#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kzz n ILE 325 N 0.00 0.00 -3.05 1.12 5.41 -1.26 -5.10 119.36 116.49 2kzz n ILE 325 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2kzz n ILE 325 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2kzz n ILE 325 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2kzz n SER 326 N 0.00 1.12 0.00 4.38 3.41 -1.26 -5.01 113.62 116.26 2kzz n SER 326 Ca 0.00 -0.49 0.14 0.00 -0.26 0.00 0.00 58.87 58.27 2kzz n SER 326 Cb 0.00 0.00 0.79 0.00 -0.26 0.00 0.00 64.21 64.74 2kzz n SER 326 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2kzz n TYR 327 N -0.21 0.00 0.05 7.33 4.01 -1.26 -3.61 117.16 123.46 2kzz n TYR 327 Ca 0.00 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.57 2kzz n TYR 327 Cb 0.00 -0.15 -0.14 0.00 -0.31 0.00 0.00 39.34 38.74 2kzz n TYR 327 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2kzz h ASP 328 N 0.00 0.38 -0.12 7.72 3.32 -2.00 -3.39 116.42 122.33 2kzz h ASP 328 Ca 0.00 -0.59 0.04 0.00 0.02 0.00 0.00 57.03 56.50 2kzz h ASP 328 Cb 0.14 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.52 2kzz h ASP 328 CO 0.00 1.50 -0.16 0.78 -1.72 0.00 0.00 179.24 179.64 2kzz h ASN 329 N 0.07 -0.48 -3.74 6.45 4.21 -1.97 -3.44 115.58 116.67 2kzz h ASN 329 Ca -0.28 0.09 -0.63 0.00 1.21 0.00 0.00 56.30 56.69 2kzz h ASN 329 Cb 2.03 0.23 -0.21 0.00 -1.12 0.00 0.00 38.32 39.25 2kzz h ASN 329 CO 0.15 -0.20 -0.84 -0.31 -1.29 0.00 0.00 177.43 174.94 2kzz s TYR 330 N -6.14 2.11 0.31 1.19 2.02 -1.26 -4.75 117.35 110.84 2kzz s TYR 330 Ca -0.14 -0.40 -0.08 0.00 -0.37 0.00 0.00 57.07 56.08 2kzz s TYR 330 Cb 0.10 -1.11 -0.06 0.00 -0.40 0.00 0.00 41.96 40.49 2kzz s TYR 330 CO 0.67 0.35 0.63 0.54 -1.57 0.00 0.00 175.55 176.17 2kzz s VAL 331 N -1.37 4.91 -0.30 0.71 0.11 -1.20 -4.94 120.40 118.31 2kzz s VAL 331 Ca 0.14 0.37 -0.00 0.00 -2.93 0.00 0.00 61.98 59.56 2kzz s VAL 331 Cb -0.09 -3.70 0.06 0.00 -1.53 0.00 0.00 36.38 31.12 2kzz s VAL 331 CO 0.07 -0.32 -0.00 -0.89 -3.33 0.00 0.00 175.10 170.62 2kzz s THR 332 N -2.11 2.76 -0.41 5.04 2.01 -1.26 -1.27 115.64 120.40 2kzz s THR 332 Ca 0.47 -1.59 -0.28 0.00 0.31 0.00 0.00 61.69 60.61 2kzz s THR 332 Cb -0.11 -2.66 0.02 0.00 0.01 0.00 0.00 72.50 69.76 2kzz s THR 332 CO 0.28 -0.18 1.04 -0.63 -0.69 0.00 0.00 174.62 174.43 2kzz s ILE 333 N 1.18 4.41 -0.47 1.82 1.01 -0.40 -4.88 121.20 123.87 2kzz s ILE 333 Ca -0.04 1.27 0.05 0.00 0.00 0.00 0.00 60.65 61.93 2kzz s ILE 333 Cb -0.20 -4.47 0.10 0.00 0.01 0.00 0.00 42.46 37.90 2kzz s ILE 333 CO -0.03 -0.75 0.96 0.18 0.00 0.00 0.00 174.94 175.30 2kzz n LEU 334 N 7.26 2.07 -3.86 2.97 4.32 -1.26 -4.16 117.00 124.34 2kzz n LEU 334 Ca 0.10 -1.66 -0.12 0.00 -0.02 0.00 0.00 56.01 54.31 2kzz n LEU 334 Cb 0.48 -0.07 -0.12 0.00 -1.62 0.00 0.00 43.42 42.10 2kzz n LEU 334 CO 0.64 0.50 -0.23 1.51 -1.22 0.00 0.00 177.39 178.59 2kzz s ASP 335 N -0.80 -0.03 0.23 -1.43 1.47 -1.26 -4.32 116.67 110.53 2kzz s ASP 335 Ca 0.09 0.00 -0.06 0.00 1.18 0.00 0.00 52.55 53.75 2kzz s ASP 335 Cb 0.05 0.21 0.38 0.00 -0.34 0.00 0.00 42.92 43.22 2kzz s ASP 335 CO 0.07 -0.18 1.73 -0.33 0.68 0.00 0.00 175.17 177.14 2kzz h GLU 336 N 5.28 0.41 -0.89 2.11 5.08 -1.99 -2.15 114.58 122.43 2kzz h GLU 336 Ca -0.28 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.15 2kzz h GLU 336 Cb 1.20 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.28 2kzz h GLU 336 CO 0.42 0.27 0.53 1.49 -1.00 0.00 0.00 179.01 180.73 2kzz h GLU 337 N 0.42 0.87 -0.12 2.33 4.81 -1.99 0.97 114.58 121.87 2kzz h GLU 337 Ca 0.37 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 59.36 2kzz h GLU 337 Cb 0.52 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 2kzz h GLU 337 CO -0.37 0.58 -0.68 1.15 -0.73 0.00 0.00 179.01 178.96 2kzz h THR 338 N 0.90 1.34 -0.03 0.32 2.02 -1.84 -2.21 112.91 113.41 2kzz h THR 338 Ca 0.42 -2.00 -0.00 0.00 0.77 0.00 0.00 66.41 65.60 2kzz h THR 338 Cb 0.35 1.98 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 2kzz h THR 338 CO -0.24 0.61 0.01 0.25 0.37 0.00 0.00 175.52 176.53 2kzz h LEU 339 N 0.36 0.05 -1.79 2.58 6.46 -0.93 -0.66 115.31 121.38 2kzz h LEU 339 Ca -0.02 -0.21 0.01 0.00 -0.12 0.00 0.00 57.88 57.54 2kzz h LEU 339 Cb 1.25 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 41.16 2kzz h LEU 339 CO 0.12 0.25 0.16 0.11 -0.62 0.00 0.00 178.44 178.46 2kzz h LYS 340 N -0.15 0.27 -0.22 1.25 1.57 -0.82 0.32 116.57 118.78 2kzz h LYS 340 Ca 0.01 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2kzz h LYS 340 Cb 0.22 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2kzz h LYS 340 CO -0.00 0.18 0.02 0.00 -0.57 0.00 0.00 179.45 179.07 2kzz h ALA 341 N 1.85 0.30 -0.63 3.86 0.00 -0.88 -1.47 119.26 122.30 2kzz h ALA 341 Ca 0.10 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2kzz h ALA 341 Cb 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2kzz h ALA 341 CO -0.02 0.01 0.12 -1.49 0.00 0.00 0.00 179.25 177.86 2kzz h TRP 342 N 0.17 1.10 -0.91 0.00 4.06 -0.03 -2.26 115.95 118.08 2kzz h TRP 342 Ca 0.07 -0.15 0.05 0.00 2.06 0.00 0.00 58.89 60.92 2kzz h TRP 342 Cb 0.37 -0.30 -0.06 0.00 -1.00 0.00 0.00 29.16 28.17 2kzz h TRP 342 CO 0.03 0.93 0.58 0.82 -3.56 0.00 0.00 178.44 177.23 2kzz h ILE 343 N 0.95 1.08 -0.38 1.49 2.04 -0.19 0.15 117.51 122.65 2kzz h ILE 343 Ca 0.19 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 2kzz h ILE 343 Cb 0.41 -0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 2kzz h ILE 343 CO 0.01 0.19 0.17 0.00 0.00 0.00 0.00 178.15 178.53 2kzz h ALA 344 N 1.41 0.49 -0.60 1.87 0.00 -0.93 -1.42 119.26 120.08 2kzz h ALA 344 Ca 0.38 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2kzz h ALA 344 Cb 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2kzz h ALA 344 CO -0.16 0.07 0.23 0.87 0.00 0.00 0.00 179.25 180.26 2kzz h LYS 345 N 0.47 0.91 -1.00 0.00 1.57 -0.78 -2.81 116.57 114.93 2kzz h LYS 345 Ca 0.13 -0.17 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 2kzz h LYS 345 Cb 0.14 -0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.24 2kzz h LYS 345 CO -0.01 0.78 0.65 -0.07 -0.57 0.00 0.00 179.45 180.23 2kzz h LEU 346 N 0.84 1.04 -2.33 2.94 4.07 -0.37 -1.93 115.31 119.56 2kzz h LEU 346 Ca 0.20 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.17 2kzz h LEU 346 Cb 0.22 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.75 2kzz h LEU 346 CO -0.01 0.66 0.00 -0.33 -1.08 0.00 0.00 178.44 177.67 2kzz h GLU 347 N 1.17 0.00 -0.01 1.13 5.08 -0.99 -2.71 114.58 118.25 2kzz h GLU 347 Ca 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 2kzz h GLU 347 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2kzz h GLU 347 CO -0.18 0.00 -0.01 0.36 -1.00 0.00 0.00 179.01 178.19 2kzz n LYS 348 N -3.02 0.27 -2.35 2.33 2.85 -0.76 -4.99 118.16 112.49 2kzz n LYS 348 Ca -0.02 -0.98 -0.40 0.00 -1.05 0.00 0.00 58.31 55.86 2kzz n LYS 348 Cb 0.15 -1.16 -0.03 0.00 -0.65 0.00 0.00 35.03 33.34 2kzz n LYS 348 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2kzz s ALA 349 N -0.73 3.40 0.33 0.58 0.00 -1.00 -4.93 121.76 119.41 2kzz s ALA 349 Ca 0.10 1.01 0.01 0.00 0.00 0.00 0.00 51.96 53.08 2kzz s ALA 349 Cb 0.07 -3.37 0.57 0.00 0.00 0.00 0.00 23.12 20.38 2kzz s ALA 349 CO 0.11 -0.34 1.95 -1.00 0.00 0.00 0.00 175.76 176.48 2kzz h PRO 350 N 3.55 0.81 -2.08 0.00 0.13 -1.93 -3.45 132.00 129.04 2kzz h PRO 350 Ca -0.48 -0.09 -0.06 0.00 -0.87 0.00 0.00 66.00 64.51 2kzz h PRO 350 Cb 1.22 -0.16 -0.20 0.00 0.13 0.00 0.00 31.00 31.99 2kzz h PRO 350 CO 0.66 0.61 0.13 0.14 -0.23 0.00 0.00 178.00 179.31 2kzz s VAL 351 N -5.53 0.00 0.03 1.56 -7.23 -1.26 -4.55 120.40 103.42 2kzz s VAL 351 Ca -0.10 -0.03 0.01 0.00 -1.81 0.00 0.00 61.98 60.06 2kzz s VAL 351 Cb 0.17 -0.96 -0.02 0.00 0.56 0.00 0.00 36.38 36.13 2kzz s VAL 351 CO 0.77 -0.01 -0.05 0.72 -0.31 0.00 0.00 175.10 176.22 2kzz s PHE 352 N -0.64 0.42 0.12 2.82 -0.12 -0.40 -4.91 117.98 115.27 2kzz s PHE 352 Ca -0.07 -0.45 -0.23 0.00 -0.05 0.00 0.00 56.93 56.13 2kzz s PHE 352 Cb -0.02 -0.27 -0.07 0.00 -0.63 0.00 0.00 43.02 42.03 2kzz s PHE 352 CO 0.06 -0.12 0.68 0.00 -0.05 0.00 0.00 175.22 175.80 2kzz s ALA 353 N -1.23 3.51 0.01 1.99 0.00 -0.78 -0.11 121.76 125.15 2kzz s ALA 353 Ca -0.11 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.07 2kzz s ALA 353 Cb -0.09 -2.82 -0.01 0.00 0.00 0.00 0.00 23.12 20.21 2kzz s ALA 353 CO -0.00 0.32 -0.04 0.12 0.00 0.00 0.00 175.76 176.16 2kzz s PHE 354 N -1.05 0.31 0.06 0.00 5.36 -0.21 -1.87 117.98 120.59 2kzz s PHE 354 Ca 0.33 -0.24 -0.09 0.00 -0.96 0.00 0.00 56.93 55.97 2kzz s PHE 354 Cb -0.21 -0.20 0.00 0.00 -0.34 0.00 0.00 43.02 42.27 2kzz s PHE 354 CO 0.23 -0.06 0.19 0.34 -1.46 0.00 0.00 175.22 174.46 2kzz s ASP 355 N -0.66 0.08 