca 0.00 -1.59 -0.23 0.00 0.52 0.00 0.00 54.79 53.49 2kxp n ASP 369 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 2kxp n ASP 369 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2kxp s SER 370 N -0.59 3.26 0.14 1.67 0.01 -1.12 -4.89 113.70 112.17 2kxp s SER 370 Ca 0.00 -1.07 0.10 0.00 1.31 0.00 0.00 55.95 56.29 2kxp s SER 370 Cb 0.00 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 2kxp s SER 370 CO 0.00 -0.10 -0.22 -0.31 0.41 0.00 0.00 173.24 173.02 2kxp s TYR 371 N -2.70 2.41 -0.23 2.43 1.51 -1.26 -0.37 117.35 119.14 2kxp s TYR 371 Ca 0.28 -0.32 -0.12 0.00 -1.01 0.00 0.00 57.07 55.90 2kxp s TYR 371 Cb -0.02 -1.27 -0.05 0.00 -0.11 0.00 0.00 41.96 40.51 2kxp s TYR 371 CO 0.13 0.39 0.21 1.03 -1.11 0.00 0.00 175.55 176.20 2kxp s ARG 372 N -2.22 4.08 0.09 -0.62 0.52 0.10 -0.16 118.95 120.75 2kxp s ARG 372 Ca 0.17 -0.17 -0.30 0.00 -0.52 0.00 0.00 55.73 54.91 2kxp s ARG 372 Cb -0.10 -3.55 -0.05 0.00 0.52 0.00 0.00 34.95 31.77 2kxp s ARG 372 CO 0.09 0.02 0.98 -1.54 0.02 0.00 0.00 175.30 174.86 2kxp s SER 373 N 1.10 7.46 0.23 0.23 1.04 -0.70 -4.86 113.70 118.20 2kxp s SER 373 Ca 0.10 1.79 0.25 0.00 0.48 0.00 0.00 55.95 58.57 2kxp s SER 373 Cb -0.14 -2.59 0.89 0.00 0.10 0.00 0.00 66.02 64.28 2kxp s SER 373 CO 0.06 -0.12 1.75 -0.81 0.98 0.00 0.00 173.24 175.10 2kxp n PRO 374 N 2.98 0.23 -0.02 4.02 -0.04 -1.26 0.06 135.00 140.98 2kxp n PRO 374 Ca 0.03 0.30 -0.01 0.00 -0.04 0.00 0.00 63.50 63.78 2kxp n PRO 374 Cb 0.49 -1.83 -0.00 0.00 -0.04 0.00 0.00 33.50 32.12 2kxp n PRO 374 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2kxp h TRP 375 N 0.00 0.00 0.00 0.54 4.06 -1.96 -3.40 115.95 115.19 2kxp h TRP 375 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2kxp h TRP 375 Cb 0.59 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.75 2kxp h TRP 375 CO 0.00 0.00 -0.28 0.66 -3.56 0.00 0.00 178.44 175.26 2kxp h SER 376 N -0.37 0.00 -3.41 -3.49 4.64 -1.98 -3.48 113.55 105.46 2kxp h SER 376 Ca 0.00 -0.02 -0.19 0.00 -0.47 0.00 0.00 61.79 61.11 2kxp h SER 376 Cb 0.11 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.27 2kxp h SER 376 CO 0.00 0.01 -0.34 0.59 -0.87 0.00 0.00 176.83 176.22 2kxp n ASN 377 N -2.77 -3.98 -3.83 4.97 3.02 0.11 -5.01 115.26 107.77 2kxp n ASN 377 Ca 0.03 -0.27 -0.13 0.00 -0.03 0.00 0.00 54.58 54.19 2kxp n ASN 377 Cb 0.51 -2.73 -0.14 0.00 -0.61 0.00 0.00 39.78 36.81 2kxp n ASN 377 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2kxp s LYS 378 N -5.56 0.06 0.35 3.52 -0.14 -1.19 -4.79 119.74 111.97 2kxp s LYS 378 Ca 0.26 0.12 -0.28 0.00 -1.36 0.00 0.00 55.97 54.71 2kxp s LYS 378 Cb -0.12 -0.02 -0.10 0.00 -1.68 0.00 0.00 37.83 35.91 2kxp s LYS 378 CO 0.36 -0.04 1.33 1.52 -0.76 0.00 0.00 175.35 177.76 2kxp s TYR 379 N 0.26 2.94 0.10 3.18 -0.85 -1.18 -1.72 117.35 120.08 2kxp s TYR 379 Ca -0.02 1.38 -0.33 0.00 -0.52 0.00 0.00 57.07 57.57 2kxp s TYR 379 Cb -0.03 -3.73 -0.15 0.00 0.38 0.00 0.00 41.96 38.43 2kxp s TYR 379 CO -0.01 -2.06 1.53 -0.44 -1.52 0.00 0.00 175.55 173.05 2kxp h ASP 380 N 3.21 -1.49 -2.56 -0.18 5.19 -0.91 -3.40 116.42 116.28 2kxp h ASP 380 Ca -0.49 0.15 -0.54 0.00 -0.62 0.00 0.00 57.03 55.52 2kxp h ASP 380 Cb 1.23 0.54 -0.00 0.00 0.18 0.00 0.00 39.33 41.28 2kxp h ASP 380 CO 0.65 -0.56 1.12 -2.84 -3.12 0.00 0.00 179.24 174.49 2kxp s PRO 381 N -5.66 4.17 -0.08 3.56 0.02 -1.26 -4.80 135.00 130.96 2kxp s PRO 381 Ca -0.16 2.28 -0.02 0.00 0.02 0.00 0.00 61.00 63.12 2kxp s PRO 381 Cb 0.05 -4.03 -0.02 0.00 0.02 0.00 0.00 34.50 30.53 2kxp s PRO 381 CO 0.58 -0.87 1.04 -2.30 -0.33 0.00 0.00 177.00 175.12 2kxp n PRO 382 N 7.22 0.01 -2.18 5.54 -0.02 -1.26 -4.84 135.00 139.47 2kxp n PRO 382 Ca 0.18 -0.13 -0.27 0.00 -2.02 0.00 0.00 63.50 61.26 2kxp n PRO 382 Cb 0.42 -1.22 0.15 0.00 -0.02 0.00 0.00 33.50 32.84 2kxp n PRO 382 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2kxp s LEU 383 N 1.22 2.81 0.00 2.45 0.20 -1.26 -5.08 118.68 119.02 2kxp s LEU 383 Ca 0.06 0.05 0.00 0.00 0.69 0.00 0.00 54.13 54.93 2kxp s LEU 383 Cb -0.00 -2.23 0.00 0.00 -0.43 0.00 0.00 46.19 43.53 2kxp s LEU 383 CO 0.02 -2.37 0.00 -0.62 -0.29 0.00 0.00 176.35 173.09 2kxp n GLU 384 N -3.39 0.00 -3.17 1.98 1.02 -1.26 -4.90 120.64 110.92 2kxp n GLU 384 Ca 0.15 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.99 2kxp n GLU 384 Cb 0.60 -0.16 -0.05 0.00 -0.02 0.00 0.00 31.44 31.80 2kxp n GLU 384 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2kxp n ASP 385 N -2.22 4.48 -4.79 1.62 8.00 -1.26 -5.07 116.55 117.31 2kxp n ASP 385 Ca 0.00 -3.54 -0.34 0.00 0.71 0.00 0.00 54.79 51.62 2kxp n ASP 385 Cb 0.00 -0.72 -0.00 0.00 -0.02 0.00 0.00 41.12 40.38 2kxp n ASP 385 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2kxp s GLY 386 N -2.69 2.42 0.12 0.44 0.00 -1.26 -4.96 107.32 101.39 2kxp s GLY 386 Ca 0.42 0.63 -0.31 0.00 0.00 0.00 0.00 44.72 45.46 2kxp s GLY 386 CO -0.05 0.97 1.64 0.00 0.00 0.00 0.00 173.10 175.65 2kxp s ALA 387 N -2.06 3.74 0.05 3.20 0.00 -1.26 -5.00 121.76 120.44 2kxp s ALA 387 Ca 0.68 1.31 0.04 0.00 0.00 0.00 0.00 51.96 54.00 2kxp s ALA 387 Cb -0.20 -3.67 -0.02 0.00 0.00 0.00 0.00 23.12 19.23 2kxp s ALA 387 CO 0.29 -0.97 -0.12 0.00 0.00 0.00 0.00 175.76 174.96 2kxp s MET 388 N 1.97 0.74 0.52 0.00 0.23 -1.26 -5.03 119.30 116.47 2kxp s MET 388 Ca 0.73 -0.82 -0.19 0.00 -1.03 0.00 0.00 55.69 54.38 2kxp s MET 388 Cb -0.42 -0.69 -0.07 0.00 -1.53 0.00 0.00 34.83 32.12 2kxp s MET 388 CO 0.32 0.15 1.07 -1.25 -2.03 0.00 0.00 175.02 173.29 2kxp s PRO 389 N -1.49 3.56 0.39 3.16 0.04 -1.26 -4.97 135.00 134.44 2kxp s PRO 389 Ca -0.03 1.43 -0.25 0.00 0.04 0.00 0.00 61.00 62.18 2kxp s PRO 389 Cb -0.09 -2.05 -0.11 0.00 0.04 0.00 0.00 34.50 32.28 2kxp s PRO 389 CO 0.01 -0.64 1.04 0.43 0.04 0.00 0.00 177.00 177.88 2kxp n SER 390 N -1.25 1.42 -0.31 6.66 7.64 -1.26 -4.37 113.62 122.13 2kxp n SER 390 Ca 0.10 1.07 0.17 0.00 1.01 0.00 0.00 58.87 61.22 2kxp n SER 390 Cb 0.52 -1.36 0.35 0.00 -1.01 0.00 0.00 64.21 62.71 2kxp n SER 390 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kxp h ALA 391 N 1.70 1.45 -0.39 -0.43 0.00 -1.99 1.15 119.26 120.75 2kxp h ALA 391 Ca -0.44 0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 2kxp h ALA 391 Cb 1.33 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 2kxp h ALA 391 CO 0.58 -0.57 -0.23 0.00 0.00 0.00 0.00 179.25 179.03 2kxp h ARG 392 N 0.15 0.79 -0.24 0.00 3.08 -2.01 -2.74 114.38 113.41 2kxp h ARG 392 Ca 0.62 -0.33 -0.14 0.00 0.07 0.00 0.00 59.98 60.21 2kxp h ARG 392 Cb 1.36 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.38 2kxp h ARG 392 CO -0.72 0.95 -0.38 -0.07 -1.07 0.00 0.00 179.97 178.68 2kxp h LEU 393 N 0.69 0.75 -1.33 3.04 -0.00 0.59 -3.03 115.31 116.03 2kxp h LEU 393 Ca 0.09 -0.52 0.12 0.00 -0.00 0.00 0.00 57.88 57.57 2kxp h LEU 393 Cb 0.75 -0.21 -0.06 0.00 -0.00 0.00 0.00 40.66 41.14 2kxp h LEU 393 CO 0.06 1.13 0.54 -0.09 -0.00 0.00 0.00 178.44 180.08 2kxp h ARG 394 N 0.40 0.69 -0.26 1.13 2.43 0.74 0.03 114.38 119.54 2kxp h ARG 394 Ca 0.02 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2kxp