0.04 6.13 2.15 -0.15 -4.59 116.67 119.67 2kzz s ASP 355 Ca -0.05 -0.50 0.06 0.00 0.43 0.00 0.00 52.55 52.49 2kzz s ASP 355 Cb -0.05 0.31 -0.02 0.00 -0.30 0.00 0.00 42.92 42.86 2kzz s ASP 355 CO -0.00 -0.63 -0.17 0.42 -0.17 0.00 0.00 175.17 174.61 2kzz s THR 356 N -3.14 1.39 -0.03 1.71 -4.23 -1.26 -1.48 115.64 108.60 2kzz s THR 356 Ca -0.01 -1.11 0.07 0.00 -1.18 0.00 0.00 61.69 59.46 2kzz s THR 356 Cb 0.02 -1.23 -0.02 0.00 1.34 0.00 0.00 72.50 72.60 2kzz s THR 356 CO -0.07 0.10 -0.23 -1.61 -0.54 0.00 0.00 174.62 172.27 2kzz s GLU 357 N -1.18 2.24 0.34 3.99 0.41 -0.22 -4.98 118.70 119.30 2kzz s GLU 357 Ca 0.04 -0.87 0.03 0.00 -0.41 0.00 0.00 54.97 53.76 2kzz s GLU 357 Cb -0.08 -2.13 -0.04 0.00 -1.78 0.00 0.00 34.13 30.09 2kzz s GLU 357 CO 0.02 0.56 0.10 0.95 -0.49 0.00 0.00 175.26 176.40 2kzz s THR 358 N -0.59 0.75 -2.50 3.63 -4.23 -1.26 -0.89 115.64 110.54 2kzz s THR 358 Ca 0.09 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.88 2kzz s THR 358 Cb -0.10 -2.57 0.54 0.00 1.34 0.00 0.00 72.50 71.71 2kzz s THR 358 CO -0.00 0.00 1.72 -0.90 -0.54 0.00 0.00 174.62 174.90 2kzz n ASP 359 N -0.91 1.54 -3.52 3.99 5.68 -0.51 -4.12 116.55 118.71 2kzz n ASP 359 Ca -0.03 -1.52 -0.16 0.00 -0.50 0.00 0.00 54.79 52.58 2kzz n ASP 359 Cb 0.66 -0.01 -0.05 0.00 -1.14 0.00 0.00 41.12 40.58 2kzz n ASP 359 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 2kzz s SER 360 N -1.98 -0.59 0.34 -1.12 0.15 -1.26 -4.67 113.70 104.57 2kzz s SER 360 Ca 0.38 0.46 0.16 0.00 0.70 0.00 0.00 55.95 57.64 2kzz s SER 360 Cb 0.21 0.53 0.57 0.00 -1.71 0.00 0.00 66.02 65.62 2kzz s SER 360 CO 0.33 -0.69 1.69 -0.07 1.20 0.00 0.00 173.24 175.70 2kzz h LEU 361 N 2.80 0.00 -8.88 3.45 3.38 -2.00 -3.43 115.31 110.64 2kzz h LEU 361 Ca -0.29 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.10 2kzz h LEU 361 Cb 1.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 2kzz h LEU 361 CO 0.39 0.46 1.32 -0.62 0.09 0.00 0.00 178.44 180.08 2kzz s ASP 362 N -6.59 5.78 0.13 -0.43 2.15 -1.26 -4.89 116.67 111.55 2kzz s ASP 362 Ca -0.00 1.39 -0.20 0.00 0.43 0.00 0.00 52.55 54.16 2kzz s ASP 362 Cb 0.12 -2.52 -0.02 0.00 -0.30 0.00 0.00 42.92 40.19 2kzz s ASP 362 CO 0.71 -1.79 1.69 -1.13 -0.17 0.00 0.00 175.17 174.49 2kzz h ASN 363 N 13.42 -0.27 0.44 -0.34 -1.24 -1.96 0.19 115.58 125.83 2kzz h ASN 363 Ca -0.35 0.07 -0.06 0.00 0.71 0.00 0.00 56.30 56.67 2kzz h ASN 363 Cb 1.18 0.16 -0.01 0.00 0.73 0.00 0.00 38.32 40.38 2kzz h ASN 363 CO 1.02 -0.11 -0.29 -0.29 -1.29 0.00 0.00 177.43 176.48 2kzz h ILE 364 N -0.05 1.00 -0.01 2.57 6.09 -1.94 -3.24 117.51 121.92 2kzz h ILE 364 Ca 0.10 -1.07 0.00 0.00 -1.37 0.00 0.00 64.86 62.52 2kzz h ILE 364 Cb 0.20 1.61 0.00 0.00 0.47 0.00 0.00 36.82 39.11 2kzz h ILE 364 CO -0.22 0.28 -0.19 -1.54 -3.07 0.00 0.00 178.15 173.41 2kzz n SER 365 N -3.89 1.60 -4.77 2.19 3.41 -1.00 -5.00 113.62 106.16 2kzz n SER 365 Ca -0.02 -1.30 -0.36 0.00 -0.26 0.00 0.00 58.87 56.94 2kzz n SER 365 Cb 0.37 0.34 0.01 0.00 -0.26 0.00 0.00 64.21 64.67 2kzz n SER 365 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kzz s ALA 366 N -1.48 2.76 -0.10 7.33 0.00 0.63 -4.96 121.76 125.94 2kzz s ALA 366 Ca 0.12 0.93 -0.00 0.00 0.00 0.00 0.00 51.96 53.01 2kzz s ALA 366 Cb 0.11 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 2kzz s ALA 366 CO 0.28 -0.86 -0.08 -0.80 0.00 0.00 0.00 175.76 174.31 2kzz s ASN 367 N -1.55 4.54 -0.01 0.00 0.01 -1.26 -4.94 114.94 111.73 2kzz s ASN 367 Ca 0.71 -0.10 -0.30 0.00 -0.71 0.00 0.00 52.86 52.45 2kzz s ASN 367 Cb -0.28 -1.35 -0.05 0.00 0.41 0.00 0.00 41.25 39.98 2kzz s ASN 367 CO 0.32 0.29 1.42 -0.22 -1.51 0.00 0.00 177.10 177.40 2kzz s LEU 368 N -0.36 4.31 -0.07 0.60 2.96 -1.26 -1.42 118.68 123.43 2kzz s LEU 368 Ca 0.05 2.12 0.19 0.00 -0.22 0.00 0.00 54.13 56.26 2kzz s LEU 368 Cb -0.12 -3.56 -0.28 0.00 0.50 0.00 0.00 46.19 42.73 2kzz s LEU 368 CO 0.02 -0.74 0.32 0.52 -1.32 0.00 0.00 176.35 175.15 2kzz n VAL 369 N 4.75 0.38 0.00 1.68 0.31 -0.07 -4.51 118.33 120.88 2kzz n VAL 369 Ca 0.14 -0.55 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 2kzz n VAL 369 Cb 0.43 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 33.24 2kzz n VAL 369 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kzz n GLY 370 N 1.53 0.34 3.12 2.92 0.00 -1.11 -0.63 105.19 111.36 2kzz n GLY 370 Ca -0.12 -0.87 -0.16 0.00 0.00 0.00 0.00 46.02 44.87 2kzz n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kzz s LEU 371 N 0.00 2.26 0.06 0.99 1.02 -0.48 -1.06 118.68 121.47 2kzz s LEU 371 Ca 0.00 -0.58 0.05 0.00 0.02 0.00 0.00 54.13 53.63 2kzz s LEU 371 Cb 0.00 -0.38 -0.03 0.00 0.02 0.00 0.00 46.19 45.80 2kzz s LEU 371 CO 0.00 -0.12 -0.15 -0.94 0.02 0.00 0.00 176.35 175.16 2kzz s SER 372 N -1.63 1.81 0.07 2.29 1.04 -0.55 0.40 113.70 117.13 2kzz s SER 372 Ca -0.05 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.81 2kzz s SER 372 Cb -0.10 -0.08 -0.04 0.00 0.10 0.00 0.00 66.02 65.90 2kzz s SER 372 CO 0.01 -0.02 -0.04 -0.36 0.98 0.00 0.00 173.24 173.81 2kzz s PHE 373 N -1.10 0.67 -0.17 5.02 0.40 -0.61 -0.98 117.98 121.20 2kzz s PHE 373 Ca 0.01 -0.99 -0.05 0.00 -0.60 0.00 0.00 56.93 55.29 2kzz s PHE 373 Cb -0.09 -0.44 0.08 0.00 0.51 0.00 0.00 43.02 43.08 2kzz s PHE 373 CO 0.02 -0.28 0.33 0.00 0.70 0.00 0.00 175.22 175.99 2kzz s ALA 374 N -3.74 -0.81 -0.70 5.36 0.00 -0.78 -0.49 121.76 120.60 2kzz s ALA 374 Ca 0.08 1.07 0.23 0.00 0.00 0.00 0.00 51.96 53.34 2kzz s ALA 374 Cb 0.06 -1.23 0.12 0.00 0.00 0.00 0.00 23.12 22.07 2kzz s ALA 374 CO -0.08 -0.81 1.10 0.44 0.00 0.00 0.00 175.76 176.41 2kzz n ILE 375 N 5.36 0.15 -3.56 0.00 -5.35 -0.94 -1.87 119.36 113.15 2kzz n ILE 375 Ca -0.06 -0.19 -0.11 0.00 -0.27 0.00 0.00 62.75 62.11 2kzz n ILE 375 Cb 0.50 0.24 -0.05 0.00 -1.74 0.00 0.00 39.64 38.59 2kzz n ILE 375 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2kzz s GLU 376 N -3.15 0.67 0.00 6.28 2.12 -1.23 -4.94 118.70 118.45 2kzz s GLU 376 Ca 0.05 0.11 -0.35 0.00 0.36 0.00 0.00 54.97 55.15 2kzz s GLU 376 Cb 0.15 0.31 -0.13 0.00 0.26 0.00 0.00 34.13 34.72 2kzz s GLU 376 CO 0.78 -0.22 1.72 -2.30 -0.54 0.00 0.00 175.26 174.71 2kzz n PRO 377 N 0.64 2.02 0.00 4.30 -0.02 -1.26 -0.39 135.00 140.30 2kzz n PRO 377 Ca -0.11 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2kzz n PRO 377 Cb 0.58 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2kzz n PRO 377 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kzz n GLY 378 N 3.88 2.06 3.11 -1.23 0.00 -1.26 -4.99 105.19 106.77 2kzz n GLY 378 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 2kzz n GLY 378 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kzz s VAL 379 N -2.33 3.59 0.05 1.61 1.01 0.48 -4.86 120.40 119.94 2kzz s VAL 379 Ca 0.00 -2.55 -0.04 0.00 0.00 0.00 0.00 61.98 59.39 2kzz s VAL 379 Cb 0.00 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 2kzz s VAL 379 CO 0.00 -0.80 0.06 0.00 0.00 0.00 0.00 175.10 174.35 2kzz s ALA 380 N 0.47 0.13 0.05 5.51 0.00 -1.26 -2.21 121.76 124.45 2kzz s ALA 380 Ca 0.13 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2kzz s ALA 380 Cb -0.21 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 2kzz s ALA 380 CO -0.04 -0.35 -0.07 0.00 0.00 0.00 0.00 175.76 175.31 2kzz s ALA 381 N -3.17 0.61 -0.16 0.00 0.00 0.35 -3.25 121.76 116.14 2kzz s ALA 381 Ca -0.00 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 2kzz s ALA 381 Cb 0.02 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 2kzz s ALA 381 CO -0.07 -0.12 -0.12 -0.47 0.00 0.00 0.00 175.76 174.98 2kzz s TYR 382 N -2.16 2.84 -0.58 0.00 5.04 -0.40 -1.58 117.35 120.53 2kzz s TYR 382 Ca -0.04 -0.88 -0.07 0.00 -2.44 0.00 0.00 57.07 53.64 2kzz s TYR 382 Cb -0.05 -1.93 0.15 0.00 0.35 0.00 0.00 41.96 40.48 2kzz s TYR 382 CO -0.02 -0.40 0.43 0.42 -1.34 0.00 0.00 175.55 174.64 2kzz s ILE 383 N 0.82 4.13 0.08 3.14 1.01 0.16 -1.27 121.20 129.27 2kzz s ILE 383 Ca -0.04 -2.38 -0.30 0.00 0.00 0.00 0.00 60.65 57.93 2kzz s ILE 383 Cb -0.15 -3.69 -0.06 0.00 0.01 0.00 0.00 42.46 38.58 2kzz s ILE 383 CO 0.01 -0.85 1.13 -2.84 0.00 0.00 0.00 174.94 172.39 2kzz s PRO 384 N 0.59 4.50 0.00 2.79 0.02 -1.26 -1.39 135.00 140.26 2kzz s PRO 384 Ca 0.12 1.68 0.00 0.00 0.02 0.00 0.00 61.00 62.82 2kzz s PRO 384 Cb -0.21 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 30.96 2kzz s PRO 384 CO -0.04 -0.12 0.00 1.33 -0.33 0.00 0.00 177.00 177.84 2kzz n VAL 385 N 3.51 0.00 -2.50 3.83 0.24 0.20 -3.90 118.33 119.71 2kzz n VAL 385 Ca 0.07 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.25 2kzz n VAL 385 Cb 0.47 -0.65 0.03 0.00 -1.47 0.00 0.00 33.84 32.23 2kzz n VAL 385 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kzz n ALA 386 N -1.78 3.74 -2.29 2.33 0.00 -0.01 -4.01 120.51 118.50 2kzz n ALA 386 Ca 0.00 -3.29 -0.40 0.00 0.00 0.00 0.00 53.44 49.75 2kzz n ALA 386 Cb 0.37 -0.66 -0.05 0.00 0.00 0.00 0.00 19.45 19.11 2kzz n ALA 386 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2kzz s HIS 387 N -3.64 3.78 -0.03 0.00 3.76 -1.26 -4.76 115.29 113.15 2kzz s HIS 387 Ca 0.37 1.54 0.09 0.00 -0.15 0.00 0.00 55.06 56.91 2kzz s HIS 387 Cb 0.37 -2.82 0.16 0.00 1.11 0.00 0.00 32.58 31.40 2kzz s HIS 387 CO -0.02 0.33 1.07 -0.40 -0.85 0.00 0.00 174.74 174.88 2kzz n ASP 388 N 2.50 0.64 -4.46 1.40 5.68 -0.67 -4.86 116.55 116.78 2kzz n ASP 388 Ca -0.03 -2.25 -0.28 0.00 -0.50 0.00 0.00 54.79 51.73 2kzz n ASP 388 Cb 0.50 -0.27 0.25 0.00 -1.14 0.00 0.00 41.12 40.46 2kzz n ASP 388 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 2kzz s TYR 389 N -0.56 1.34 0.08 2.11 -0.85 -1.23 -4.83 117.35 113.42 2kzz s TYR 389 Ca 0.14 1.09 -0.32 0.00 -0.52 0.00 0.00 57.07 57.47 2kzz s TYR 389 Cb 0.15 -3.10 -0.11 0.00 0.38 0.00 0.00 41.96 39.27 2kzz s TYR 389 CO -0.04 -3.89 1.83 -0.11 -1.52 0.00 0.00 175.55 171.82 2kzz n LEU 390 N -4.92 3.83 -1.13 -3.49 -0.00 -1.26 -1.90 117.00 108.13 2kzz n LEU 390 Ca 0.03 0.99 -0.13 0.00 -0.00 0.00 0.00 56.01 56.90 2kzz n LEU 390 Cb 0.55 -1.50 -0.05 0.00 -0.00 0.00 0.00 43.42 42.42 2kzz n LEU 390 CO 0.57 0.08 -0.14 0.47 -0.00 0.00 0.00 177.39 178.38 2kzz n ASP 391 N 5.69 -4.52 -4.68 1.96 8.00 -1.26 -4.97 116.55 116.76 2kzz n ASP 391 Ca 0.19 0.26 -0.45 0.00 0.71 0.00 0.00 54.79 55.50 2kzz n ASP 391 Cb 0.35 -3.31 -0.04 0.00 -0.02 0.00 0.00 41.12 38.11 2kzz n ASP 391 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kzz n ALA 392 N 0.67 1.61 -1.06 2.24 0.00 -0.80 -4.91 120.51 118.26 2kzz n ALA 392 Ca -0.14 0.38 -0.34 0.00 0.00 0.00 0.00 53.44 53.34 2kzz n ALA 392 Cb 0.48 -2.45 0.11 0.00 0.00 0.00 0.00 19.45 17.58 2kzz n ALA 392 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2kzz n PRO 393 N 4.57 0.07 -1.73 0.00 -0.02 -1.26 -4.90 135.00 131.72 2kzz n PRO 393 Ca 0.18 0.08 -0.42 0.00 -2.02 0.00 0.00 63.50 61.32 2kzz n PRO 393 Cb 0.31 -2.05 -0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2kzz n PRO 393 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2kzz n ASP 394 N -1.64 3.20 -4.21 2.55 8.00 -1.26 -5.00 116.55 118.18 2kzz n ASP 394 Ca 0.10 1.21 -0.12 0.00 0.71 0.00 0.00 54.79 56.69 2kzz n ASP 394 Cb 0.51 -1.54 -0.10 0.00 -0.02 0.00 0.00 41.12 39.97 2kzz n ASP 394 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2kzz s GLN 395 N -1.90 1.00 0.24 -1.24 -0.21 -1.26 -4.94 119.66 111.34 2kzz s GLN 395 Ca 0.55 -1.45 -0.30 0.00 0.02 0.00 0.00 55.36 54.18 2kzz s GLN 395 Cb -0.53 -0.26 -0.09 0.00 1.00 0.00 0.00 33.01 33.13 2kzz s GLN 395 CO 0.62 -0.08 1.33 0.42 -2.12 0.00 0.00 175.29 175.47 2kzz s ILE 396 N -3.63 3.01 0.55 1.08 1.01 -1.25 -4.95 121.20 117.02 2kzz s ILE 396 Ca 0.19 0.87 -0.21 0.00 0.00 0.00 0.00 60.65 61.50 2kzz s ILE 396 Cb 0.06 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.93 2kzz s ILE 396 CO 0.00 0.15 1.26 -0.94 0.00 0.00 0.00 174.94 175.41 2kzz s SER 397 N 0.16 5.38 0.24 3.58 1.04 -1.26 -4.32 113.70 118.52 2kzz s SER 397 Ca 0.56 2.52 -0.05 0.00 0.48 0.00 0.00 55.95 59.46 2kzz s SER 397 Cb -0.38 -2.61 0.38 0.00 0.10 0.00 0.00 66.02 63.50 2kzz s SER 397 CO 0.42 -1.48 1.82 -0.09 0.98 0.00 0.00 173.24 174.89 2kzz h ARG 398 N 1.31 0.79 -0.60 4.02 2.43 -1.93 0.20 114.38 120.60 2kzz h ARG 398 Ca -0.50 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 58.54 2kzz h ARG 398 Cb 1.29 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 2kzz h ARG 398 CO 0.57 0.52 0.05 0.93 -1.51 0.00 0.00 179.97 180.53 2kzz h GLU 399 N 0.81 1.01 -0.14 0.20 4.39 -1.95 -1.68 114.58 117.22 2kzz h GLU 399 Ca 0.39 -0.28 -0.23 0.00 0.34 0.00 0.00 59.36 59.58 2kzz h GLU 399 Cb 0.32 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2kzz h GLU 399 CO -0.23 0.96 -0.80 -0.09 -1.16 0.00 0.00 179.01 177.69 2kzz h ARG 400 N 0.93 0.78 -0.47 2.33 9.65 -1.78 -2.50 114.38 123.32 2kzz h ARG 400 Ca 0.18 -0.65 -0.06 0.00 -1.10 0.00 0.00 59.98 58.35 2kzz h ARG 400 Cb 0.47 0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 29.17 2kzz h ARG 400 CO 0.02 1.25 0.04 0.00 2.80 0.00 0.00 179.97 184.08 2kzz h ALA 401 N 0.56 1.19 -0.03 2.80 0.00 -0.90 -2.52 119.26 120.36 2kzz h ALA 401 Ca -0.06 -0.23 -0.22 0.00 0.00 0.00 0.00 54.91 54.40 2kzz h ALA 401 Cb 1.43 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2kzz h ALA 401 CO 0.16 0.54 -0.90 -0.07 0.00 0.00 0.00 179.25 178.99 2kzz h LEU 402 N 0.71 0.58 -0.80 0.00 3.38 -1.32 -1.41 115.31 116.46 2kzz h LEU 402 Ca 0.15 -0.44 -0.12 0.00 0.09 0.00 0.00 57.88 57.56 2kzz h LEU 402 Cb 0.38 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2kzz h LEU 402 CO 0.01 1.23 -0.44 1.05 0.09 0.00 0.00 178.44 180.38 2kzz h GLU 403 N 0.27 0.35 0.01 1.13 4.11 -1.33 0.27 114.58 119.40 2kzz h GLU 403 Ca -0.07 -0.18 -0.19 0.00 0.07 0.00 0.00 59.36 58.99 2kzz h GLU 403 Cb 1.52 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.75 2kzz h GLU 403 CO 0.16 0.73 -0.88 -0.07 0.07 0.00 0.00 179.01 179.02 2kzz h LEU 404 N 0.29 0.08 0.00 3.06 3.38 -1.45 -3.28 115.31 117.38 2kzz h LEU 404 Ca 0.02 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2kzz h LEU 404 Cb 0.89 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 2kzz h LEU 404 CO 0.07 0.91 -0.84 -0.07 0.09 0.00 0.00 178.44 178.60 2kzz h LEU 405 N 0.03 0.00 -0.46 1.67 4.07 -1.06 -3.40 115.31 116.15 2kzz h LEU 405 Ca -0.02 0.00 0.09 0.00 0.08 0.00 0.00 57.88 58.03 2kzz h LEU 405 Cb 1.53 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 43.18 2kzz h LEU 405 CO 0.12 0.17 -0.15 0.50 -1.08 0.00 0.00 178.44 178.00 2kzz h LYS 406 N 0.00 -0.04 -0.60 1.13 3.64 -0.52 -1.44 116.57 118.74 2kzz h LYS 406 Ca -0.03 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.45 2kzz h LYS 406 Cb 1.16 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.91 2kzz h LYS 406 CO 0.02 -0.03 0.21 -1.35 -2.27 0.00 0.00 179.45 176.03 2kzz h PRO 407 N -0.04 0.37 -0.19 1.90 0.11 -1.78 -0.14 132.00 132.23 2kzz h PRO 407 Ca 0.22 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.30 2kzz h PRO 407 Cb 0.38 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 2kzz h PRO 407 CO -0.50 0.24 0.07 1.25 -0.21 0.00 0.00 178.00 178.85 2kzz h LEU 408 N 0.38 0.26 -0.93 2.35 5.85 -1.75 -2.23 115.31 119.24 2kzz h LEU 408 Ca 0.31 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2kzz h LEU 408 Cb 0.39 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2kzz h LEU 408 CO -0.32 0.38 0.34 -0.07 -0.34 0.00 0.00 178.44 178.43 2kzz h LEU 409 N 0.14 1.01 -0.62 2.25 4.07 -0.82 -2.75 115.31 118.59 2kzz h LEU 409 Ca 0.06 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.89 2kzz h LEU 409 Cb 0.20 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.68 2kzz h LEU 409 CO -0.00 0.87 0.00 -0.62 -1.08 0.00 0.00 178.44 177.61 2kzz n GLU 410 N -4.30 1.43 -2.74 1.13 1.02 -0.11 -1.89 120.64 115.18 2kzz n GLU 410 Ca 0.07 -0.62 -0.43 0.00 -0.02 0.00 0.00 57.16 56.16 2kzz n GLU 410 Cb 0.16 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.08 2kzz n GLU 410 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2kzz s ASP 411 N -1.91 6.55 0.58 1.62 2.15 -0.85 -4.58 116.67 120.23 2kzz s ASP 411 Ca 0.40 0.25 0.33 0.00 0.43 0.00 0.00 52.55 53.95 2kzz s ASP 411 Cb 0.20 -2.49 1.82 0.00 -0.30 0.00 0.00 42.92 42.15 2kzz s ASP 411 CO 0.33 -1.13 2.21 1.05 -0.17 0.00 0.00 175.17 177.46 2kzz h GLU 412 N 9.13 0.00 0.01 4.34 4.11 -1.86 -1.97 114.58 128.35 2kzz h GLU 412 Ca -0.24 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 58.99 2kzz h GLU 412 Cb 1.