h ARG 394 Cb 0.97 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 2kxp h ARG 394 CO 0.09 0.46 0.10 -0.22 -1.51 0.00 0.00 179.97 178.88 2kxp h LYS 395 N 0.71 0.40 -0.15 0.20 3.64 -1.38 -1.42 116.57 118.58 2kxp h LYS 395 Ca 0.40 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.65 2kxp h LYS 395 Cb 0.56 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2kxp h LYS 395 CO -0.16 0.45 -0.13 -0.07 -2.27 0.00 0.00 179.45 177.26 2kxp h LEU 396 N 0.27 0.22 -0.66 5.20 4.07 -1.13 -2.27 115.31 121.02 2kxp h LEU 396 Ca 0.09 -0.05 -0.12 0.00 0.08 0.00 0.00 57.88 57.89 2kxp h LEU 396 Cb 0.20 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 2kxp h LEU 396 CO -0.01 0.38 -0.21 -0.08 -1.08 0.00 0.00 178.44 177.44 2kxp h GLU 397 N 0.22 0.82 -0.67 1.13 4.81 -0.59 -1.26 114.58 119.05 2kxp h GLU 397 Ca 0.05 -0.33 -0.08 0.00 -0.13 0.00 0.00 59.36 58.87 2kxp h GLU 397 Cb 0.38 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 2kxp h GLU 397 CO 0.02 0.96 0.12 0.28 -0.73 0.00 0.00 179.01 179.66 2kxp h VAL 398 N 0.72 1.26 -0.32 0.32 2.07 -0.71 -1.24 116.25 118.35 2kxp h VAL 398 Ca 0.10 -1.03 -0.13 0.00 0.82 0.00 0.00 66.70 66.47 2kxp h VAL 398 Cb 0.74 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2kxp h VAL 398 CO 0.06 0.39 -0.33 -0.33 0.02 0.00 0.00 177.57 177.38 2kxp h GLU 399 N 1.02 0.69 -0.55 1.57 5.08 -1.28 -2.23 114.58 118.88 2kxp h GLU 399 Ca 0.20 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 2kxp h GLU 399 Cb 0.43 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 2kxp h GLU 399 CO 0.01 0.92 0.09 0.00 -1.00 0.00 0.00 179.01 179.03 2kxp h ALA 400 N 1.06 0.74 -0.68 3.43 0.00 -0.93 0.20 119.26 123.07 2kxp h ALA 400 Ca 0.06 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2kxp h ALA 400 Cb 0.84 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2kxp h ALA 400 CO 0.07 0.48 0.19 -0.91 0.00 0.00 0.00 179.25 179.08 2kxp h ASN 401 N 0.81 0.98 -0.23 0.00 2.35 -1.10 0.48 115.58 118.87 2kxp h ASN 401 Ca 0.17 -0.18 -0.20 0.00 -0.55 0.00 0.00 56.30 55.54 2kxp h ASN 401 Cb 0.41 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.52 2kxp h ASN 401 CO 0.01 0.93 -0.63 -1.13 -1.65 0.00 0.00 177.43 174.96 2kxp h ASN 402 N 1.01 0.95 -0.15 5.81 -0.73 -1.13 -0.01 115.58 121.32 2kxp h ASN 402 Ca 0.22 -0.58 -0.01 0.00 1.87 0.00 0.00 56.30 57.80 2kxp h ASN 402 Cb 0.31 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.62 2kxp h ASN 402 CO -0.00 1.35 0.05 0.00 -0.37 0.00 0.00 177.43 178.46 2kxp h ALA 403 N 0.62 0.20 0.00 1.57 0.00 -0.36 -2.67 119.26 118.62 2kxp h ALA 403 Ca -0.01 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2kxp h ALA 403 Cb 1.25 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2kxp h ALA 403 CO 0.14 -0.19 -0.43 0.74 0.00 0.00 0.00 179.25 179.50 2kxp h PHE 404 N 0.08 0.00 -0.96 0.00 0.04 -0.94 -2.87 116.94 112.29 2kxp h PHE 404 Ca 0.05 0.00 0.13 0.00 2.80 0.00 0.00 57.97 60.95 2kxp h PHE 404 Cb 0.20 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.27 2kxp h PHE 404 CO -0.01 0.43 0.61 0.22 -0.60 0.00 0.00 178.31 178.96 2kxp h ASP 405 N 0.00 0.83 0.62 2.17 1.82 -0.64 0.43 116.42 121.65 2kxp h ASP 405 Ca -0.00 0.04 -0.21 0.00 -0.39 0.00 0.00 57.03 56.47 2kxp h ASP 405 Cb 0.80 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.67 2kxp h ASP 405 CO 0.06 0.44 -0.94 1.56 -1.61 0.00 0.00 179.24 178.74 2kxp h GLN 406 N 0.89 0.20 0.00 0.28 1.08 -1.40 -3.05 115.11 113.11 2kxp h GLN 406 Ca 0.47 -0.24 0.00 0.00 -1.45 0.00 0.00 58.65 57.44 2kxp h GLN 406 Cb 0.55 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 2kxp h GLN 406 CO -0.24 1.00 0.00 -0.92 -0.95 0.00 0.00 178.83 177.72 2kxp h TYR 407 N 0.10 0.00 0.12 2.96 5.03 -0.92 -1.37 116.97 122.88 2kxp h TYR 407 Ca -0.05 0.00 -0.30 0.00 2.58 0.00 0.00 58.73 60.96 2kxp h TYR 407 Cb 1.60 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.87 2kxp h TYR 407 CO 0.03 0.00 -1.49 -0.09 -1.32 0.00 0.00 178.16 175.29 2kxp h ARG 408 N 0.00 0.24 -0.00 1.82 1.12 -0.90 -3.03 114.38 113.64 2kxp h ARG 408 Ca 0.00 -0.42 0.00 0.00 -1.11 0.00 0.00 59.98 58.45 2kxp h ARG 408 Cb 0.45 0.16 0.00 0.00 -0.01 0.00 0.00 29.97 30.57 2kxp h ARG 408 CO 0.00 1.11 -0.23 -3.47 -3.11 0.00 0.00 179.97 174.27 2kxp n ASP 409 N -3.45 0.31 0.03 -3.80 2.03 -1.05 0.36 116.55 110.98 2kxp n ASP 409 Ca -0.15 -0.03 0.11 0.00 0.52 0.00 0.00 54.79 55.24 2kxp n ASP 409 Cb 1.04 -0.10 -0.07 0.00 -0.72 0.00 0.00 41.12 41.27 2kxp n ASP 409 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2kxp n LEU 410 N -1.39 0.45 -0.01 -2.67 4.77 -0.54 -2.98 117.00 114.63 2kxp n LEU 410 Ca 0.08 0.05 -0.01 0.00 -0.03 0.00 0.00 56.01 56.10 2kxp n LEU 410 Cb 0.33 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.37 2kxp n LEU 410 CO 0.30 -0.02 -0.55 -1.22 -1.33 0.00 0.00 177.39 174.57 2kxp n TYR 411 N -2.24 0.00 -0.06 -1.77 4.02 -1.14 -4.77 117.16 111.19 2kxp n TYR 411 Ca -0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.87 2kxp n TYR 411 Cb 0.51 -0.06 -0.16 0.00 -0.02 0.00 0.00 39.34 39.62 2kxp n TYR 411 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2kxp n PHE 412 N -2.45 0.00 -1.87 -0.72 3.01 0.16 -4.98 117.46 110.61 2kxp n PHE 412 Ca -0.03 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.26 2kxp n PHE 412 Cb 0.53 -0.77 -0.05 0.00 -0.01 0.00 0.00 39.48 39.18 2kxp n PHE 412 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2kxp n GLU 413 N -2.53 -1.29 -1.72 -1.08 1.02 -0.08 -4.78 120.64 110.18 2kxp n GLU 413 Ca -0.21 1.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 2kxp n GLU 413 Cb 0.90 -5.33 0.00 0.00 -0.02 0.00 0.00 31.44 26.99 2kxp n GLU 413 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kxp n GLY 414 N -0.92 -0.52 7.00 0.62 0.00 -1.24 -4.92 105.19 105.21 2kxp n GLY 414 Ca -0.19 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 44.97 2kxp n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kxp n GLY 415 N 0.00 -1.36 3.25 -0.02 0.00 -1.26 -4.62 105.19 101.18 2kxp n GLY 415 Ca 0.00 -1.27 -0.19 0.00 0.00 0.00 0.00 46.02 44.56 2kxp n GLY 415 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kxp s VAL 416 N 0.00 1.39 -0.00 1.61 1.01 0.12 -4.98 120.40 119.55 2kxp s VAL 416 Ca 0.00 -1.67 -0.05 0.00 0.00 0.00 0.00 61.98 60.25 2kxp s VAL 416 Cb 0.00 -1.51 -0.00 0.00 0.00 0.00 0.00 36.38 34.87 2kxp s VAL 416 CO 0.00 -0.35 0.10 -0.55 0.00 0.00 0.00 175.10 174.30 2kxp s SER 417 N -2.34 0.05 -0.07 3.32 0.15 -1.26 -0.41 113.70 113.14 2kxp s SER 417 Ca 0.08 -0.20 -0.11 0.00 0.70 0.00 0.00 55.95 56.42 2kxp s SER 417 Cb -0.06 0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.47 2kxp s SER 417 CO 0.03 -0.31 0.28 -0.55 1.20 0.00 0.00 173.24 173.90 2kxp s SER 418 N -1.19 -0.24 -0.05 5.45 0.15 -0.40 -4.75 113.70 112.68 2kxp s SER 418 Ca -0.13 0.36 0.01 0.00 0.70 0.00 0.00 55.95 56.89 2kxp s SER 418 Cb -0.07 0.48 0.02 0.00 -1.71 0.00 0.00 66.02 64.73 2kxp s SER 418 CO 0.01 -0.23 -0.07 -0.69 1.20 0.00 0.00 173.24 173.46 2kxp s VAL 419 N -0.44 0.70 -0.05 4.45 1.01 -1.26 0.26 120.40 