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 2kzz h GLU 412 CO 1.07 0.04 -0.92 0.87 0.07 0.00 0.00 179.01 180.14 2kzz h LYS 413 N 0.00 0.16 -6.39 1.06 1.79 -1.92 -3.36 116.57 107.91 2kzz h LYS 413 Ca -0.00 -0.19 -0.54 0.00 -2.18 0.00 0.00 60.65 57.74 2kzz h LYS 413 Cb 0.15 0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 30.79 2kzz h LYS 413 CO 0.01 0.97 1.09 0.00 -1.08 0.00 0.00 179.45 180.43 2kzz s ALA 414 N -3.10 2.78 -0.14 3.86 0.00 -0.74 -4.98 121.76 119.45 2kzz s ALA 414 Ca -0.02 -0.85 -0.29 0.00 0.00 0.00 0.00 51.96 50.79 2kzz s ALA 414 Cb 0.10 -4.14 -0.01 0.00 0.00 0.00 0.00 23.12 19.07 2kzz s ALA 414 CO 0.83 -3.04 1.13 -0.51 0.00 0.00 0.00 175.76 174.17 2kzz s LEU 415 N 6.01 4.20 0.07 0.00 1.43 -1.26 -4.57 118.68 124.56 2kzz s LEU 415 Ca 0.48 1.60 0.03 0.00 -1.03 0.00 0.00 54.13 55.22 2kzz s LEU 415 Cb -0.10 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.54 2kzz s LEU 415 CO 0.22 -0.62 0.05 -0.54 0.23 0.00 0.00 176.35 175.70 2kzz s LYS 416 N 2.74 2.79 0.05 1.70 3.01 -0.75 -1.28 119.74 128.00 2kzz s LYS 416 Ca 0.51 -0.71 0.09 0.00 -1.01 0.00 0.00 55.97 54.84 2kzz s LYS 416 Cb -0.20 -2.68 -0.03 0.00 -1.01 0.00 0.00 37.83 33.92 2kzz s LYS 416 CO 0.15 0.57 -0.25 0.08 0.51 0.00 0.00 175.35 176.41 2kzz s VAL 417 N -1.33 2.02 -0.02 3.17 1.01 0.85 -2.28 120.40 123.83 2kzz s VAL 417 Ca 0.27 -1.36 -0.29 0.00 0.00 0.00 0.00 61.98 60.59 2kzz s VAL 417 Cb -0.12 -1.74 0.10 0.00 0.00 0.00 0.00 36.38 34.62 2kzz s VAL 417 CO 0.20 0.31 0.95 -0.83 0.00 0.00 0.00 175.10 175.72 2kzz s GLY 418 N -1.27 -0.42 -0.36 4.51 0.00 -0.36 -1.04 107.32 108.38 2kzz s GLY 418 Ca 0.11 1.00 -0.16 0.00 0.00 0.00 0.00 44.72 45.67 2kzz s GLY 418 CO 0.02 0.33 0.39 1.62 0.00 0.00 0.00 173.10 175.46 2kzz s GLN 419 N -3.02 3.46 -0.96 2.90 2.00 -1.26 -0.51 119.66 122.26 2kzz s GLN 419 Ca 0.07 -0.48 -0.05 0.00 -2.00 0.00 0.00 55.36 52.90 2kzz s GLN 419 Cb -0.01 -3.84 -0.05 0.00 0.80 0.00 0.00 33.01 29.90 2kzz s GLN 419 CO -0.07 -0.61 0.86 -1.71 -0.50 0.00 0.00 175.29 173.25 2kzz n ASN 420 N 5.46 -6.77 0.30 6.67 5.15 -1.26 -4.87 115.26 119.94 2kzz n ASN 420 Ca -0.08 -0.57 0.20 0.00 -0.60 0.00 0.00 54.58 53.53 2kzz n ASN 420 Cb 0.49 -5.13 1.07 0.00 -0.53 0.00 0.00 39.78 35.69 2kzz n ASN 420 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2kzz h LEU 421 N -0.76 0.00 -0.38 1.20 4.07 -1.93 -2.84 115.31 114.67 2kzz h LEU 421 Ca -0.48 0.00 0.06 0.00 0.08 0.00 0.00 57.88 57.55 2kzz h LEU 421 Cb 1.24 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.93 2kzz h LEU 421 CO 0.40 0.00 0.04 0.50 -1.08 0.00 0.00 178.44 178.30 2kzz h LYS 422 N 0.00 0.15 -0.65 1.13 3.64 -1.89 0.09 116.57 119.03 2kzz h LYS 422 Ca 0.00 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2kzz h LYS 422 Cb 0.03 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 2kzz h LYS 422 CO 0.00 0.10 0.37 -0.92 -2.27 0.00 0.00 179.45 176.73 2kzz h TYR 423 N 0.15 0.88 -0.25 1.91 3.20 -1.87 -2.90 116.97 118.09 2kzz h TYR 423 Ca 0.19 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 2kzz h TYR 423 Cb 0.24 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 2kzz h TYR 423 CO -0.23 0.62 0.06 -0.44 -1.64 0.00 0.00 178.16 176.54 2kzz h ASP 424 N 0.89 0.38 -0.97 -2.11 3.32 -1.46 -2.58 116.42 113.88 2kzz h ASP 424 Ca 0.23 -0.23 0.04 0.00 0.02 0.00 0.00 57.03 57.09 2kzz h ASP 424 Cb 0.02 -0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.41 2kzz h ASP 424 CO -0.04 0.51 0.64 -0.09 -1.72 0.00 0.00 179.24 178.54 2kzz h ARG 425 N 0.23 1.19 -0.22 3.56 1.12 -0.96 -2.74 114.38 116.56 2kzz h ARG 425 Ca 0.08 -0.07 -0.01 0.00 -1.11 0.00 0.00 59.98 58.87 2kzz h ARG 425 Cb 0.28 -0.27 -0.01 0.00 -0.01 0.00 0.00 29.97 29.96 2kzz h ARG 425 CO 0.00 0.78 0.09 0.78 -3.11 0.00 0.00 179.97 178.51 2kzz h GLY 426 N 1.22 0.35 0.64 2.80 0.00 -1.36 -1.93 103.07 104.79 2kzz h GLY 426 Ca 0.39 -0.19 0.10 0.00 0.00 0.00 0.00 47.33 47.63 2kzz h GLY 426 CO -0.12 0.18 0.61 -2.22 0.00 0.00 0.00 176.54 174.99 2kzz h ILE 427 N 0.20 0.98 -0.27 2.60 1.08 -1.17 -1.21 117.51 119.72 2kzz h ILE 427 Ca 0.07 -0.34 -0.12 0.00 -0.39 0.00 0.00 64.86 64.08 2kzz h ILE 427 Cb 0.18 -0.10 -0.01 0.00 -3.07 0.00 0.00 36.82 33.81 2kzz h ILE 427 CO -0.01 0.18 -0.34 -0.07 -0.69 0.00 0.00 178.15 177.22 2kzz h LEU 428 N 0.99 0.61 -0.78 1.44 3.38 -1.24 -1.99 115.31 117.73 2kzz h LEU 428 Ca 0.45 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2kzz h LEU 428 Cb 0.38 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2kzz h LEU 428 CO -0.20 0.91 0.00 0.00 0.09 0.00 0.00 178.44 179.23 2kzz n ALA 429 N -2.50 1.41 0.42 1.53 0.00 -0.49 -0.37 120.51 120.51 2kzz n ALA 429 Ca -0.01 0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.66 2kzz n ALA 429 Cb 0.48 -1.31 0.48 0.00 0.00 0.00 0.00 19.45 19.10 2kzz n ALA 429 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2kzz h ASN 430 N 0.00 0.00 -0.09 0.00 2.35 -0.97 -3.16 115.58 113.71 2kzz h ASN 430 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2kzz h ASN 430 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2kzz h ASN 430 CO 0.00 0.00 0.00 -1.22 -1.65 0.00 0.00 177.43 174.56 2kzz n TYR 431 N -2.46 0.32 -1.41 1.19 4.01 0.50 -4.96 117.16 114.36 2kzz n TYR 431 Ca 0.03 -0.95 -0.08 0.00 -0.16 0.00 0.00 57.90 56.74 2kzz n TYR 431 Cb 0.32 -0.20 -0.03 0.00 -0.31 0.00 0.00 39.34 39.12 2kzz n TYR 431 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kzz n GLY 432 N -1.09 0.83 3.55 2.72 0.00 -1.19 -5.01 105.19 105.00 2kzz n GLY 432 Ca 0.17 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 2kzz n GLY 432 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kzz s ILE 433 N -2.32 4.28 -0.52 -0.61 1.01 -1.01 -5.01 121.20 117.03 2kzz s ILE 433 Ca 0.00 -0.22 -0.13 0.00 0.00 0.00 0.00 60.65 60.30 2kzz s ILE 433 Cb 0.00 -2.90 0.13 0.00 0.01 0.00 0.00 42.46 39.69 2kzz s ILE 433 CO 0.00 0.48 0.44 -1.61 0.00 0.00 0.00 174.94 174.25 2kzz s GLU 434 N 0.39 2.79 -0.24 2.79 0.41 -1.26 -2.96 118.70 120.61 2kzz s GLU 434 Ca -0.01 -1.76 -0.28 0.00 -0.41 0.00 0.00 54.97 52.51 2kzz s GLU 434 Cb -0.13 -4.14 -0.04 0.00 -1.78 0.00 0.00 34.13 28.03 2kzz s GLU 434 CO 0.02 -1.27 1.99 -1.17 -0.49 0.00 0.00 175.26 174.34 2kzz s LEU 435 N 1.45 3.57 0.48 1.80 0.20 -1.26 -4.19 118.68 120.73 2kzz s LEU 435 Ca 0.05 1.70 0.06 0.00 0.69 0.00 0.00 54.13 56.62 2kzz s LEU 435 Cb -0.28 -3.52 -0.00 0.00 -0.43 0.00 0.00 46.19 41.96 2kzz s LEU 435 CO 0.01 -1.74 0.27 -0.13 -0.29 0.00 0.00 176.35 174.47 2kzz s ARG 436 N 5.82 2.27 -0.81 1.98 0.52 -0.79 -4.68 118.95 123.25 2kzz s ARG 436 Ca 0.89 -1.97 -0.02 0.00 -0.52 0.00 0.00 55.73 54.11 2kzz s ARG 436 Cb -0.29 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.17 2kzz s ARG 436 CO 0.34 -0.38 0.29 0.41 0.02 0.00 0.00 175.30 175.99 2kzz n GLY 437 N -1.51 0.05 3.26 -3.53 0.00 -1.26 -4.65 105.19 97.57 2kzz n GLY 437 Ca -0.03 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 2kzz n GLY 437 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2kzz n ILE 438 N -3.90 3.71 -0.02 -0.61 5.41 -1.26 -1.80 119.36 120.88 2kzz n ILE 438 Ca -0.06 -3.65 -0.18 0.00 1.00 0.00 0.00 62.75 59.86 2kzz n ILE 438 Cb 0.57 -2.44 -0.13 0.00 -0.71 0.00 0.00 39.64 36.92 2kzz n ILE 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2kzz h ALA 439 N 7.03 0.03 -3.61 -1.39 0.00 -1.89 -3.46 119.26 115.98 2kzz h ALA 439 Ca 0.49 -0.73 -0.39 0.00 0.00 0.00 0.00 54.91 54.28 2kzz h ALA 439 Cb 0.78 0.19 -0.32 0.00 0.00 0.00 0.00 17.79 18.44 2kzz h ALA 439 CO 1.62 0.33 -0.77 -0.06 0.00 0.00 0.00 179.25 180.37 2kzz s PHE 440 N -2.34 0.66 -0.21 0.00 0.08 -0.96 -4.96 117.98 110.24 2kzz s PHE 440 Ca -0.19 -0.16 0.01 0.00 0.12 0.00 0.00 56.93 56.72 2kzz s PHE 440 Cb 0.00 -0.56 0.04 0.00 -0.57 0.00 0.00 43.02 41.94 2kzz s PHE 440 CO 0.74 -0.13 -0.12 0.34 -0.10 0.00 0.00 175.22 175.95 2kzz s ASP 441 N 0.60 3.61 0.60 1.36 -1.08 -1.25 -1.22 116.67 119.29 2kzz s ASP 441 Ca -0.08 -0.98 0.36 0.00 -0.52 0.00 0.00 52.55 51.34 2kzz s ASP 441 Cb -0.11 -1.34 1.91 0.00 -1.46 0.00 0.00 42.92 41.92 2kzz s ASP 441 CO -0.00 -0.14 2.21 0.71 0.52 0.00 0.00 175.17 178.47 2kzz h THR 442 N 6.42 0.21 -0.31 1.71 1.35 -1.16 -0.37 112.91 120.76 2kzz h THR 442 Ca -0.28 -0.23 -0.09 0.00 -0.55 0.00 0.00 66.41 65.26 2kzz h THR 442 Cb 1.09 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 68.69 2kzz h THR 442 CO 0.49 0.03 -0.14 -0.03 -0.25 0.00 0.00 175.52 175.62 2kzz h MET 443 N 0.00 0.64 0.00 4.72 -1.53 -1.80 -1.98 114.93 114.98 2kzz h MET 443 Ca -0.00 -0.28 -0.14 0.00 -3.44 0.00 0.00 59.70 55.84 2kzz h MET 443 Cb 0.18 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.19 2kzz h MET 443 CO 0.00 0.86 -0.66 -0.07 0.14 0.00 0.00 176.91 177.18 2kzz h LEU 444 N 0.40 0.00 -0.01 3.39 3.38 -1.65 -1.70 115.31 119.13 2kzz h LEU 444 Ca 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2kzz h LEU 444 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2kzz h LEU 444 CO 0.04 0.66 0.00 -0.33 0.09 0.00 0.00 178.44 178.91 2kzz h GLU 445 N 0.00 0.01 -0.06 1.13 5.08 -0.93 -1.06 114.58 118.75 2kzz h GLU 445 Ca -0.01 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2kzz h GLU 445 Cb 1.29 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2kzz h GLU 445 CO 0.09 0.10 -0.02 1.03 -1.00 0.00 0.00 179.01 179.21 2kzz h SER 446 N -0.08 -0.07 -0.85 1.42 0.87 -1.30 -1.63 113.55 111.91 2kzz h SER 446 Ca 0.00 0.02 0.06 0.00 -1.23 0.00 0.00 61.79 60.64 2kzz h SER 446 Cb 0.09 0.04 -0.06 0.00 -0.44 0.00 0.00 62.40 62.04 2kzz h SER 446 CO -0.00 -0.03 0.53 0.22 -0.53 0.00 0.00 176.83 177.02 2kzz h TYR 447 N -0.01 0.98 0.00 2.24 3.20 -1.14 -1.88 116.97 120.36 2kzz h TYR 447 Ca 0.03 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.82 2kzz h TYR 447 Cb 0.06 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 37.99 2kzz h TYR 447 CO -0.13 0.50 -0.54 0.82 -1.64 0.00 0.00 178.16 177.17 2kzz h ILE 448 N 0.97 1.08 -0.46 1.81 1.08 -0.97 -1.29 117.51 119.73 2kzz h ILE 448 Ca 0.37 -2.10 -0.12 0.00 -0.39 0.00 0.00 64.86 62.61 2kzz h ILE 448 Cb 0.15 2.25 -0.01 0.00 -3.07 0.00 0.00 36.82 36.13 2kzz h ILE 448 CO -0.17 0.53 -0.21 0.25 -0.69 0.00 0.00 178.15 177.87 2kzz h LEU 449 N 0.00 0.94 -5.47 1.44 5.85 -0.50 -3.43 115.31 114.14 2kzz h LEU 449 Ca -0.01 -0.35 0.12 0.00 0.84 0.00 0.00 57.88 58.49 2kzz h LEU 449 Cb 1.20 -0.26 -0.18 0.00 0.37 0.00 0.00 40.66 41.80 2kzz h LEU 449 CO 0.07 1.11 -0.14 0.21 -0.34 0.00 0.00 178.44 179.36 2kzz s ASN 450 N -6.73 -0.51 0.53 1.25 3.84 -0.96 -5.05 114.94 107.30 2kzz s ASN 450 Ca -0.11 -0.19 0.32 0.00 0.21 0.00 0.00 52.86 53.09 2kzz s ASN 450 Cb 0.13 0.79 1.46 0.00 -0.55 0.00 0.00 41.25 43.08 2kzz s ASN 450 CO 0.86 -0.06 1.86 0.77 -2.79 0.00 0.00 177.10 177.73 2kzz h SER 451 N 6.00 0.04 -0.54 -4.21 4.64 -1.44 -0.04 113.55 118.01 2kzz h SER 451 Ca -0.04 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2kzz h SER 451 Cb 1.22 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2kzz h SER 451 CO -0.05 0.01 0.00 1.33 -0.87 0.00 0.00 176.83 177.25 2kzz n VAL 452 N -4.28 1.52 0.19 0.95 0.24 -1.26 -4.48 118.33 111.22 2kzz n VAL 452 Ca 0.21 -1.20 0.07 0.00 -2.04 0.00 0.00 64.34 61.38 2kzz n VAL 452 Cb 1.02 0.25 0.59 0.00 -1.47 0.00 0.00 33.84 34.22 2kzz n VAL 452 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kzz h ALA 453 N 3.29 1.94 0.00 2.33 0.00 -1.37 -3.48 119.26 121.98 2kzz h ALA 453 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2kzz h ALA 453 Cb 1.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2kzz h ALA 453 CO 0.13 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.83 2kzz n GLY 454 N -1.53 -0.10 3.76 0.00 0.00 -1.26 -5.11 105.19 100.96 2kzz n GLY 454 Ca -0.01 -1.34 -0.41 0.00 0.00 0.00 0.00 46.02 44.27 2kzz n GLY 454 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kzz s ARG 455 N -2.00 4.46 -0.24 1.61 0.52 -1.26 -4.94 118.95 117.10 2kzz s ARG 455 Ca 0.00 2.04 0.13 0.00 -0.52 0.00 0.00 55.73 57.38 2kzz s ARG 455 Cb 0.00 -3.14 0.80 0.00 0.52 0.00 0.00 34.95 33.13 2kzz s ARG 455 CO 0.00 -0.06 1.73 0.72 0.02 0.00 0.00 175.30 177.71 2kzz n HIS 456 N 1.26 2.08 -2.42 -0.53 8.25 -1.26 -4.45 115.22 118.15 2kzz n HIS 456 Ca 0.01 -0.75 -0.31 0.00 -0.26 0.00 0.00 57.72 56.41 2kzz n HIS 456 Cb 0.43 -0.52 -0.02 0.00 1.12 0.00 0.00 29.99 31.00 2kzz n HIS 456 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2kzz s ASP 457 N -0.77 6.48 0.39 0.41 -4.77 -1.26 -4.55 116.67 112.60 2kzz s ASP 457 Ca 0.53 1.37 0.11 0.00 -3.30 0.00 0.00 52.55 51.26 2kzz s ASP 457 Cb 0.41 -2.43 0.90 0.00 -1.09 0.00 0.00 42.92 40.70 2kzz s ASP 457 CO 0.15 -0.60 1.93 -0.03 0.70 0.00 0.00 175.17 177.32 2kzz h MET 458 N 0.68 0.57 -0.45 2.11 1.85 -1.98 -0.02 114.93 117.70 2kzz h MET 458 Ca -0.46 -0.03 -0.14 0.00 -0.61 0.00 0.00 59.70 58.45 2kzz h MET 458 Cb 1.19 -0.13 -0.01 0.00 0.43 0.00 0.00 31.60 33.08 2kzz h MET 458 CO 0.62 0.38 -0.28 -0.44 -0.40 0.00 0.00 176.91 176.79 2kzz h ASP 459 N 0.59 1.02 -0.31 1.39 5.19 -1.97 -0.11 116.42 122.21 2kzz h ASP 459 Ca 0.36 -0.42 -0.15 0.00 -0.62 0.00 0.00 57.03 56.20 2kzz h ASP 459 Cb 0.60 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.82 2kzz h ASP 459 CO -0.13 1.22 -0.41 0.28 -3.12 0.00 0.00 179.24 177.08 2kzz h SER 460 N 0.82 0.90 0.57 6.45 0.02 -1.67 -3.04 113.55 117.61 2kzz h SER 460 Ca 0.09 -0.50 -0.03 0.00 -0.84 0.00 0.00 61.79 60.52 2kzz h SER 460 Cb 0.86 -0.26 0.01 0.00 0.14 0.00 0.00 62.40 63.15 2kzz h SER 460 CO 0.08 1.22 -0.28 -0.07 -1.14 0.00 0.00 176.83 176.64 2kzz h LEU 461 N 0.61 -0.65 -1.07 5.07 3.38 -0.90 -2.38 115.31 119.36 2kzz h LEU 461 Ca 0.04 0.02 0.21 0.00 0.09 0.00 0.00 57.88 58.23 2kzz h LEU 461 Cb 1.00 0.17 -0.11 0.00 0.09 0.00 0.00 40.66 41.81 2kzz h LEU 461 CO 0.10 -0.46 0.61 0.00 0.09 0.00 0.00 178.44 178.78 2kzz h ALA 462 N -0.36 1.78 0.00 1.53 0.00 -1.05 0.13 119.26 121.29 2kzz h ALA 462 Ca -0.08 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2kzz h ALA 462 Cb 0.60 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2kzz h ALA 462 CO 0.13 -0.18 -0.57 1.49 0.00 0.00 0.00 179.25 180.12 2kzz h GLU 463 N 0.67 0.00 0.06 0.00 4.81 -1.29 0.79 114.58 119.62 2kzz h GLU 463 Ca 0.59 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.61 2kzz h GLU 463 Cb 1.05 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 2kzz h GLU 463 CO -0.39 0.57 -1.10 -0.09 -0.73 0.00 0.00 179.01 177.28 2kzz h ARG 464 N 0.00 0.13 0.00 1.92 2.43 -0.39 -3.15 114.38 115.33 2kzz h ARG 464 Ca -0.01 -0.23 -0.15 0.00 -0.81 0.00 0.00 59.98 58.78 2kzz h ARG 464 Cb 1.07 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.67 2kzz h ARG 464 CO 0.07 1.11 -1.76 0.91 -1.51 0.00 0.00 179.97 178.79 2kzz n TRP 465 N -4.19 0.48 0.09 2.20 7.02 0.21 -4.49 117.44 118.77 2kzz n TRP 465 Ca -0.24 0.16 0.01 0.00 -1.02 0.00 0.00 57.50 56.41 2kzz n TRP 465 Cb 0.76 -0.89 0.02 0.00 -2.42 0.00 0.00 31.31 28.77 2kzz n TRP 465 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2kzz n LEU 466 N -2.66 1.37 -4.23 -0.99 4.77 0.15 -4.98 117.00 110.43 2kzz n LEU 466 Ca -0.13 -1.15 -0.36 0.00 -0.03 0.00 0.00 56.01 54.35 2kzz n LEU 466 Cb 0.81 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.86 2kzz n LEU 466 CO 0.43 0.32 -0.07 0.29 -1.33 0.00 0.00 177.39 177.03 2kzz n LYS 467 N 0.10 -2.89 -4.42 3.23 4.01 -0.48 -4.90 118.16 112.80 2kzz n LYS 467 Ca 0.02 0.35 -0.21 0.00 -0.51 0.00 0.00 58.31 57.95 2kzz n LYS 467 Cb 0.10 -4.96 -0.16 0.00 -0.51 0.00 0.00 35.03 29.51 2kzz n LYS 467 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 2kzz s HIS 468 N -3.39 1.05 -0.33 2.13 2.46 -0.87 -4.95 115.29 111.39 2kzz s HIS 468 Ca 0.65 -0.29 -0.14 0.00 0.47 0.00 0.00 55.06 55.75 2kzz s HIS 468 Cb -0.36 -0.76 -0.02 0.00 -0.13 0.00 0.00 32.58 31.31 2kzz s HIS 468 CO 0.94 -0.14 0.32 0.15 -2.47 0.00 0.00 174.74 173.54 2kzz s LYS 469 N 0.33 3.60 0.73 2.88 1.02 -1.26 -2.07 119.74 124.97 2kzz s LYS 469 Ca -0.06 -0.44 -0.11 0.00 0.02 0.00 0.00 55.97 55.38 2kzz s LYS 469 Cb -0.10 -3.79 0.03 0.00 -0.52 0.00 0.00 37.83 33.45 2kzz s LYS 469 CO 0.01 -0.47 1.07 0.95 -0.92 0.00 0.00 175.35 176.00 2kzz s THR 470 N 1.93 3.72 0.01 2.17 -4.23 -1.26 -4.99 115.64 113.00 2kzz s THR 470 Ca 0.10 0.56 -0.30 0.00 -1.18 0.00 0.00 61.69 60.87 2kzz s THR 470 Cb -0.17 -3.29 -0.05 0.00 1.34 0.00 0.00 72.50 70.33 2kzz s THR 470 CO 0.11 -0.73 1.29 -0.63 -0.54 0.00 0.00 174.62 174.12 2kzz s ILE 471 N -3.07 3.91 0.34 2.99 1.01 -1.26 -5.01 121.20 120.11 2kzz s ILE 471 Ca 0.59 1.31 -0.14 0.00 0.00 0.00 0.00 60.65 62.41 2kzz s ILE 471 Cb -0.14 -3.84 -0.08 0.00 0.01 0.00 0.00 42.46 38.40 2kzz s ILE 471 CO 0.55 0.04 0.74 0.28 0.00 0.00 0.00 174.94 176.54 2kzz s THR 472 N 1.85 4.71 0.32 2.92 -1.32 -1.26 -4.98 115.64 117.88 2kzz s THR 472 Ca 0.60 0.87 0.03 0.00 -1.21 0.00 0.00 61.69 61.98 2kzz s THR 472 Cb -0.30 -3.63 0.29 0.00 -1.51 0.00 0.00 72.50 67.35 2kzz s THR 472 CO 0.26 -0.25 1.93 0.15 -2.21 0.00 0.00 174.62 174.50 2kzz h PHE 473 N 2.07 0.94 -0.71 9.09 3.57 -1.97 -1.51 116.94 128.43 2kzz h PHE 473 Ca -0.48 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 2kzz h PHE 473 Cb 1.18 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 2kzz h PHE 473 CO 0.62 0.49 0.41 0.93 -2.23 0.00 0.00 178.31 178.53 2kzz h GLU 474 N 0.93 0.96 -0.48 1.11 3.07 -1.94 -0.08 114.58 118.15 2kzz h GLU 474 Ca 0.37 -0.09 -0.01 0.00 -0.50 0.00 0.00 59.36 59.13 2kzz h GLU 474 Cb 0.24 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 27.92 2kzz h GLU 474 CO -0.13 0.68 0.27 0.93 -1.40 0.00 0.00 179.01 179.36 2kzz h GLU 475 N 0.98 0.65 0.00 2.33 5.08 -1.56 0.32 114.58 122.37 2kzz h GLU 475 Ca 0.25 -0.06 -0.32 0.00 -1.00 0.00 0.00 59.36 58.24 2kzz h GLU 475 Cb -0.02 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.03 2kzz h GLU 475 CO -0.05 0.47 -2.16 0.44 -1.00 0.00 0.00 179.01 176.72 2kzz n ILE 476 N -4.42 1.34 -0.12 3.13 -5.35 -0.99 -4.67 119.36 108.29 2kzz n ILE 476 Ca 0.04 -0.81 -0.16 0.00 -0.27 0.00 0.00 62.75 61.54 2kzz n ILE 476 Cb 0.09 -0.58 -0.13 0.00 -1.74 0.00 0.00 39.64 37.28 2kzz n ILE 476 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kzz n ALA 477 N -2.66 1.43 0.00 -1.28 0.00 -0.08 -4.94 120.51 112.99 2kzz n ALA 477 Ca -0.26 -1.13 0.00 0.00 0.00 0.00 0.00 53.44 52.05 2kzz n ALA 477 Cb 1.08 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.38 2kzz n ALA 477 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kzz n GLY 478 N 2.14 -0.39 3.29 0.00 0.00 0.11 -1.62 105.19 108.72 2kzz n GLY 478 Ca -0.43 -2.21 -0.17 0.00 0.00 0.00 0.00 46.02 43.22 2kzz n GLY 