125.06 2kxp s VAL 419 Ca -0.06 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 61.73 2kxp s VAL 419 Cb -0.04 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.67 2kxp s VAL 419 CO 0.02 0.26 -0.13 -0.47 0.00 0.00 0.00 175.10 174.77 2kxp s TYR 420 N 0.79 1.45 0.26 5.22 5.04 -0.82 -4.85 117.35 124.44 2kxp s TYR 420 Ca -0.12 -0.48 0.12 0.00 -2.44 0.00 0.00 57.07 54.15 2kxp s TYR 420 Cb -0.14 -1.03 -0.05 0.00 0.35 0.00 0.00 41.96 41.08 2kxp s TYR 420 CO 0.01 -0.22 -0.20 -0.51 -1.34 0.00 0.00 175.55 173.29 2kxp s LEU 421 N 0.41 2.58 -0.26 6.97 1.43 -1.26 -0.01 118.68 128.53 2kxp s LEU 421 Ca -0.10 -0.97 -0.02 0.00 -1.03 0.00 0.00 54.13 52.01 2kxp s LEU 421 Cb -0.13 -1.15 0.15 0.00 0.03 0.00 0.00 46.19 45.09 2kxp s LEU 421 CO 0.03 0.06 0.46 0.86 0.23 0.00 0.00 176.35 177.99 2kxp s TRP 422 N -2.27 -1.11 0.95 0.29 -0.11 -0.19 -4.84 118.94 111.66 2kxp s TRP 422 Ca 0.28 1.19 -0.16 0.00 1.22 0.00 0.00 56.10 58.63 2kxp s TRP 422 Cb -0.06 0.24 -0.11 0.00 -1.50 0.00 0.00 33.47 32.04 2kxp s TRP 422 CO 0.14 -0.76 -0.47 -3.47 -4.62 0.00 0.00 176.95 167.77 2kxp n ASP 423 N 5.39 -4.91 0.00 5.86 2.03 -1.26 -2.51 116.55 121.15 2kxp n ASP 423 Ca -0.03 0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.54 2kxp n ASP 423 Cb 0.50 -0.88 0.00 0.00 -0.72 0.00 0.00 41.12 40.03 2kxp n ASP 423 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2kxp n LEU 424 N 2.30 0.00 -0.09 -2.67 7.94 -0.52 -4.72 117.00 119.23 2kxp n LEU 424 Ca 0.01 0.00 -0.20 0.00 -1.11 0.00 0.00 56.01 54.71 2kxp n LEU 424 Cb 0.55 0.00 -0.12 0.00 0.53 0.00 0.00 43.42 44.38 2kxp n LEU 424 CO 0.52 0.00 -0.29 -2.24 -1.11 0.00 0.00 177.39 174.27 2kxp h ASP 425 N 0.00 0.01 -0.04 1.96 3.04 -1.98 -3.41 116.42 116.00 2kxp h ASP 425 Ca 0.00 -0.64 -0.11 0.00 -3.24 0.00 0.00 57.03 53.04 2kxp h ASP 425 Cb 0.00 -0.00 -0.21 0.00 -1.04 0.00 0.00 39.33 38.08 2kxp h ASP 425 CO 0.00 1.38 -0.78 1.41 -2.04 0.00 0.00 179.24 179.21 2kxp n HIS 426 N -4.46 0.15 0.00 4.15 8.25 -1.26 -5.07 115.22 116.98 2kxp n HIS 426 Ca -0.27 -1.09 0.00 0.00 -0.26 0.00 0.00 57.72 56.10 2kxp n HIS 426 Cb 0.64 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.54 2kxp n HIS 426 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2kxp n GLY 427 N -0.35 -0.85 3.57 -1.41 0.00 -1.26 -3.33 105.19 101.56 2kxp n GLY 427 Ca 0.14 0.19 -0.08 0.00 0.00 0.00 0.00 46.02 46.27 2kxp n GLY 427 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2kxp s PHE 428 N -2.27 -0.28 0.40 1.61 -0.12 -1.20 -1.44 117.98 114.68 2kxp s PHE 428 Ca 0.00 0.37 0.04 0.00 -0.05 0.00 0.00 56.93 57.30 2kxp s PHE 428 Cb 0.00 0.49 -0.05 0.00 -0.63 0.00 0.00 43.02 42.82 2kxp s PHE 428 CO 0.00 -0.33 0.04 0.00 -0.05 0.00 0.00 175.22 174.88 2kxp s ALA 429 N -1.80 3.07 0.07 1.99 0.00 -1.05 -1.88 121.76 122.16 2kxp s ALA 429 Ca 0.03 -1.69 -0.27 0.00 0.00 0.00 0.00 51.96 50.04 2kxp s ALA 429 Cb -0.01 0.38 0.09 0.00 0.00 0.00 0.00 23.12 23.58 2kxp s ALA 429 CO -0.03 -0.19 0.82 0.20 0.00 0.00 0.00 175.76 176.56 2kxp s GLY 430 N -3.66 -0.46 -0.08 0.00 0.00 -1.14 -1.02 107.32 100.96 2kxp s GLY 430 Ca 0.28 0.72 0.01 0.00 0.00 0.00 0.00 44.72 45.73 2kxp s GLY 430 CO 0.14 0.23 -0.09 0.54 0.00 0.00 0.00 173.10 173.92 2kxp s VAL 431 N -3.32 0.99 -0.34 1.40 0.11 0.99 -2.55 120.40 117.67 2kxp s VAL 431 Ca 0.05 -0.34 -0.11 0.00 -2.93 0.00 0.00 61.98 58.65 2kxp s VAL 431 Cb -0.01 -0.95 0.00 0.00 -1.53 0.00 0.00 36.38 33.89 2kxp s VAL 431 CO -0.08 0.34 0.19 -0.63 -3.33 0.00 0.00 175.10 171.59 2kxp s ILE 432 N 1.08 4.75 -0.05 7.04 1.01 0.13 -1.95 121.20 133.21 2kxp s ILE 432 Ca -0.07 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 60.02 2kxp s ILE 432 Cb -0.14 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 2kxp s ILE 432 CO -0.01 -0.06 0.10 -0.76 0.00 0.00 0.00 174.94 174.21 2kxp s LEU 433 N 1.62 4.06 -0.15 2.97 1.43 0.14 -1.58 118.68 127.17 2kxp s LEU 433 Ca 0.04 0.27 -0.05 0.00 -1.03 0.00 0.00 54.13 53.36 2kxp s LEU 433 Cb -0.18 -2.20 0.07 0.00 0.03 0.00 0.00 46.19 43.92 2kxp s LEU 433 CO 0.07 0.33 0.31 -0.63 0.23 0.00 0.00 176.35 176.66 2kxp s ILE 434 N -1.12 -0.49 -0.11 -0.59 1.01 -0.49 -1.27 121.20 118.14 2kxp s ILE 434 Ca 0.20 0.24 0.03 0.00 0.00 0.00 0.00 60.65 61.12 2kxp s ILE 434 Cb -0.12 -0.52 0.01 0.00 0.01 0.00 0.00 42.46 41.84 2kxp s ILE 434 CO 0.10 0.10 -0.20 -0.75 0.00 0.00 0.00 174.94 174.19 2kxp s LYS 435 N 2.49 2.64 -0.06 2.79 2.20 0.46 0.48 119.74 130.73 2kxp s LYS 435 Ca 0.00 -0.73 -0.02 0.00 -0.36 0.00 0.00 55.97 54.87 2kxp s LYS 435 Cb -0.12 -2.10 0.03 0.00 -1.51 0.00 0.00 37.83 34.13 2kxp s LYS 435 CO -0.10 0.05 0.02 0.21 -0.36 0.00 0.00 175.35 175.17 2kxp s LYS 436 N 0.67 0.35 -0.12 4.03 2.47 -0.53 0.11 119.74 126.73 2kxp s LYS 436 Ca -0.12 0.19 -0.05 0.00 -1.56 0.00 0.00 55.97 54.43 2kxp s LYS 436 Cb -0.16 -0.85 -0.04 0.00 -1.46 0.00 0.00 37.83 35.32 2kxp s LYS 436 CO 0.03 -0.33 0.06 0.00 0.16 0.00 0.00 175.35 175.27 2kxp s ALA 437 N 2.04 3.52 1.11 3.13 0.00 -1.26 -0.69 121.76 129.61 2kxp s ALA 437 Ca 0.05 -0.74 -0.19 0.00 0.00 0.00 0.00 51.96 51.09 2kxp s ALA 437 Cb -0.12 -1.73 0.26 0.00 0.00 0.00 0.00 23.12 21.53 2kxp s ALA 437 CO -0.05 0.53 1.24 0.20 0.00 0.00 0.00 175.76 177.68 2kxp s GLY 438 N -0.71 1.71 0.05 0.00 0.00 -0.72 -4.91 107.32 102.74 2kxp s GLY 438 Ca 0.12 -1.19 -0.36 0.00 0.00 0.00 0.00 44.72 43.29 2kxp s GLY 438 CO 0.02 -0.31 1.50 1.22 0.00 0.00 0.00 173.10 175.53 2kxp n ASP 439 N -4.35 2.29 -0.66 1.64 8.00 -1.26 -4.81 116.55 117.41 2kxp n ASP 439 Ca 0.16 1.09 0.06 0.00 0.71 0.00 0.00 54.79 56.81 2kxp n ASP 439 Cb 0.59 -1.27 0.17 0.00 -0.02 0.00 0.00 41.12 40.60 2kxp n ASP 439 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kxp n GLY 440 N 3.12 0.66 0.27 0.44 0.00 -1.26 -3.50 105.19 104.91 2kxp n GLY 440 Ca 0.19 -0.39 0.05 0.00 0.00 0.00 0.00 46.02 45.88 2kxp n GLY 440 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2kxp n SER 441 N 0.54 1.33 -4.89 1.61 3.41 -1.26 -5.00 113.62 109.37 2kxp n SER 441 Ca 0.12 -1.17 -0.30 0.00 -0.26 0.00 0.00 58.87 57.27 2kxp n SER 441 Cb 0.30 0.42 -0.04 0.00 -0.26 0.00 0.00 64.21 64.64 2kxp n SER 441 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2kxp s LYS 442 N -1.39 3.73 0.21 4.33 1.02 -1.23 -4.99 119.74 121.43 2kxp s LYS 442 Ca 0.09 0.27 -0.09 0.00 0.02 0.00 0.00 55.97 56.26 2kxp s LYS 442 Cb 0.09 -2.53 0.24 0.00 -0.52 0.00 0.00 37.83 35.12 2kxp s LYS 442 CO 0.26 0.12 1.82 -0.22 -0.92 0.00 0.00 175.35 176.40 2kxp h LYS 443 N 1.64 0.71 -5.76 1.68 1.63 -1.94 -3.40 116.57 111.11 2kxp h LYS 443 Ca -0.47 -0.04 -0.61 0.00 -0.85 0.00 0.00 60.65 58.67 2kxp h LYS 443 Cb 1.19 -0.16 -0.07 0.00 -0.60 0.00 0.00 32.23 32.58 2kxp h LYS 443 CO 0.65 0.47 -0.28 0.96 -3.45 0.00 0.00 179.45 177.80 2kxp s ILE 444 N -6.09 5.21 0.16 2.00 -0.00 -1.26 -4.33 121.20 116.89 2kxp s ILE 444 Ca -0.13 0.66 0.05 0.00 -0.00 0.00 0.00 60.65 61.23 2kxp s ILE 444 Cb 0.16 -3.65 -0.04 0.00 -0.00 0.00 0.00 42.46 38.94 2kxp s ILE 444 CO 0.76 0.50 0.13 -0.54 -0.00 0.00 0.00 174.94 175.80 2kxp s LYS 445 N -0.43 2.89 0.02 0.37 -0.14 -0.18 -4.89 119.74 117.37 2kxp s LYS 445 Ca 0.20 -0.87 -0.11 0.00 -1.36 0.00 0.00 55.97 53.83 2kxp s LYS 445 Cb -0.15 -2.64 0.01 0.00 -1.68 0.00 0.00 37.83 33.37 2kxp s LYS 445 CO 0.09 0.49 0.24 0.20 -0.76 0.00 0.00 175.35 175.60 2kxp s GLY 446 N -3.07 -0.05 -0.14 -3.33 0.00 -1.26 -2.58 107.32 96.90 2kxp s GLY 446 Ca 0.31 -0.03 -0.08 0.00 0.00 0.00 0.00 44.72 44.92 2kxp s GLY 446 CO 0.23 -0.21 0.34 0.00 0.00 0.00 0.00 173.10 173.46 2kxp s TRP 448 N 1.28 3.03 -0.18 0.00 -0.11 0.13 -1.66 118.94 121.43 2kxp s TRP 448 Ca -0.09 -1.45 -0.04 0.00 1.22 0.00 0.00 56.10 55.75 2kxp s TRP 448 Cb -0.09 -2.06 -0.02 0.00 -1.50 0.00 0.00 33.47 29.80 2kxp s TRP 448 CO -0.10 -0.70 -0.03 -0.51 -4.62 0.00 0.00 176.95 170.98 2kxp s ASP 449 N 1.35 4.71 -0.18 5.86 1.11 -0.94 -1.45 116.67 127.13 2kxp s ASP 449 Ca 0.01 -0.19 -0.01 0.00 0.18 0.00 0.00 52.55 52.54 2kxp s ASP 449 Cb -0.16 -1.78 0.00 0.00 1.07 0.00 0.00 42.92 42.05 2kxp s ASP 449 CO -0.05 0.12 -0.13 -0.44 1.18 0.00 0.00 175.17 175.85 2kxp s SER 450 N 0.68 3.72 -0.31 0.27 0.01 0.18 -0.48 113.70 117.78 2kxp s SER 450 Ca -0.02 -0.49 0.01 0.00 1.31 0.00 0.00 55.95 56.76 2kxp s SER 450 Cb -0.14 -1.59 0.10 0.00 0.21 0.00 0.00 66.02 64.59 2kxp s SER 450 CO 0.02 0.04 0.07 -0.63 0.41 0.00 0.00 173.24 173.15 2kxp s ILE 451 N 1.10 1.34 -0.14 1.44 1.01 -1.24 -1.39 121.20 123.32 2kxp s ILE 451 Ca 0.00 -1.67 -0.03 0.00 0.00 0.00 0.00 60.65 58.95 2kxp s ILE 451 Cb -0.14 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.32 2kxp s ILE 451 CO -0.04 -0.61 -0.03 -1.00 0.00 0.00 0.00 174.94 173.26 2kxp s HIS 452 N 1.39 3.05 -0.37 3.97 3.76 -0.61 -1.37 115.29 125.10 2kxp s HIS 452 Ca 0.09 -0.17 0.01 0.00 -0.15 0.00 0.00 55.06 54.84 2kxp s HIS 452 Cb -0.18 -1.91 0.12 0.00 1.11 0.00 0.00 32.58 31.71 2kxp s HIS 452 CO -0.19 0.09 0.15 0.08 -0.85 0.00 0.00 174.74 174.02 2kxp s VAL 453 N 0.06 1.37 0.19 -0.90 1.01 -1.25 -0.69 120.40 120.18 2kxp s VAL 453 Ca 0.00 -2.08 -0.01 0.00 0.00 0.00 0.00 61.98 59.89 2kxp s VAL 453 Cb -0.13 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2kxp s VAL 453 CO 0.03 -0.76 0.38 0.54 0.00 0.00 0.00 175.10 175.29 2kxp s VAL 454 N 0.93 5.21 -0.29 2.92 0.11 -1.06 -2.56 120.40 125.66 2kxp s VAL 454 Ca 0.13 -0.30 -0.01 0.00 -2.93 0.00 0.00 61.98 58.87 2kxp s VAL 454 Cb -0.21 -3.71 0.09 0.00 -1.53 0.00 0.00 36.38 31.02 2kxp s VAL 454 CO -0.11 -0.13 0.08 -1.61 -3.33 0.00 0.00 175.10 170.00 2kxp s GLU 455 N -3.18 0.77 0.24 1.54 2.02 -0.88 -2.90 118.70 116.30 2kxp s GLU 455 Ca 0.39 -0.98 -0.30 0.00 0.02 0.00 0.00 54.97 54.10 2kxp s GLU 455 Cb -0.11 -2.06 -0.09 0.00 0.10 0.00 0.00 34.13 31.97 2kxp s GLU 455 CO 0.28 -0.91 0.97 0.08 0.02 0.00 0.00 175.26 175.70 2kxp s VAL 456 N 1.63 4.00 -0.59 2.63 1.01 -0.79 -2.56 120.40 125.73 2kxp s VAL 456 Ca 0.07 1.99 0.06 0.00 0.00 0.00 0.00 61.98 64.11 2kxp s VAL 456 Cb -0.17 -4.27 0.26 0.00 0.00 0.00 0.00 36.38 32.20 2kxp s VAL 456 CO -0.21 0.46 0.74 1.67 0.00 0.00 0.00 175.10 177.76 2kxp n GLN 457 N 1.54 2.32 -1.31 2.72 7.27 0.75 -3.27 117.38 127.40 2kxp n GLN 457 Ca -0.02 -4.45 -0.42 0.00 0.07 0.00 0.00 57.00 52.18 2kxp n GLN 457 Cb 0.47 -2.09 -0.00 0.00 2.41 0.00 0.00 30.24 31.03 2kxp n GLN 457 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 2kxp n GLU 458 N 0.76 0.03 -4.47 3.69 0.00 -1.21 -2.66 120.64 116.78 2kxp n GLU 458 Ca 0.29 0.01 -0.33 0.00 0.00 0.00 0.00 57.16 57.12 2kxp n GLU 458 Cb 0.43 -1.03 -0.10 0.00 0.00 0.00 0.00 31.44 30.74 2kxp n GLU 458 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2kxp s LYS 459 N -1.03 2.75 0.16 5.31 -0.14 -1.13 -4.85 119.74 120.81 2kxp s LYS 459 Ca 0.60 -0.58 -0.23 0.00 -1.36 0.00 0.00 55.97 54.40 2kxp s LYS 459 Cb -0.65 -2.62 0.05 0.00 -1.68 0.00 0.00 37.83 32.93 2kxp s LYS 459 CO 0.62 0.65 1.60 0.66 -0.76 0.00 0.00 175.35 178.13 2kxp h SER 460 N 4.87 -1.02 -4.28 2.83 4.64 -1.92 -3.39 113.55 115.28 2kxp h SER 460 Ca -0.49 0.18 -0.52 0.00 -0.47 0.00 0.00 61.79 60.48 2kxp h SER 460 Cb 1.18 0.48 -0.24 0.00 -0.31 0.00 0.00 62.40 63.50 2kxp h SER 460 CO 0.54 -0.31 -0.82 -0.94 -0.87 0.00 0.00 176.83 174.43 2kxp s SER 461 N -5.06 2.20 0.00 4.97 1.04 -1.26 -4.72 113.70 110.87 2kxp s SER 461 Ca -0.15 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.74 2kxp s SER 461 Cb 0.13 -0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.10 2kxp s SER 461 CO 0.68 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.59 2kxp n GLY 462 N 1.66 1.16 3.93 7.32 0.00 -1.26 -4.52 105.19 113.49 2kxp n GLY 462 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2kxp n GLY 462 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kxp n ARG 463 N -1.47 0.00 -2.79 1.61 5.12 -1.26 -4.73 116.66 113.15 2kxp n ARG 463 Ca 0.00 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.50 2kxp n ARG 463 Cb 0.00 -4.34 -0.03 0.00 -1.16 0.00 0.00 32.46 26.93 2kxp n ARG 463 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2kxp s THR 464 N -0.96 4.81 0.14 0.55 -1.32 -1.26 -3.45 115.64 114.16 2kxp s THR 464 Ca 0.00 1.83 0.08 0.00 -1.21 0.00 0.00 61.69 62.40 2kxp s THR 464 Cb 0.00 -4.22 -0.04 0.00 -1.51 0.00 0.00 72.50 66.73 2kxp s THR 464 CO 0.00 -0.02 -0.13 0.00 -2.21 0.00 0.00 174.62 172.27 2kxp s ALA 465 N 2.29 2.85 -0.17 11.08 0.00 -1.20 -2.84 121.76 133.77 2kxp s ALA 465 Ca 0.42 -1.38 -0.17 0.00 0.00 0.00 0.00 51.96 50.83 2kxp s ALA 465 Cb -0.17 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 2kxp s ALA 465 CO 0.13 0.55 0.45 -1.58 0.00 0.00 0.00 175.76 175.31 2kxp s HIS 466 N -1.40 3.42 -0.11 0.00 2.46 -1.09 -3.26 115.29 115.31 2kxp s HIS 466 Ca 0.22 0.74 -0.05 0.00 0.47 0.00 0.00 55.06 56.44 2kxp s HIS 466 Cb -0.10 -2.57 -0.04 0.00 -0.13 0.00 0.00 32.58 29.75 2kxp s HIS 466 CO 0.13 0.03 0.08 0.71 -2.47 0.00 0.00 174.74 173.22 2kxp s TYR 467 N 1.16 3.39 -0.42 3.88 1.51 -1.10 -0.18 117.35 125.59 2kxp s TYR 467 Ca 0.22 0.36 0.02 0.00 -1.01 0.00 0.00 57.07 56.67 2kxp s TYR 467 Cb -0.15 -1.88 0.15 0.00 -0.11 0.00 0.00 41.96 39.97 2kxp s TYR 467 CO 0.09 0.59 0.28 0.21 -1.11 0.00 0.00 175.55 175.61 2kxp s LYS 468 N -0.89 0.99 0.53 -0.62 2.20 -1.06 -2.63 119.74 118.26 2kxp s LYS 468 Ca 0.14 -1.90 -0.11 0.00 -0.36 0.00 0.00 55.97 53.73 2kxp s LYS 468 Cb -0.12 -1.76 -0.05 0.00 -1.51 0.00 0.00 37.83 34.39 2kxp s LYS 468 CO 0.03 -1.26 0.94 -1.17 -0.36 0.00 0.00 175.35 173.53 2kxp s LEU 469 N 0.38 3.50 -0.46 5.43 2.96 -0.28 -2.08 118.68 128.13 2kxp s LEU 469 Ca 0.23 1.33 0.07 0.00 -0.22 0.00 0.00 54.13 55.54 2kxp s LEU 469 Cb -0.14 -4.31 0.30 0.00 0.50 0.00 0.00 46.19 42.54 2kxp s LEU 469 CO -0.07 -0.67 1.01 1.07 -1.32 0.00 0.00 176.35 176.38 2kxp n THR 470 N -2.11 -0.03 -0.71 3.68 5.66 -1.06 -1.90 114.28 117.81 2kxp n THR 470 Ca 0.05 -1.81 -0.29 0.00 -3.05 0.00 0.00 64.05 58.94 2kxp n THR 470 Cb 0.54 1.26 0.25 0.00 -1.55 0.00 0.00 70.33 70.84 2kxp n THR 470 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2kxp s SER 471 N -1.46 0.49 -0.38 1.09 1.04 -1.22 -3.87 113.70 109.39 2kxp s SER 471 Ca 0.26 1.03 -0.01 0.00 0.48 0.00 0.00 55.95 57.71 2kxp s SER 471 Cb 0.28 -1.53 0.19 0.00 0.10 0.00 0.00 66.02 65.05 2kxp s SER 471 CO -0.11 -4.44 0.88 -0.89 0.98 0.00 0.00 173.24 169.67 2kxp s THR 472 N -2.61 -0.56 0.40 2.02 2.01 -0.47 -3.19 115.64 113.24 2kxp s THR 472 Ca 0.69 -0.14 -0.25 0.00 0.31 0.00 0.00 61.69 62.29 2kxp s THR 472 Cb -0.17 0.00 -0.08 0.00 0.01 0.00 0.00 72.50 72.26 2kxp s THR 472 CO 0.59 0.00 1.19 -0.69 -0.69 0.00 0.00 174.62 175.02 2kxp s VAL 473 N 1.67 3.07 -0.39 3.82 1.01 -0.73 -3.66 120.40 125.19 2kxp s VAL 473 Ca 0.18 0.90 0.02 0.00 0.00 0.00 0.00 61.98 63.09 2kxp s VAL 473 Cb 0.02 -3.51 0.11 0.00 0.00 0.00 0.00 36.38 33.00 2kxp s VAL 473 CO -0.11 0.09 0.14 -0.32 0.00 0.00 0.00 175.10 174.91 2kxp s MET 474 N -2.28 1.35 -0.04 2.72 0.00 0.37 -0.99 119.30 120.43 2kxp s MET 474 Ca 0.57 -1.86 -0.23 0.00 0.00 0.00 0.00 55.69 54.17 2kxp s MET 474 Cb -0.32 -2.76 -0.04 0.00 0.00 0.00 0.00 34.83 31.71 2kxp s MET 474 CO 0.40 -1.03 0.69 -1.17 0.00 0.00 0.00 175.02 173.92 2kxp s LEU 475 N 0.73 4.35 -0.08 4.11 0.20 -1.22 -2.21 118.68 124.55 2kxp s LEU 475 Ca 0.13 1.21 0.03 0.00 0.69 0.00 0.00 54.13 56.20 2kxp s LEU 475 Cb -0.21 -3.08 0.01 0.00 -0.43 0.00 0.00 46.19 42.48 2kxp s LEU 475 CO -0.09 -0.07 -0.17 0.86 -0.29 0.00 0.00 176.35 176.59 2kxp s TRP 476 N 0.56 1.88 -0.05 5.38 -0.00 -0.67 -1.46 118.94 124.59 2kxp s TRP 476 Ca 0.37 -0.73 -0.01 0.00 -0.00 0.00 0.00 56.10 55.74 2kxp s TRP 476 Cb -0.18 -1.31 0.03 0.00 -0.00 0.00 0.00 33.47 32.00 2kxp s TRP 476 CO 0.19 -0.32 0.01 -0.51 -0.00 0.00 0.00 176.95 176.31 2kxp s LEU 477 N 0.51 0.78 0.06 5.86 1.43 -0.98 -1.82 118.68 124.52 2kxp s LEU 477 Ca -0.16 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 2kxp s LEU 477 Cb -0.16 -0.28 -0.04 0.00 0.03 0.00 0.00 46.19 45.74 2kxp s LEU 477 CO 0.06 -0.16 -0.05 -1.58 0.23 0.00 0.00 176.35 174.85 2kxp s GLN 478 N 1.55 0.65 -0.29 1.70 0.74 -1.06 0.15 119.66 123.09 2kxp s GLN 478 Ca -0.02 -1.16 -0.15 0.00 0.05 0.00 0.00 55.36 54.08 2kxp s GLN 478 Cb -0.13 0.02 0.11 0.00 1.10 0.00 0.00 33.01 34.11 2kxp s GLN 478 CO -0.03 -0.06 0.79 -0.08 -0.55 0.00 0.00 175.29 175.36 2kxp s THR 479 N -3.35 -0.21 -0.92 -0.34 -1.32 -0.60 -1.01 115.64 107.89 2kxp s THR 479 Ca 0.05 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.52 2kxp s THR 479 Cb 0.04 -1.00 0.27 0.00 -1.51 0.00 0.00 72.50 70.29 2kxp s THR 479 CO -0.06 0.00 1.07 0.59 -2.21 0.00 0.00 174.62 174.00 2kxp n ASN 480 N 4.39 5.04 -4.70 8.08 3.02 -1.26 -1.77 115.26 128.06 2kxp n ASN 480 Ca -0.17 -3.31 -0.32 0.00 -0.03 0.00 0.00 54.58 50.75 2kxp n ASN 480 Cb 0.56 -1.06 -0.08 0.00 -0.61 0.00 0.00 39.78 38.59 2kxp n ASN 480 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2kxp s LYS 481 N -2.19 2.76 0.18 3.52 2.20 -0.51 -4.90 119.74 120.80 2kxp s LYS 481 Ca 0.32 -0.67 -0.13 0.00 -0.36 0.00 0.00 55.97 55.13 2kxp s LYS 481 Cb 0.03 -2.66 0.13 0.00 -1.51 0.00 0.00 37.83 33.82 2kxp s LYS 481 CO -0.01 0.60 1.78 1.79 -0.36 0.00 0.00 175.35 179.16 2kxp h THR 482 N 3.24 0.95 0.00 3.43 1.35 -1.96 12.62 112.91 132.54 2kxp h THR 482 Ca -0.48 -0.16 -0.02 0.00 -0.55 0.00 0.00 66.41 65.19 2kxp h THR 482 Cb 1.17 0.43 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2kxp h THR 482 CO 0.59 0.09 -0.10 1.23 -0.25 0.00 0.00 175.52 177.08 2kxp h GLY 483 N 0.48 0.00 -0.14 5.82 0.00 -2.01 -2.69 103.07 104.52 2kxp h GLY 483 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2kxp h GLY 483 CO -0.15 0.00 -0.07 -1.14 0.00 0.00 0.00 176.54 175.17 2kxp n SER 484 N -3.73 1.53 0.00 0.19 3.41 -0.18 -5.04 113.62 109.79 2kxp n SER 484 Ca -0.02 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.37 2kxp n SER 484 Cb 0.20 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 2kxp n SER 484 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kxp n GLY 485 N -0.67 0.46 2.95 5.00 0.00 3.93 -3.43 105.19 113.43 2kxp n GLY 485 Ca 0.05 0.43 -0.30 0.00 0.00 0.00 0.00 46.02 46.21 2kxp n GLY 485 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kxp s THR 486 N 0.00 1.45 -0.16 2.61 -4.23 -1.26 -1.42 115.64 112.63 2kxp s THR 486 Ca 0.00 -0.92 0.00 0.00 -1.18 0.00 0.00 61.69 59.59 2kxp s THR 486 Cb 0.00 -1.59 0.03 0.00 1.34 0.00 0.00 72.50 72.28 2kxp s THR 486 CO 0.00 0.11 -0.12 -0.32 -0.54 0.00 0.00 174.62 173.75 2kxp s MET 487 N 1.47 2.10 -0.15 3.99 0.00 -0.73 -5.01 119.30 120.97 2kxp s MET 487 Ca -0.01 -0.62 0.02 0.00 0.00 0.00 0.00 55.69 55.07 2kxp s MET 487 Cb -0.16 -2.16 0.01 0.00 0.00 0.00 0.00 34.83 32.52 2kxp s MET 487 CO -0.08 -0.31 -0.20 -0.80 0.00 0.00 0.00 175.02 173.64 2kxp s ASN 488 N 1.49 3.27 -0.52 1.11 0.02 -1.26 -1.56 114.94 117.47 2kxp s ASN 488 Ca 0.03 -0.58 0.05 0.00 -1.02 0.00 0.00 52.86 51.34 2kxp s ASN 488 Cb -0.14 -1.49 0.20 0.00 0.02 0.00 0.00 41.25 39.84 2kxp s ASN 488 CO -0.10 0.06 0.47 -0.11 0.02 0.00 0.00 177.10 177.45 2kxp n LEU 489 N 4.20 1.21 0.00 0.60 7.94 0.40 -5.00 117.00 126.36 2kxp n LEU 489 Ca -0.20 -4.82 0.00 0.00 -1.11 0.00 0.00 56.01 49.88 2kxp n LEU 489 Cb 0.51 0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.49 2kxp n LEU 489 CO 0.27 1.90 0.00 0.61 -1.11 0.00 0.00 177.39 179.06 2kxp n GLY 490 N 2.04 3.61 0.00 -3.96 0.00 -1.26 -2.32 105.19 103.30 2kxp n GLY 490 Ca 0.25 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 44.19 2kxp n GLY 490 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kxp n GLY 491 N 5.00 0.29 0.00 -0.02 0.00 -0.53 -4.93 105.19 105.00 2kxp n GLY 491 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2kxp n GLY 491 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2kxp n SER 492 N 0.00 0.00 -4.64 1.61 2.88 -1.26 -3.46 113.62 108.76 2kxp n SER 492 Ca 0.00 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.24 2kxp n SER 492 Cb 0.00 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 2kxp n SER 492 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2kxp s LEU 493 N 0.00 3.27 0.02 2.46 1.98 -0.16 -4.96 118.68 121.29 2kxp s LEU 493 Ca 0.00 -0.26 0.06 0.00 -2.89 0.00 0.00 54.13 51.04 2kxp s LEU 493 Cb 0.00 -2.02 -0.02 0.00 0.66 0.00 0.00 46.19 44.81 2kxp s LEU 493 CO 0.00 0.19 -0.17 -0.89 -1.89 0.00 0.00 176.35 173.58 2kxp s THR 494 N -1.25 1.37 -0.15 3.68 2.01 -1.26 -1.77 115.64 118.28 2kxp s THR 494 Ca 0.23 -0.93 -0.08 0.00 0.31 0.00 0.00 61.69 61.23 2kxp s THR 494 Cb -0.11 -1.18 0.06 0.00 0.01 0.00 0.00 72.50 71.27 2kxp s THR 494 CO 0.15 0.23 0.36 -0.13 -0.69 0.00 0.00 174.62 174.55 2kxp s ARG 495 N -0.81 0.32 0.39 4.92 1.81 -1.19 -5.03 118.95 119.36 2kxp s ARG 495 Ca 0.06 0.73 -0.01 0.00 -1.72 0.00 0.00 55.73 54.79 2kxp s ARG 495 Cb -0.07 -0.03 -0.03 0.00 -0.45 0.00 0.00 34.95 34.37 2kxp s ARG 495 CO 0.01 -0.17 0.61 -0.65 -0.68 0.00 0.00 175.30 174.41 2kxp s GLN 496 N 1.51 3.44 -0.28 3.54 -0.21 -1.26 -3.42 119.66 122.97 2kxp s GLN 496 Ca -0.08 -0.25 -0.16 0.00 0.02 0.00 0.00 55.36 54.88 2kxp s GLN 496 Cb -0.09 -2.59 0.08 0.00 1.00 0.00 0.00 33.01 31.40 2kxp s GLN 496 CO -0.11 0.03 0.69 1.41 -2.12 0.00 0.00 175.29 175.18 2kxp s MET 497 N -4.43 0.72 0.00 2.91 1.75 -0.80 -4.98 119.30 114.47 2kxp s MET 497 Ca 0.42 