478 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kzz s LYS 479 N 0.00 1.49 2.00 1.61 1.02 -1.26 -4.37 119.74 120.23 2kzz s LYS 479 Ca 0.00 -1.83 0.00 0.00 0.02 0.00 0.00 55.97 54.16 2kzz s LYS 479 Cb 0.00 0.05 0.00 0.00 -0.52 0.00 0.00 37.83 37.36 2kzz s LYS 479 CO 0.00 -0.45 0.00 0.41 -0.92 0.00 0.00 175.35 174.39 2kzz n GLY 480 N -0.49 -0.88 0.17 -3.33 0.00 -1.26 -3.46 105.19 95.94 2kzz n GLY 480 Ca 0.02 -1.13 0.02 0.00 0.00 0.00 0.00 46.02 44.93 2kzz n GLY 480 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kzz h LYS 481 N 0.00 0.00 -0.91 1.61 1.57 -2.03 -2.94 116.57 113.87 2kzz h LYS 481 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kzz h LYS 481 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 2kzz h LYS 481 CO 0.00 0.47 0.01 0.09 -0.57 0.00 0.00 179.45 179.44 2kzz n ASN 482 N -3.85 2.16 -4.77 0.86 3.02 -1.26 -4.90 115.26 106.53 2kzz n ASN 482 Ca -0.01 -2.23 -0.40 0.00 -0.03 0.00 0.00 54.58 51.92 2kzz n ASN 482 Cb 0.51 -0.55 -0.02 0.00 -0.61 0.00 0.00 39.78 39.11 2kzz n ASN 482 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2kzz s GLN 483 N -1.39 4.22 0.44 3.52 0.74 -1.11 -4.86 119.66 121.22 2kzz s GLN 483 Ca 0.13 2.02 -0.13 0.00 0.05 0.00 0.00 55.36 57.43 2kzz s GLN 483 Cb 0.10 -2.89 -0.07 0.00 1.10 0.00 0.00 33.01 31.24 2kzz s GLN 483 CO 0.04 -0.23 0.84 -0.51 -0.55 0.00 0.00 175.29 174.88 2kzz s LEU 484 N -2.10 3.76 0.09 3.68 1.43 -0.64 -5.00 118.68 119.90 2kzz s LEU 484 Ca 0.53 1.29 -0.06 0.00 -1.03 0.00 0.00 54.13 54.85 2kzz s LEU 484 Cb -0.35 -4.19 -0.05 0.00 0.03 0.00 0.00 46.19 41.62 2kzz s LEU 484 CO 0.46 -0.46 0.35 0.42 0.23 0.00 0.00 176.35 177.35 2kzz s THR 485 N -2.45 5.19 0.43 5.49 -4.23 -1.26 -4.84 115.64 113.96 2kzz s THR 485 Ca 0.54 0.16 0.31 0.00 -1.18 0.00 0.00 61.69 61.52 2kzz s THR 485 Cb -0.10 -3.62 0.48 0.00 1.34 0.00 0.00 72.50 70.60 2kzz s THR 485 CO 0.31 0.19 1.54 0.33 -0.54 0.00 0.00 174.62 176.44 2kzz n PHE 486 N 0.55 0.73 0.60 3.99 7.35 -1.26 -0.19 117.46 129.24 2kzz n PHE 486 Ca -0.06 0.74 0.07 0.00 -0.76 0.00 0.00 57.45 57.44 2kzz n PHE 486 Cb 0.52 -1.17 0.34 0.00 0.35 0.00 0.00 39.48 39.52 2kzz n PHE 486 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 2kzz n ASN 487 N -4.73 0.00 -0.70 -2.13 0.23 -1.26 -2.43 115.26 104.24 2kzz n ASN 487 Ca 0.40 0.30 0.09 0.00 -0.53 0.00 0.00 54.58 54.84 2kzz n ASN 487 Cb 1.52 -0.40 0.06 0.00 -2.08 0.00 0.00 39.78 38.89 2kzz n ASN 487 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2kzz n GLN 488 N -1.40 1.65 -3.20 -3.83 6.02 0.73 -1.67 117.38 115.68 2kzz n GLN 488 Ca 0.05 -1.49 -0.39 0.00 -0.01 0.00 0.00 57.00 55.16 2kzz n GLN 488 Cb 0.15 -1.36 -0.06 0.00 1.02 0.00 0.00 30.24 29.99 2kzz n GLN 488 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2kzz s ILE 489 N -1.70 4.83 0.40 5.09 1.01 -1.02 -4.83 121.20 124.98 2kzz s ILE 489 Ca 0.21 1.28 -0.26 0.00 0.00 0.00 0.00 60.65 61.88 2kzz s ILE 489 Cb 0.16 -3.94 -0.10 0.00 0.01 0.00 0.00 42.46 38.58 2kzz s ILE 489 CO 0.28 0.46 1.20 0.00 0.00 0.00 0.00 174.94 176.88 2kzz n ALA 490 N 2.41 0.96 -0.25 9.38 0.00 -1.26 -4.69 120.51 127.07 2kzz n ALA 490 Ca -0.07 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2kzz n ALA 490 Cb 0.51 -2.21 0.07 0.00 0.00 0.00 0.00 19.45 17.82 2kzz n ALA 490 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2kzz h LEU 491 N 2.02 -0.78 -1.06 0.00 4.07 -1.96 0.11 115.31 117.70 2kzz h LEU 491 Ca -0.46 0.22 -0.09 0.00 0.08 0.00 0.00 57.88 57.63 2kzz h LEU 491 Cb 1.31 0.48 -0.01 0.00 1.08 0.00 0.00 40.66 43.52 2kzz h LEU 491 CO 0.60 -0.25 -0.36 -0.33 -1.08 0.00 0.00 178.44 177.01 2kzz h GLU 492 N -0.03 0.21 0.01 1.13 4.39 -1.99 0.47 114.58 118.77 2kzz h GLU 492 Ca 0.33 -0.09 -0.23 0.00 0.34 0.00 0.00 59.36 59.72 2kzz h GLU 492 Cb 0.54 -0.01 0.02 0.00 -0.10 0.00 0.00 28.75 29.20 2kzz h GLU 492 CO -0.75 0.54 -0.90 0.93 -1.16 0.00 0.00 179.01 177.67 2kzz h GLU 493 N 0.18 0.60 -1.00 2.33 4.39 -1.70 -2.57 114.58 116.80 2kzz h GLU 493 Ca 0.02 -0.66 0.03 0.00 0.34 0.00 0.00 59.36 59.10 2kzz h GLU 493 Cb 0.72 0.19 -0.06 0.00 -0.10 0.00 0.00 28.75 29.50 2kzz h GLU 493 CO 0.05 1.26 0.66 0.00 -1.16 0.00 0.00 179.01 179.82 2kzz h ALA 494 N 0.36 1.32 -0.44 3.43 0.00 -0.64 -2.82 119.26 120.47 2kzz h ALA 494 Ca -0.11 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2kzz h ALA 494 Cb 1.58 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2kzz h ALA 494 CO 0.18 0.56 0.04 0.78 0.00 0.00 0.00 179.25 180.81 2kzz h GLY 495 N 1.28 0.82 0.55 0.00 0.00 -0.88 -0.94 103.07 103.90 2kzz h GLY 495 Ca 0.40 -0.57 0.06 0.00 0.00 0.00 0.00 47.33 47.21 2kzz h GLY 495 CO -0.12 0.52 0.08 3.21 0.00 0.00 0.00 176.54 180.23 2kzz h ARG 496 N 0.61 0.20 0.38 4.80 3.08 -1.22 0.17 114.38 122.40 2kzz h ARG 496 Ca 0.13 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2kzz h ARG 496 Cb 0.43 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2kzz h ARG 496 CO 0.01 0.13 -0.18 -0.92 -1.07 0.00 0.00 179.97 177.94 2kzz h TYR 497 N 0.20 -0.48 0.26 3.04 3.20 -1.41 -2.31 116.97 119.47 2kzz h TYR 497 Ca 0.18 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2kzz h TYR 497 Cb 0.21 0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.64 2kzz h TYR 497 CO -0.19 -0.19 -0.12 0.00 -1.64 0.00 0.00 178.16 176.02 2kzz h ALA 498 N -0.20 -0.35 -0.54 1.82 0.00 -1.06 -2.14 119.26 116.80 2kzz h ALA 498 Ca -0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2kzz h ALA 498 Cb 0.51 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2kzz h ALA 498 CO 0.09 -0.67 0.23 0.00 0.00 0.00 0.00 179.25 178.90 2kzz h ALA 499 N 0.34 1.40 -0.40 0.00 0.00 -0.78 -2.11 119.26 117.71 2kzz h ALA 499 Ca -0.04 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 2kzz h ALA 499 Cb 0.30 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2kzz h ALA 499 CO 0.06 0.46 -0.13 1.49 0.00 0.00 0.00 179.25 181.13 2kzz h GLU 500 N 0.76 0.73 -0.15 0.00 4.81 -1.31 -0.35 114.58 119.07 2kzz h GLU 500 Ca 0.19 -0.25 0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2kzz h GLU 500 Cb 0.12 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2kzz h GLU 500 CO -0.02 0.83 -0.01 -0.44 -0.73 0.00 0.00 179.01 178.65 2kzz h ASP 501 N 0.66 -0.07 0.29 1.04 5.19 -0.74 0.38 116.42 123.17 2kzz h ASP 501 Ca 0.11 0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.55 2kzz h ASP 501 Cb 0.60 0.06 -0.01 0.00 0.18 0.00 0.00 39.33 40.16 2kzz h ASP 501 CO 0.04 -0.01 -0.22 0.00 -3.12 0.00 0.00 179.24 175.93 2kzz h ALA 502 N 1.13 -0.49 0.42 3.45 0.00 -1.21 -0.70 119.26 121.86 2kzz h ALA 502 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2kzz h ALA 502 Cb 0.09 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2kzz h ALA 502 CO -0.13 -0.80 -0.20 0.22 0.00 0.00 0.00 179.25 178.35 2kzz h ASP 503 N -0.51 -0.47 -0.77 0.00 3.58 -0.83 -2.20 116.42 115.21 2kzz h ASP 503 Ca -0.02 0.01 0.05 0.00 0.42 0.00 0.00 57.03 57.49 2kzz h ASP 503 Cb 0.44 0.12 -0.05 0.00 1.72 0.00 0.00 39.33 41.56 2kzz h ASP 503 CO -0.00 -0.33 0.47 0.58 -2.88 0.00 0.00 179.24 177.08 2kzz h VAL 504 N -0.57 1.06 -0.46 2.25 2.07 -0.26 -1.62 116.25 118.72 2kzz h VAL 504 Ca -0.06 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.20 2kzz h VAL 504 Cb 0.43 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.25 2kzz h VAL 504 CO 0.09 0.16 0.21 0.74 0.02 0.00 0.00 177.57 178.79 2kzz h THR 505 N 0.90 0.92 -0.51 2.57 2.02 -0.83 -0.80 112.91 117.18 2kzz h THR 505 Ca 0.32 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.37 2kzz h THR 505 Cb 0.10 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 2kzz h THR 505 CO -0.14 0.08 0.33 0.25 0.37 0.00 0.00 175.52 176.40 2kzz h LEU 506 N 0.41 0.59 -1.06 2.58 5.85 -0.77 -1.62 115.31 121.29 2kzz h LEU 506 Ca 0.21 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2kzz h LEU 506 Cb 0.15 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2kzz h LEU 506 CO -0.17 0.43 0.35 1.56 -0.34 0.00 0.00 178.44 180.27 2kzz h GLN 507 N 0.69 1.02 -0.39 1.25 4.20 -0.70 -1.38 115.11 119.79 2kzz h GLN 507 Ca 0.19 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 2kzz h GLN 507 Cb -0.07 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2kzz h GLN 507 CO -0.04 0.78 -0.12 -0.07 -0.67 0.00 0.00 178.83 178.71 2kzz h LEU 508 N 1.01 0.69 -0.44 1.46 3.38 -0.79 -2.39 115.31 118.22 2kzz h LEU 508 Ca 0.25 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 2kzz h LEU 508 Cb 0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2kzz h LEU 508 CO -0.03 0.83 -0.15 -0.74 0.09 0.00 0.00 178.44 178.44 2kzz h HIS 509 N 0.63 1.00 0.00 1.13 2.76 -0.79 -0.91 115.15 118.98 2kzz h HIS 509 Ca 0.11 -0.23 -0.03 0.00 -2.20 0.00 0.00 60.37 58.02 2kzz h HIS 509 Cb 0.58 -0.24 -0.00 0.00 1.55 