1.22 0.03 0.00 -1.25 0.00 0.00 55.69 56.11 2kxp s MET 497 Cb -0.10 0.15 -0.01 0.00 2.84 0.00 0.00 34.83 37.71 2kxp s MET 497 CO 0.38 -0.15 -0.09 -1.21 -0.65 0.00 0.00 175.02 173.30 2kxp s GLU 498 N 1.58 0.68 -0.24 4.11 8.01 -1.26 -1.13 118.70 130.46 2kxp s GLU 498 Ca -0.10 -0.39 -0.28 0.00 0.01 0.00 0.00 54.97 54.22 2kxp s GLU 498 Cb -0.05 -0.64 0.15 0.00 -4.31 0.00 0.00 34.13 29.28 2kxp s GLU 498 CO -0.19 0.17 1.15 0.21 0.01 0.00 0.00 175.26 176.61 2kxp s LYS 499 N -0.44 0.37 -0.18 1.61 2.20 -1.08 -5.05 119.74 117.18 2kxp s LYS 499 Ca 0.02 0.22 -0.19 0.00 -0.36 0.00 0.00 55.97 55.66 2kxp s LYS 499 Cb -0.04 0.18 -0.03 0.00 -1.51 0.00 0.00 37.83 36.42 2kxp s LYS 499 CO -0.00 -0.09 0.53 0.16 -0.36 0.00 0.00 175.35 175.59 2kxp s ASP 500 N -0.55 6.61 0.27 1.43 -4.77 -1.26 -2.71 116.67 115.69 2kxp s ASP 500 Ca 0.03 0.73 0.11 0.00 -3.30 0.00 0.00 52.55 50.13 2kxp s ASP 500 Cb -0.02 -2.30 -0.05 0.00 -1.09 0.00 0.00 42.92 39.45 2kxp s ASP 500 CO -0.05 -0.16 -0.19 -0.70 0.70 0.00 0.00 175.17 174.77 2kxp s GLU 501 N 1.48 1.65 -0.12 2.11 2.12 -1.20 -5.03 118.70 119.71 2kxp s GLU 501 Ca 0.25 -1.76 -0.15 0.00 0.36 0.00 0.00 54.97 53.67 2kxp s GLU 501 Cb -0.15 -1.70 -0.05 0.00 0.26 0.00 0.00 34.13 32.49 2kxp s GLU 501 CO 0.10 0.31 0.37 0.95 -0.54 0.00 0.00 175.26 176.45 2kxp s THR 502 N -2.56 5.23 -0.25 -1.70 -4.23 -1.26 -3.26 115.64 107.60 2kxp s THR 502 Ca 0.29 0.73 -0.12 0.00 -1.18 0.00 0.00 61.69 61.42 2kxp s THR 502 Cb -0.04 -3.71 -0.05 0.00 1.34 0.00 0.00 72.50 70.04 2kxp s THR 502 CO 0.14 0.40 0.24 -0.69 -0.54 0.00 0.00 174.62 174.17 2kxp s VAL 503 N 0.25 5.29 0.25 2.29 1.01 -1.22 -4.85 120.40 123.42 2kxp s VAL 503 Ca 0.21 0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.53 2kxp s VAL 503 Cb -0.14 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 2kxp s VAL 503 CO 0.08 0.27 0.26 -1.54 0.00 0.00 0.00 175.10 174.17 2kxp n SER 504 N 4.77 -0.70 -0.01 3.32 3.41 -0.50 -4.77 113.62 119.13 2kxp n SER 504 Ca -0.13 -2.56 -0.07 0.00 -0.26 0.00 0.00 58.87 55.86 2kxp n SER 504 Cb 0.52 1.47 0.12 0.00 -0.26 0.00 0.00 64.21 66.06 2kxp n SER 504 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2kxp h ASP 505 N 1.50 0.60 1.63 4.04 3.32 -1.98 -1.95 116.42 123.58 2kxp h ASP 505 Ca -0.18 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2kxp h ASP 505 Cb 0.89 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.27 2kxp h ASP 505 CO 0.26 0.91 -0.36 0.77 -1.72 0.00 0.00 179.24 179.10 2kxp h SER 506 N 0.49 0.00 -2.21 6.45 4.64 -1.99 -3.38 113.55 117.54 2kxp h SER 506 Ca 0.05 -0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.79 2kxp h SER 506 Cb 0.85 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.54 2kxp h SER 506 CO 0.07 0.00 -0.96 -0.24 -0.87 0.00 0.00 176.83 174.84 2kxp n SER 507 N -2.93 0.76 -2.70 4.97 2.88 -1.07 -5.04 113.62 110.49 2kxp n SER 507 Ca 0.03 -2.76 -0.08 0.00 -1.33 0.00 0.00 58.87 54.73 2kxp n SER 507 Cb 0.53 -0.63 0.06 0.00 -0.75 0.00 0.00 64.21 63.43 2kxp n SER 507 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2kxp n PRO 508 N 1.74 -1.24 0.35 -1.46 -0.04 -0.76 -1.41 135.00 132.19 2kxp n PRO 508 Ca 0.25 -0.47 -0.15 0.00 -0.04 0.00 0.00 63.50 63.08 2kxp n PRO 508 Cb 0.48 -0.41 -0.07 0.00 -0.04 0.00 0.00 33.50 33.47 2kxp n PRO 508 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2kxp h HIS 509 N -1.66 -0.95 -0.88 0.54 3.86 -1.95 -1.71 115.15 112.40 2kxp h HIS 509 Ca -0.11 -0.01 0.19 0.00 -1.16 0.00 0.00 60.37 59.28 2kxp h HIS 509 Cb 0.32 0.33 -0.16 0.00 1.06 0.00 0.00 27.41 28.96 2kxp h HIS 509 CO 0.00 -0.56 -0.14 0.82 0.86 0.00 0.00 177.93 178.91 2kxp h ILE 510 N -0.94 0.14 -0.31 2.45 2.04 -1.98 0.44 117.51 119.36 2kxp h ILE 510 Ca -0.09 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 65.82 2kxp h ILE 510 Cb 0.74 0.12 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 2kxp h ILE 510 CO 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 178.15 178.26 2kxp h ALA 511 N 1.87 0.26 -0.16 1.87 0.00 -1.86 0.50 119.26 121.74 2kxp h ALA 511 Ca 0.45 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.45 2kxp h ALA 511 Cb 0.76 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2kxp h ALA 511 CO -0.87 -0.42 0.07 -0.91 0.00 0.00 0.00 179.25 177.12 2kxp h ASN 512 N 0.07 0.21 -0.31 0.00 2.35 0.60 -1.68 115.58 116.82 2kxp h ASN 512 Ca 0.15 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2kxp h ASN 512 Cb 0.20 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 2kxp h ASN 512 CO -0.26 0.30 0.17 0.40 -1.65 0.00 0.00 177.43 176.39 2kxp h ILE 513 N 0.11 1.12 -0.20 2.81 2.04 0.05 -2.42 117.51 121.01 2kxp h ILE 513 Ca 0.05 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 2kxp h ILE 513 Cb 0.16 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2kxp h ILE 513 CO -0.01 0.14 -0.02 1.23 0.00 0.00 0.00 178.15 179.49 2kxp h GLY 514 N 0.58 0.40 0.74 5.37 0.00 0.38 -1.66 103.07 108.88 2kxp h GLY 514 Ca 0.12 -0.31 0.05 0.00 0.00 0.00 0.00 47.33 47.19 2kxp h GLY 514 CO -0.02 0.28 0.35 3.21 0.00 0.00 0.00 176.54 180.37 2kxp h ARG 515 N 0.11 0.65 0.22 4.80 2.47 -0.90 0.85 114.38 122.57 2kxp h ARG 515 Ca 0.05 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.72 2kxp h ARG 515 Cb 0.44 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.62 2kxp h ARG 515 CO 0.01 0.43 -0.10 -0.07 0.56 0.00 0.00 179.97 180.80 2kxp h LEU 516 N 0.67 -0.25 -0.44 3.04 4.07 -1.38 -1.00 115.31 120.02 2kxp h LEU 516 Ca 0.27 -0.11 0.06 0.00 0.08 0.00 0.00 57.88 58.18 2kxp h LEU 516 Cb 0.13 0.06 -0.05 0.00 1.08 0.00 0.00 40.66 41.88 2kxp h LEU 516 CO -0.16 -0.04 0.14 0.58 -1.08 0.00 0.00 178.44 177.88 2kxp h VAL 517 N -0.45 0.83 0.05 1.22 2.07 -1.01 0.49 116.25 119.44 2kxp h VAL 517 Ca -0.03 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.40 2kxp h VAL 517 Cb 0.34 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2kxp h VAL 517 CO 0.05 0.05 -0.10 -0.08 0.02 0.00 0.00 177.57 177.51 2kxp h GLU 518 N 0.29 -0.20 -0.59 1.57 4.22 -0.74 0.19 114.58 119.33 2kxp h GLU 518 Ca 0.21 0.01 -0.05 0.00 0.08 0.00 0.00 59.36 59.62 2kxp h GLU 518 Cb 0.23 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2kxp h GLU 518 CO -0.23 -0.13 0.17 0.22 -2.18 0.00 0.00 179.01 176.86 2kxp h ASP 519 N -0.20 0.83 -0.05 1.04 1.82 -0.73 -0.54 116.42 118.59 2kxp h ASP 519 Ca 0.02 -0.14 -0.00 0.00 -0.39 0.00 0.00 57.03 56.52 2kxp h ASP 519 Cb 0.23 -0.22 -0.00 0.00 0.68 0.00 0.00 39.33 40.02 2kxp h ASP 519 CO -0.07 0.79 0.01 -0.03 -1.61 0.00 0.00 179.24 178.33 2kxp h MET 520 N 0.87 0.07 -0.40 0.28 4.05 0.46 -1.65 114.93 118.61 2kxp h MET 520 Ca 0.19 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.58 2kxp h MET 520 Cb 0.27 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 2kxp h MET 520 CO -0.01 0.27 0.18 0.93 0.23 0.00 0.00 176.91 178.52 2kxp h GLU 521 N -0.14 0.59 -0.89 0.39 4.39 -0.46 -0.47 114.58 117.99 2kxp h GLU 521 Ca 0.01 -0.09 0.07 0.00 0.34 0.00 0.00 59.36 59.69 2kxp h GLU 521 Cb 0.23 -0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 28.71 2kxp h GLU 521 CO -0.00 0.52 0.55 -0.91 -1.16 0.00 0.00 179.01 178.02 2kxp h ASN 522 N 0.51 0.86 -0.20 1.42 -0.26 -1.04 0.58 115.58 117.45 2kxp h ASN 522 Ca 0.14 0.02 -0.17 0.00 -0.56 0.00 0.00 56.30 55.73 2kxp h ASN 522 Cb 0.14 -0.16 -0.00 0.00 -1.06 0.00 0.00 38.32 37.23 2kxp h ASN 522 CO -0.02 0.55 -0.48 0.50 -1.06 0.00 0.00 177.43 176.92 2kxp h LYS 523 N 1.00 0.77 0.00 0.81 3.64 -0.99 -2.96 116.57 118.84 2kxp h LYS 523 Ca 0.39 -0.45 -0.07 0.00 -1.27 0.00 0.00 60.65 59.25 2kxp h LYS 523 Cb 0.19 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2kxp h LYS 523 CO -0.18 1.08 -0.32 0.82 -2.27 0.00 0.00 179.45 178.58 2kxp h ILE 524 N 0.61 0.67 0.00 2.00 2.04 -0.28 -2.85 117.51 119.70 2kxp h ILE 524 Ca 0.03 -1.49 -0.07 0.00 1.00 0.00 0.00 64.86 64.33 2kxp h ILE 524 Cb 1.06 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.12 2kxp h ILE 524 CO 0.10 0.31 -0.33 0.08 0.00 0.00 0.00 178.15 178.31 2kxp h ARG 525 N 0.00 0.00 0.17 2.37 -0.00 0.30 -1.64 114.38 115.58 2kxp h ARG 525 Ca -0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 59.98 59.64 2kxp h ARG 525 Cb 0.96 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.94 2kxp h ARG 525 CO 0.04 0.33 -1.69 0.66 -0.00 0.00 0.00 179.97 179.31 2kxp h SER 526 N 0.00 0.56 -0.24 0.08 4.64 -1.46 -3.23 113.55 113.90 2kxp h SER 526 Ca -0.00 -0.82 -0.08 0.00 -0.47 0.00 0.00 61.79 60.41 2kxp h SER 526 Cb 0.69 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 2kxp h SER 526 CO 0.04 1.69 -0.12 0.74 -0.87 0.00 0.00 176.83 178.32 2kxp h THR 527 N 0.10 1.25 -0.53 2.95 2.02 -1.41 -1.83 112.91 115.46 2kxp h THR 527 Ca -0.32 -1.10 -0.06 0.00 0.77 0.00 0.00 66.41 65.71 2kxp h THR 527 Cb 2.08 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 69.57 2kxp h THR 527 CO 0.18 0.37 0.10 -0.07 0.37 0.00 0.00 175.52 176.47 2kxp h LEU 528 N 0.58 0.83 -1.06 2.58 3.38 -1.42 0.72 115.31 120.92 2kxp h LEU 528 Ca 0.10 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2kxp h LEU 528 Cb 0.54 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2kxp h LEU 528 CO 0.03 0.87 -0.40 -1.13 0.09 0.00 0.00 178.44 177.90 2kxp h ASN 529 N 0.76 0.14 0.13 -0.43 -1.24 -1.52 0.65 115.58 114.06 2kxp h ASN 529 Ca 0.16 -0.05 -0.01 0.00 0.71 0.00 0.00 56.30 57.11 2kxp h ASN 529 Cb 0.38 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.39 2kxp h ASN 529 CO 0.01 0.53 -0.06 -0.33 -1.29 0.00 0.00 177.43 176.29 2kxp h GLU 530 N 0.11 -0.17 0.67 6.67 5.08 -0.99 -2.97 114.58 122.98 2kxp h GLU 530 Ca 0.01 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2kxp h GLU 530 Cb 0.76 0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.06 2kxp h GLU 530 CO 0.06 0.29 -0.32 0.82 -1.00 0.00 0.00 179.01 178.85 2kxp h ILE 531 N -0.89 0.00 0.00 3.13 2.04 -0.88 0.11 117.51 121.02 2kxp h ILE 531 Ca -0.02 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.65 2kxp h ILE 531 Cb 0.53 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 2kxp h ILE 531 CO 0.03 0.00 0.00 -1.22 0.00 0.00 0.00 178.15 176.96 2kxp n TYR 532 N -4.96 0.00 -0.47 1.37 4.02 0.22 -1.05 117.16 116.30 2kxp n TYR 532 Ca -0.11 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.77 2kxp n TYR 532 Cb 0.36 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.67 2kxp n TYR 532 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2kxp n PHE 533 N -0.23 0.00 0.00 -0.72 3.72 -1.12 -3.71 117.46 115.40 2kxp n PHE 533 Ca 0.00 -0.91 0.00 0.00 -0.05 0.00 0.00 57.45 56.49 2kxp n PHE 533 Cb 0.00 -0.53 0.00 0.00 -0.94 0.00 0.00 39.48 38.01 2kxp n PHE 533 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2kxp n GLY 534 N 1.61 -0.06 0.07 1.37 0.00 0.11 -4.78 105.19 103.51 2kxp n GLY 534 Ca 0.02 0.11 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 2kxp n GLY 534 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kxp h LYS 535 N 0.00 -0.15 -0.74 1.61 1.57 0.81 -1.44 116.57 118.23 2kxp h LYS 535 Ca 0.00 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.87 2kxp h LYS 535 Cb 0.00 0.03 -0.10 0.00 0.08 0.00 0.00 32.23 32.25 2kxp h LYS 535 CO 0.00 -0.10 -0.39 0.25 -0.57 0.00 0.00 179.45 178.64 2kxp n THR 536 N -2.62 -0.46 -0.08 -0.16 -2.24 -0.67 0.85 114.28 108.90 2kxp n THR 536 Ca -0.02 1.77 -0.08 0.00 -2.27 0.00 0.00 64.05 63.46 2kxp n THR 536 Cb 0.07 -2.24 -0.01 0.00 -2.10 0.00 0.00 70.33 66.05 2kxp n THR 536 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2kxp h LYS 537 N 0.00 -0.22 -0.68 -0.78 3.64 -1.62 0.61 116.57 117.52 2kxp h LYS 537 Ca 0.17 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.67 2kxp h LYS 537 Cb 0.35 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 32.14 2kxp h LYS 537 CO -0.71 -0.15 0.27 -0.44 -2.27 0.00 0.00 179.45 176.16 2kxp h ASP 538 N -0.23 0.29 -0.51 4.20 3.32 0.16 0.47 116.42 124.11 2kxp h ASP 538 Ca 0.16 0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 2kxp h ASP 538 Cb 0.48 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 2kxp h ASP 538 CO -0.45 0.15 0.26 0.40 -1.72 0.00 0.00 179.24 177.88 2kxp h ILE 539 N 0.46 1.18 -0.53 0.35 1.08 0.71 -1.97 117.51 118.79 2kxp h ILE 539 Ca 0.35 -0.52 -0.07 0.00 -0.39 0.00 0.00 64.86 64.23 2kxp h ILE 539 Cb 0.46 0.49 -0.02 0.00 -3.07 0.00 0.00 36.82 34.68 2kxp h ILE 539 CO -0.33 0.21 0.06 0.58 -0.69 0.00 0.00 178.15 177.99 2kxp h VAL 540 N 0.76 1.26 0.00 1.67 2.07 0.12 -2.10 116.25 120.03 2kxp h VAL 540 Ca 0.19 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.72 2kxp h VAL 540 Cb 0.09 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2kxp h VAL 540 CO -0.03 0.36 0.00 0.78 0.02 0.00 0.00 177.57 178.70 2kxp h ASN 541 N 0.78 0.00 1.17 0.57 2.35 -0.73 -2.51 115.58 117.21 2kxp h ASN 541 Ca 0.16 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.75 2kxp h ASN 541 Cb 0.44 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 2kxp h ASN 541 CO 0.01 0.00 -0.85 1.23 -1.65 0.00 0.00 177.43 176.17 2kxp h GLY 542 N 2.09 0.00 0.60 2.83 0.00 -0.69 -3.34 103.07 104.56 2kxp h GLY 542 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2kxp h GLY 542 CO 0.00 0.00 -0.04 1.41 0.00 0.00 0.00 176.54 177.91 2kxp h LEU 543 N 0.00 -0.10 -8.54 3.11 3.38 -1.12 -3.47 115.31 108.57 2kxp h LEU 543 Ca -0.04 -0.35 -0.21 0.00 0.09 0.00 0.00 57.88 57.37 2kxp h LEU 543 Cb 1.59 0.03 -0.14 0.00 0.09 0.00 0.00 40.66 42.23 2kxp h LEU 543 CO 0.09 0.31 -0.54 -0.60 0.09 0.00 0.00 178.44 177.79 2kxp s ARG 544 N -4.52 1.26 -0.03 1.13 3.52 -1.22 -5.15 118.95 113.93 2kxp s ARG 544 Ca -0.15 -1.58 -0.03 0.00 -0.13 0.00 0.00 55.73 53.85 2kxp s ARG 544 Cb 0.02 0.30 0.01 0.00 -1.56 0.00 0.00 34.95 33.73 2kxp s ARG 544 CO 0.63 -0.43 0.09 0.45 -0.81 0.00 0.00 175.30 175.22 2kxp s SER 545 N -3.14 -0.07 0.09 -2.12 0.15 -1.26 -4.54 113.70 102.80 2kxp s SER 545 Ca 0.36 0.17 -0.16 0.00 0.70 0.00 0.00 55.95 57.03 2kxp s SER 545 Cb 0.06 0.15 -0.08 0.00 -1.71 0.00 0.00 66.02 64.43 2kxp s SER 545 CO 0.12 -0.05 1.44 0.40 1.20 0.00 0.00 173.24 176.34 2kxp h ILE 546 N 5.27 1.30 -3.56 6.45 2.04 -2.01 -3.43 117.51 123.56 2kxp h ILE 546 Ca -0.29 -1.33 -0.52 0.00 1.00 0.00 0.00 64.86 63.72 2kxp h ILE 546 Cb 1.19 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.79 2kxp h ILE 546 CO 0.46 0.42 0.23 -1.81 0.00 0.00 0.00 178.15 177.45 2kxp s ASP 547 N -6.39 7.43 -0.10 1.72 1.01 -1.26 -4.97 116.67 114.11 2kxp s ASP 547 Ca -0.13 1.70 -0.36 0.00 0.71 0.00 0.00 52.55 54.47 2kxp s ASP 547 Cb 0.08 -2.53 -0.14 0.00 1.01 0.00 0.00 42.92 41.35 2kxp s ASP 547 CO 0.81 0.14 1.76 0.00 0.21 0.00 0.00 175.17 178.09 2kxp n ALA 548 N 1.88 0.48 -2.59 5.23 0.00 -1.26 -4.88 120.51 119.36 2kxp n ALA 548 Ca -0.04 0.35 -0.43 0.00 0.00 0.00 0.00 53.44 53.33 2kxp n ALA 548 Cb 0.49 -2.37 -0.02 0.00 0.00 0.00 0.00 19.45 17.55 2kxp n ALA 548 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2kxp s ILE 549 N 3.25 4.30 -0.39 0.00 1.01 -1.26 -4.89 121.20 123.22 2kxp s ILE 549 Ca 0.92 1.41 -0.09 0.00 0.00 0.00 0.00 60.65 62.88 2kxp s ILE 549 Cb -0.82 -4.49 -0.09 0.00 0.01 0.00 0.00 42.46 37.06 2kxp s ILE 549 CO 0.54 -0.77 1.42 -2.65 0.00 0.00 0.00 174.94 173.48 2kxp n PRO 550 N 7.47 0.04 -0.35 2.79 -0.02 -1.26 -4.78 135.00 138.89 2kxp n PRO 550 Ca 0.12 -0.54 -0.11 0.00 -2.02 0.00 0.00 63.50 60.95 2kxp n PRO 550 Cb 0.48 -1.96 -0.00 0.00 -0.02 0.00 0.00 33.50 32.00 2kxp n PRO 550 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kxp n ASP 551 N 9.63 -0.65 -3.88 2.55 5.75 -1.26 -4.92 116.55 123.77 2kxp n ASP 551 Ca 0.16 0.23 -0.28 0.00 -0.01 0.00 0.00 54.79 54.90 2kxp n ASP 551 Cb 0.47 -0.24 -0.17 0.00 -1.03 0.00 0.00 41.12 40.16 2kxp n ASP 551 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2kxp s ASN 552 N -0.26 2.64 0.18 -1.12 4.22 -1.26 -4.99 114.94 114.35 2kxp s ASN 552 Ca 0.16 -0.57 0.17 0.00 -2.14 0.00 0.00 52.86 50.47 2kxp s ASN 552 Cb -0.19 -0.85 -0.02 0.00 1.28 0.00 0.00 41.25 41.47 2kxp s ASN 552 CO 0.16 -0.18 1.15 0.06 -2.04 0.00 0.00 177.10 176.25 2kxp h GLN 553 N 8.15 0.00 0.15 3.55 -0.00 -2.00 -3.37 115.11 121.60 2kxp h GLN 553 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.41 2kxp h GLN 553 Cb 1.12 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.57 2kxp h GLN 553 CO 0.39 0.35 -0.30 0.87 -0.00 0.00 0.00 178.83 180.14 2kxp h LYS 554 N 0.00 -0.48 -0.56 0.06 1.57 -1.96 0.92 116.57 116.12 2kxp h LYS 554 Ca -0.07 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.82 2kxp h LYS 554 Cb 1.43 0.11 -0.10 0.00 0.08 0.00 0.00 32.23 33.74 2kxp h LYS 554 CO 0.05 -0.32 -0.44 1.88 -0.57 0.00 0.00 179.45 180.05 2kxp h TYR 555 N -0.50 -1.29 -0.40 -1.35 -1.99 -1.98 1.54 116.97 111.00 2kxp h TYR 555 Ca -0.02 0.08 0.04 0.00 2.00 0.00 0.00 58.73 60.83 2kxp h TYR 555 Cb 0.47 0.65 -0.04 0.00 2.00 0.00 0.00 36.73 39.81 2kxp h TYR 555 CO -0.31 -0.43 0.18 0.87 -0.00 0.00 0.00 178.16 178.48 2kxp h LYS 556 N -0.24 0.36 0.00 4.88 1.79 -1.65 0.22 116.57 121.93 2kxp h LYS 556 Ca 0.17 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.56 2kxp h LYS 556 Cb 0.56 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.12 2kxp h LYS 556 CO -0.68 0.24 -0.28 0.37 -1.08 0.00 0.00 179.45 178.02 2kxp h GLN 557 N 0.37 0.00 0.00 3.15 4.15 0.27 -1.96 115.11 121.10 2kxp h GLN 557 Ca 0.17 0.00 -0.19 0.00 0.77 0.00 0.00 58.65 59.40 2kxp h GLN 557 Cb 0.10 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.77 2kxp h GLN 557 CO -0.14 0.28 -0.90 1.25 -1.93 0.00 0.00 178.83 177.39 2kxp h LEU 558 N 0.00 0.03 -0.33 -2.39 5.85 0.32 -3.25 115.31 115.54 2kxp h LEU 558 Ca -0.00 -0.03 -0.20 0.00 0.84 0.00 0.00 57.88 58.49 2kxp h LEU 558 Cb 0.51 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 2kxp h LEU 558 CO 0.04 0.91 -0.75 -0.61 -0.34 0.00 0.00 178.44 177.69 2kxp h GLN 559 N 0.01 0.51 -0.96 1.25 4.15 -0.11 -2.92 115.11 117.04 2kxp h GLN 559 Ca -0.02 -0.42 0.05 0.00 0.77 0.00 0.00 58.65 59.03 2kxp h GLN 559 Cb 1.58 0.09 -0.06 0.00 0.21 0.00 0.00 27.48 29.30 2kxp h GLN 559 CO 0.12 1.05 0.62 0.00 -1.93 0.00 0.00 178.83 178.70 2kxp h ARG 560 N 0.35 1.15 0.51 1.69 3.08 -1.41 0.55 114.38 120.30 2kxp h ARG 560 Ca -0.04 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 2kxp h ARG 560 Cb 1.34 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 31.14 2kxp h ARG 560 CO 0.14 0.76 -0.24 0.93 -1.07 0.00 0.00 179.97 180.48 2kxp h GLU 561 N 1.18 -0.66 -0.97 0.04 4.39 -1.59 -2.21 114.58 114.76 2kxp h GLU 561 Ca 0.39 0.04 0.23 0.00 0.34 0.00 0.00 59.36 60.36 2kxp h GLU 561 Cb 0.06 0.15 -0.12 0.00 -0.10 0.00 0.00 28.75 28.74 2kxp h GLU 561 CO -0.14 -0.44 0.54 1.25 -1.16 0.00 0.00 179.01 179.06 2kxp h LEU 562 N -1.00 0.61 0.00 1.33 6.46 -1.44 -2.57 115.31 118.69 2kxp h LEU 562 Ca -0.07 0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 2kxp h LEU 562 Cb 0.52 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.50 2kxp h LEU 562 CO 0.11 0.11 0.00 -1.20 -0.62 0.00 0.00 178.44 176.85 2kxp n SER 563 N -4.90 0.00 0.11 1.25 7.64 0.18 -2.20 113.62 115.69 2kxp n SER 563 Ca 0.25 0.65 0.00 0.00 1.01 0.00 0.00 58.87 60.78 2kxp n SER 563 Cb 0.68 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2kxp n SER 563 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2kxp n GLN 564 N -1.05 0.01 -0.05 1.43 7.27 -0.83 0.20 117.38 124.36 2kxp n GLN 564 Ca 0.00 0.31 -0.15 0.00 0.07 0.00 0.00 57.00 57.23 2kxp n GLN 564 Cb 0.00 -1.85 -0.07 0.00 2.41 0.00 0.00 30.24 30.73 2kxp n GLN 564 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2kxp h VAL 565 N 0.00 1.33 0.14 1.69 2.07 -1.03 -1.74 116.25 118.70 2kxp h VAL 565 Ca 0.00 -1.71 -0.29 0.00 0.82 0.00 0.00 66.70 65.52 2kxp h VAL 565 Cb 1.16 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 2kxp h VAL 565 CO 0.00 0.53 -1.36 -0.07 0.02 0.00 0.00 177.57 176.69 2kxp h LEU 566 N 0.29 0.45 -1.39 2.57 3.38 0.22 -0.07 115.31 120.76 2kxp h LEU 566 Ca -0.01 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2kxp h LEU 566 Cb 1.08 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2kxp h LEU 566 CO 0.10 1.42 0.00 0.71 0.09 0.00 0.00 178.44 180.76 2kxp h THR 567 N 0.08 0.00 -0.06 0.22 1.35 -1.57 -2.78 112.91 110.14 2kxp h THR 567 Ca -0.18 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 2kxp h THR 567 Cb 2.00 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.89 2kxp h THR 567 CO 0.20 0.00 0.00 1.67 -0.25 0.00 0.00 175.52 177.14 2kxp n GLN 568 N -3.02 1.79 0.00 4.72 -0.06 -0.66 -5.05 117.38 115.10 2kxp n GLN 568 Ca 0.01 -1.32 0.00 0.00 -2.00 0.00 0.00 57.00 53.69 2kxp n GLN 568 Cb 0.30 -1.07 0.00 0.00 -4.06 0.00 0.00 30.24 25.42 2kxp n GLN 568 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2kxp n ARG 569 N -0.10 0.00 0.00 3.69 0.00 -0.04 -5.00 116.66 115.20 2kxp n ARG 569 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 2kxp n ARG 569 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.68 2kxp n ARG 569 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2kxp n GLN 570 N 0.00 0.00 0.00 -0.14 7.27 -1.25 -4.65 117.38 118.61 2kxp n GLN 570 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2kxp n GLN 570 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2kxp n GLN 570 CO 0.00 0.00 0.00 1.51 0.07 0.00 0.00 177.06 178.64