0.00 0.00 27.41 29.29 2kzz h HIS 509 CO 0.03 1.00 -0.14 -0.07 -1.30 0.00 0.00 177.93 177.45 2kzz h LEU 510 N 0.71 0.00 0.11 0.26 4.07 -0.85 0.29 115.31 119.91 2kzz h LEU 510 Ca 0.11 0.00 -0.34 0.00 0.08 0.00 0.00 57.88 57.72 2kzz h LEU 510 Cb 0.70 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.42 2kzz h LEU 510 CO 0.05 0.14 -1.87 0.29 -1.08 0.00 0.00 178.44 175.97 2kzz n LYS 511 N -3.81 0.73 0.11 1.13 5.02 -0.94 -4.46 118.16 115.95 2kzz n LYS 511 Ca -0.02 0.32 -0.23 0.00 -2.02 0.00 0.00 58.31 56.35 2kzz n LYS 511 Cb 0.24 -1.72 -0.14 0.00 -0.02 0.00 0.00 35.03 33.38 2kzz n LYS 511 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 2kzz h MET 512 N -0.10 0.58 -0.76 1.97 2.86 -1.04 -3.31 114.93 115.13 2kzz h MET 512 Ca -0.41 -0.87 0.08 0.00 -2.06 0.00 0.00 59.70 56.45 2kzz h MET 512 Cb 1.92 0.30 -0.07 0.00 0.06 0.00 0.00 31.60 33.82 2kzz h MET 512 CO 0.04 1.41 0.42 2.35 1.06 0.00 0.00 176.91 182.19 2kzz h TRP 513 N 0.19 0.77 -0.23 -0.22 -0.00 -1.16 -0.21 115.95 115.10 2kzz h TRP 513 Ca -0.22 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.69 2kzz h TRP 513 Cb 2.02 -0.23 -0.01 0.00 -0.00 0.00 0.00 29.16 30.94 2kzz h TRP 513 CO 0.13 0.32 0.11 -1.35 -0.00 0.00 0.00 178.44 177.64 2kzz h PRO 514 N 0.73 0.34 -0.75 2.65 0.11 -1.77 -2.94 132.00 130.35 2kzz h PRO 514 Ca 0.36 -0.05 0.08 0.00 0.11 0.00 0.00 66.00 66.50 2kzz h PRO 514 Cb 0.32 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.32 2kzz h PRO 514 CO -0.24 0.35 0.49 -0.44 -0.21 0.00 0.00 178.00 177.96 2kzz h ASP 515 N 0.24 0.66 0.11 -2.05 5.19 -1.50 -0.98 116.42 118.09 2kzz h ASP 515 Ca 0.08 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.50 2kzz h ASP 515 Cb 0.13 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2kzz h ASP 515 CO -0.01 0.42 0.00 0.18 -3.12 0.00 0.00 179.24 176.71 2kzz n LEU 516 N -4.49 0.00 -0.28 1.55 4.77 -0.14 -2.67 117.00 115.74 2kzz n LEU 516 Ca 0.12 0.21 0.08 0.00 -0.03 0.00 0.00 56.01 56.39 2kzz n LEU 516 Cb 0.26 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 2kzz n LEU 516 CO 0.33 -0.16 0.18 0.00 -1.33 0.00 0.00 177.39 176.42 2kzz n GLN 517 N -1.21 1.62 0.02 3.23 6.02 -0.37 -3.99 117.38 122.69 2kzz n GLN 517 Ca 0.04 -0.61 0.07 0.00 -0.01 0.00 0.00 57.00 56.50 2kzz n GLN 517 Cb 0.05 -1.29 0.32 0.00 1.02 0.00 0.00 30.24 30.34 2kzz n GLN 517 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2kzz n LYS 518 N -0.46 0.03 -3.74 -1.09 5.02 -1.09 -4.60 118.16 112.23 2kzz n LYS 518 Ca 0.06 0.30 -0.14 0.00 -2.02 0.00 0.00 58.31 56.50 2kzz n LYS 518 Cb 0.33 -1.56 -0.15 0.00 -0.02 0.00 0.00 35.03 33.63 2kzz n LYS 518 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2kzz s HIS 519 N -3.05 -0.13 -0.17 2.13 3.76 -1.26 -5.02 115.29 111.54 2kzz s HIS 519 Ca 0.06 0.45 0.29 0.00 -0.15 0.00 0.00 55.06 55.71 2kzz s HIS 519 Cb 0.09 -0.15 1.12 0.00 1.11 0.00 0.00 32.58 34.75 2kzz s HIS 519 CO 0.26 -0.17 1.86 0.87 -0.85 0.00 0.00 174.74 176.71 2kzz h LYS 520 N 7.46 0.00 0.00 1.40 1.79 -1.89 -2.79 116.57 122.54 2kzz h LYS 520 Ca -0.38 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.09 2kzz h LYS 520 Cb 1.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 2kzz h LYS 520 CO 0.38 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.16 2kzz n GLY 521 N 0.22 -1.67 0.36 3.86 0.00 -1.26 -2.12 105.19 104.58 2kzz n GLY 521 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 2kzz n GLY 521 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2kzz h PRO 522 N 0.00 0.86 0.05 1.61 0.11 -1.64 -2.15 132.00 130.84 2kzz h PRO 522 Ca 0.00 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.08 2kzz h PRO 522 Cb 0.00 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 30.87 2kzz h PRO 522 CO 0.00 0.57 -0.29 1.25 -0.21 0.00 0.00 178.00 179.32 2kzz h LEU 523 N 0.89 -0.84 -0.33 2.35 7.12 -1.58 -1.21 115.31 121.71 2kzz h LEU 523 Ca 0.53 0.11 0.05 0.00 0.13 0.00 0.00 57.88 58.69 2kzz h LEU 523 Cb 0.66 0.33 -0.04 0.00 -0.53 0.00 0.00 40.66 41.07 2kzz h LEU 523 CO -0.32 -0.36 0.06 -1.13 -0.13 0.00 0.00 178.44 176.56 2kzz h ASN 524 N -0.46 0.00 -0.64 1.25 -1.24 -0.85 -0.70 115.58 112.94 2kzz h ASN 524 Ca 0.05 0.06 0.04 0.00 0.71 0.00 0.00 56.30 57.15 2kzz h ASN 524 Cb 0.52 0.08 -0.04 0.00 0.73 0.00 0.00 38.32 39.61 2kzz h ASN 524 CO -0.21 0.04 0.38 0.58 -1.29 0.00 0.00 177.43 176.92 2kzz h VAL 525 N 0.18 1.05 -0.38 2.57 2.07 -1.10 -0.22 116.25 120.42 2kzz h VAL 525 Ca 0.16 -0.25 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 2kzz h VAL 525 Cb 0.18 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2kzz h VAL 525 CO -0.21 0.13 -0.08 0.15 0.02 0.00 0.00 177.57 177.58 2kzz h PHE 526 N 0.73 0.80 0.00 1.57 3.04 -0.74 0.18 116.94 122.53 2kzz h PHE 526 Ca 0.26 -0.17 -0.00 0.00 3.98 0.00 0.00 57.97 62.05 2kzz h PHE 526 Cb 0.07 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.38 2kzz h PHE 526 CO -0.06 0.85 -0.00 0.93 -2.02 0.00 0.00 178.31 178.01 2kzz h GLU 527 N 0.52 -0.00 0.00 1.11 5.08 -0.99 -0.99 114.58 119.30 2kzz h GLU 527 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2kzz h GLU 527 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2kzz h GLU 527 CO 0.03 0.67 -1.66 0.09 -1.00 0.00 0.00 179.01 177.15 2kzz n ASN 528 N -4.77 0.29 -0.03 1.42 4.13 -0.11 -4.41 115.26 111.79 2kzz n ASN 528 Ca -0.09 -0.03 -0.04 0.00 1.68 0.00 0.00 54.58 56.09 2kzz n ASN 528 Cb 0.33 1.53 -0.01 0.00 -1.54 0.00 0.00 39.78 40.09 2kzz n ASN 528 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2kzz n ILE 529 N -2.25 0.98 0.14 2.41 5.41 -0.22 -4.68 119.36 121.15 2kzz n ILE 529 Ca -0.02 0.26 -0.14 0.00 1.00 0.00 0.00 62.75 63.85 2kzz n ILE 529 Cb 0.54 -1.85 -0.08 0.00 -0.71 0.00 0.00 39.64 37.53 2kzz n ILE 529 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2kzz h GLU 530 N -0.45 -0.32 -0.36 0.38 4.39 -0.79 -3.11 114.58 114.33 2kzz h GLU 530 Ca 0.00 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.73 2kzz h GLU 530 Cb 0.45 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 2kzz h GLU 530 CO 0.00 -0.06 0.22 0.52 -1.16 0.00 0.00 179.01 178.53 2kzz h MET 531 N -0.55 0.44 0.00 2.33 2.86 -1.40 -2.12 114.93 116.49 2kzz h MET 531 Ca -0.03 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2kzz h MET 531 Cb 0.40 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 2kzz h MET 531 CO 0.06 0.29 -0.06 -1.35 1.06 0.00 0.00 176.91 176.90 2kzz h PRO 532 N 0.45 0.00 0.00 -0.22 0.11 -1.77 -2.53 132.00 128.04 2kzz h PRO 532 Ca 0.14 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.22 2kzz h PRO 532 Cb -0.03 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.08 2kzz h PRO 532 CO -0.05 0.06 -0.12 1.25 -0.21 0.00 0.00 178.00 178.94 2kzz h LEU 533 N 0.00 0.00 -0.26 2.35 5.85 -1.31 -3.34 115.31 118.60 2kzz h LEU 533 Ca -0.00 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.78 2kzz h LEU 533 Cb 0.29 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 2kzz h LEU 533 CO 0.01 0.12 -0.21 0.58 -0.34 0.00 0.00 178.44 178.60 2kzz h VAL 534 N 0.00 0.44 0.00 1.05 2.07 -1.38 -0.81 116.25 117.62 2kzz h VAL 534 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2kzz h VAL 534 Cb 0.81 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 2kzz h VAL 534 CO 0.02 0.00 -0.11 1.55 0.02 0.00 0.00 177.57 179.05 2kzz h PRO 535 N -0.21 0.00 -0.10 1.57 0.13 -1.78 -2.73 132.00 128.88 2kzz h PRO 535 Ca 0.14 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.06 2kzz h PRO 535 Cb 0.42 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.57 2kzz h PRO 535 CO -0.38 0.11 -0.77 -0.39 -0.23 0.00 0.00 178.00 176.34 2kzz h VAL 536 N 0.00 1.30 -0.47 1.56 -1.51 -1.53 -2.42 116.25 113.18 2kzz h VAL 536 Ca -0.00 -2.01 -0.01 0.00 -1.23 0.00 0.00 66.70 63.45 2kzz h VAL 536 Cb 0.74 2.15 -0.02 0.00 -2.13 0.00 0.00 31.29 32.03 2kzz h VAL 536 CO 0.01 0.62 0.25 -0.07 -1.23 0.00 0.00 177.57 177.16 2kzz h LEU 537 N 0.39 0.60 -0.46 4.19 3.38 -1.14 -0.40 115.31 121.87 2kzz h LEU 537 Ca -0.07 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 57.88 2kzz h LEU 537 Cb 1.41 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.94 2kzz h LEU 537 CO 0.16 0.53 0.07 -1.28 0.09 0.00 0.00 178.44 178.00 2kzz h SER 538 N 0.62 -0.05 0.07 -0.43 0.87 -1.46 0.51 113.55 113.69 2kzz h SER 538 Ca 0.17 0.09 -0.09 0.00 -1.23 0.00 0.00 61.79 60.72 2kzz h SER 538 Cb 0.07 0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 2kzz h SER 538 CO -0.02 0.01 -0.30 0.03 -0.53 0.00 0.00 176.83 176.01 2kzz h ARG 539 N 0.19 0.35 -0.24 2.24 3.08 -0.97 -1.07 114.38 117.96 2kzz h ARG 539 Ca 0.23 -0.14 -0.17 0.00 0.07 0.00 0.00 59.98 59.98 2kzz h ARG 539 Cb 0.31 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2kzz h ARG 539 CO -0.32 0.62 -0.50 0.82 -1.07 0.00 0.00 179.97 179.52 2kzz h ILE 540 N 0.31 1.30 -0.33 2.04 2.04 -0.44 -1.64 117.51 120.78 2kzz h ILE 540 Ca 0.04 -1.70 -0.06 0.00 1.00 0.00 0.00 64.86 64.14 2kzz h ILE 540 Cb 0.68 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.50 2kzz h ILE 540 CO 0.05 0.54 -0.03 -0.33 0.00 0.00 0.00 178.15 178.39 2kzz h GLU 541 N 0.51 0.61 -0.03 2.37 5.08 -0.77 -2.57 114.58 119.76 2kzz h GLU 541 Ca 0.01 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 58.02 2kzz h GLU 541 Cb 1.11 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2kzz h GLU 541 CO 0.11 0.75 -0.59 0.00 -1.00 0.00 0.00 179.01 178.28 2kzz h ARG 542 N 0.41 0.11 -0.27 2.33 3.08 -1.25 -3.10 114.38 115.69 2kzz h ARG 542 Ca 0.09 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2kzz h ARG 542 Cb 0.50 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 2kzz h ARG 542 CO 0.02 0.67 0.12 -0.91 -1.07 0.00 0.00 179.97 178.81 2kzz h ASN 543 N 0.09 0.37 -3.44 7.04 -0.26 -1.18 -3.49 115.58 114.70 2kzz h ASN 543 Ca -0.01 -0.14 0.06 0.00 -0.56 0.00 0.00 56.30 55.65 2kzz h ASN 543 Cb 1.07 -0.09 -0.02 0.00 -1.06 0.00 0.00 38.32 38.22 2kzz h ASN 543 CO 0.08 0.41 -0.08 0.61 -1.06 0.00 0.00 177.43 177.39 2kzz n GLY 544 N -0.79 -1.96 2.94 2.83 0.00 -0.98 -4.94 105.19 102.30 2kzz n GLY 544 Ca -0.02 -1.36 -0.21 0.00 0.00 0.00 0.00 46.02 44.43 2kzz n GLY 544 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kzz s VAL 545 N -0.70 0.69 -0.17 1.61 0.11 0.11 -4.72 120.40 117.33 2kzz s VAL 545 Ca 0.00 -0.24 -0.29 0.00 -2.93 0.00 0.00 61.98 58.51 2kzz s VAL 545 Cb 0.00 -0.67 -0.01 0.00 -1.53 0.00 0.00 36.38 34.17 2kzz s VAL 545 CO 0.00 0.25 1.23 -0.75 -3.33 0.00 0.00 175.10 172.50 2kzz s LYS 546 N 0.65 4.24 -0.15 1.54 2.36 -1.26 -0.83 119.74 126.29 2kzz s LYS 546 Ca -0.10 1.62 0.01 0.00 -2.55 0.00 0.00 55.97 54.95 2kzz s LYS 546 Cb -0.13 -3.74 0.00 0.00 -1.05 0.00 0.00 37.83 32.91 2kzz s LYS 546 CO 0.01 -0.69 -0.17 0.42 1.55 0.00 0.00 175.35 176.47 2kzz s ILE 547 N 3.41 2.52 -0.51 5.43 1.01 -1.26 -1.52 121.20 130.29 2kzz s ILE 547 Ca 0.53 -0.82 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 2kzz s ILE 547 Cb -0.21 -2.05 0.03 0.00 0.01 0.00 0.00 42.46 40.24 2kzz s ILE 547 CO 0.14 0.52 1.18 -0.62 0.00 0.00 0.00 174.94 176.16 2kzz s ASP 548 N 0.79 6.55 0.41 3.58 -1.08 -0.04 -4.89 116.67 121.99 2kzz s ASP 548 Ca -0.06 0.38 0.22 0.00 -0.52 0.00 0.00 52.55 52.57 2kzz s ASP 548 Cb -0.15 -2.55 0.71 0.00 -1.46 0.00 0.00 42.92 39.47 2kzz s ASP 548 CO -0.00 -1.34 1.74 1.55 0.52 0.00 0.00 175.17 177.63 2kzz h PRO 549 N 9.45 0.00 0.56 4.34 0.13 -1.97 -3.02 132.00 141.49 2kzz h PRO 549 Ca -0.24 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.86 2kzz h PRO 549 Cb 1.06 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.20 2kzz h PRO 549 CO 1.14 0.27 -0.27 0.87 -0.23 0.00 0.00 178.00 179.78 2kzz h LYS 550 N 0.00 -0.73 -0.46 0.86 1.57 -1.99 0.20 116.57 116.02 2kzz h LYS 550 Ca -0.00 0.05 0.09 0.00 -1.87 0.00 0.00 60.65 58.92 2kzz h LYS 550 Cb 0.89 0.16 -0.09 0.00 0.08 0.00 0.00 32.23 33.27 2kzz h LYS 550 CO 0.03 -0.47 -0.19 0.28 -0.57 0.00 0.00 179.45 178.54 2kzz h VAL 551 N -0.79 0.41 -0.89 0.50 2.07 -1.98 0.16 116.25 115.74 2kzz h VAL 551 Ca -0.08 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.51 2kzz h VAL 551 Cb 0.59 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 2kzz h VAL 551 CO 0.13 0.00 0.58 -0.07 0.02 0.00 0.00 177.57 178.22 2kzz h LEU 552 N -0.09 0.87 -0.26 2.57 4.07 -1.34 -0.86 115.31 120.27 2kzz h LEU 552 Ca 0.22 0.01 -0.18 0.00 0.08 0.00 0.00 57.88 58.01 2kzz h LEU 552 Cb 0.43 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.99 2kzz h LEU 552 CO -0.52 0.56 -0.54 -0.74 -1.08 0.00 0.00 178.44 176.12 2kzz h HIS 553 N 0.99 1.03 0.52 1.13 2.76 0.15 -1.81 115.15 119.92 2kzz h HIS 553 Ca 0.39 -0.38 -0.02 0.00 -2.20 0.00 0.00 60.37 58.16 2kzz h HIS 553 Cb 0.23 -0.19 -0.00 0.00 1.55 0.00 0.00 27.41 28.99 2kzz h HIS 553 CO -0.00 1.20 -0.31 -0.91 -1.30 0.00 0.00 177.93 176.61 2kzz h ASN 554 N 0.58 -0.77 -0.97 3.26 2.35 -0.03 -0.40 115.58 119.59 2kzz h ASN 554 Ca 0.01 0.04 0.26 0.00 -0.55 0.00 0.00 56.30 56.06 2kzz h ASN 554 Cb 1.15 0.23 -0.06 0.00 0.05 0.00 0.00 38.32 39.69 2kzz h ASN 554 CO 0.12 -0.49 0.67 -0.74 -1.65 0.00 0.00 177.43 175.34 2kzz h HIS 555 N -0.78 0.27 0.17 1.19 2.76 -1.21 0.23 115.15 117.79 2kzz h HIS 555 Ca -0.06 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.11 2kzz h HIS 555 Cb 0.63 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.52 2kzz h HIS 555 CO -0.09 0.05 -0.08 1.03 -1.30 0.00 0.00 177.93 177.54 2kzz h SER 556 N 0.18 -0.20 -0.83 3.26 0.87 -0.33 -1.26 113.55 115.25 2kzz h SER 556 Ca 0.49 -0.29 0.02 0.00 -1.23 0.00 0.00 61.79 60.79 2kzz h SER 556 Cb 1.62 0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 63.58 2kzz h SER 556 CO -0.11 0.21 0.54 -0.33 -0.53 0.00 0.00 176.83 176.61 2kzz h GLU 557 N -0.64 1.04 -0.34 2.24 4.39 0.90 -1.97 114.58 120.20 2kzz h GLU 557 Ca -0.02 -0.06 -0.08 0.00 0.34 0.00 0.00 59.36 59.53 2kzz h GLU 557 Cb 0.47 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 2kzz h GLU 557 CO 0.04 0.69 -0.15 1.49 -1.16 0.00 0.00 179.01 179.92 2kzz h GLU 558 N 1.07 0.60 0.00 2.33 4.81 -0.75 -2.57 114.58 120.08 2kzz h GLU 558 Ca 0.32 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2kzz h GLU 558 Cb -0.04 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2kzz h GLU 558 CO -0.10 0.73 0.00 -0.07 -0.73 0.00 0.00 179.01 178.84 2kzz h LEU 559 N 0.55 0.00 0.12 1.64 3.38 -0.50 -0.88 115.31 119.62 2kzz h LEU 559 Ca 0.09 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.81 2kzz h LEU 559 Cb 0.57 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.34 2kzz h LEU 559 CO 0.04 0.00 -1.05 0.74 0.09 0.00 0.00 178.44 178.25 2kzz h THR 560 N 0.00 1.37 -0.66 0.22 2.02 -1.03 -2.49 112.91 112.35 2kzz h THR 560 Ca 0.00 -2.44 -0.08 0.00 0.77 0.00 0.00 66.41 64.66 2kzz h THR 560 Cb 0.60 2.86 -0.03 0.00 -1.74 0.00 0.00 68.15 69.84 2kzz h THR 560 CO 0.00 0.72 0.10 -0.07 0.37 0.00 0.00 175.52 176.64 2kzz h LEU 561 N 0.03 1.05 -0.63 2.58 3.38 -1.29 -1.62 115.31 118.81 2kzz h LEU 561 Ca -0.17 -0.27 -0.15 0.00 0.09 0.00 0.00 57.88 57.39 2kzz h LEU 561 Cb 1.78 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.23 2kzz h LEU 561 CO 0.20 1.05 -0.65 0.03 0.09 0.00 0.00 178.44 179.17 2kzz h ARG 562 N 1.01 0.16 -0.15 1.13 3.08 -1.25 -2.01 114.38 116.35 2kzz h ARG 562 Ca 0.20 -0.12 -0.14 0.00 0.07 0.00 0.00 59.98 59.99 2kzz h ARG 562 Cb 0.45 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2kzz h ARG 562 CO 0.01 0.75 -0.51 -0.07 -1.07 0.00 0.00 179.97 179.08 2kzz h LEU 563 N 0.11 0.45 -0.21 3.04 3.38 -1.23 -1.75 115.31 119.10 2kzz h LEU 563 Ca -0.01 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2kzz h LEU 563 Cb 1.16 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 2kzz h LEU 563 CO 0.10 0.89 -0.07 0.00 0.09 0.00 0.00 178.44 179.44 2kzz h ALA 564 N 1.13 0.29 -0.44 1.53 0.00 -1.16 -2.72 119.26 117.89 2kzz h ALA 564 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2kzz h ALA 564 Cb 1.01 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2kzz h ALA 564 CO 0.09 0.10 0.29 0.93 0.00 0.00 0.00 179.25 180.65 2kzz h GLU 565 N 0.14 0.59 0.00 0.00 4.39 -1.28 -2.09 114.58 116.32 2kzz h GLU 565 Ca 0.05 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 2kzz h GLU 565 Cb 0.54 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2kzz h GLU 565 CO 0.03 0.41 -0.23 -0.07 -1.16 0.00 0.00 179.01 177.98 2kzz h LEU 566 N 0.60 0.00 -0.33 1.33 3.38 -1.35 0.10 115.31 119.03 2kzz h LEU 566 Ca 0.16 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.94 2kzz h LEU 566 Cb -0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2kzz h LEU 566 CO -0.03 0.23 -0.73 -0.08 0.09 0.00 0.00 178.44 177.91 2kzz h GLU 567 N 0.00 0.54 -0.29 1.13 4.81 -1.13 -1.75 114.58 117.89 2kzz h GLU 567 Ca -0.00 -0.44 -0.12 0.00 -0.13 0.00 0.00 59.36 58.67 2kzz h GLU 567 Cb 0.41 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 2kzz h GLU 567 CO 0.03 1.06 -0.29 0.87 -0.73 0.00 0.00 179.01 179.95 2kzz h LYS 568 N 0.37 0.71 -0.09 1.92 1.57 -0.75 -2.02 116.57 118.28 2kzz h LYS 568 Ca -0.03 -0.37 -0.03 0.00 -1.87 0.00 0.00 60.65 58.35 2kzz h LYS 568 Cb 1.32 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.64 2kzz h LYS 568 CO 0.13 0.99 -0.07 0.87 -0.57 0.00 0.00 179.45 180.81 2kzz h LYS 569 N 0.45 0.13 -0.02 3.15 1.57 -0.74 0.12 116.57 121.23 2kzz h LYS 569 Ca 0.05 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2kzz h LYS 569 Cb 0.86 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.15 2kzz h LYS 569 CO 0.07 0.21 -0.07 0.00 -0.57 0.00 0.00 179.45 179.09 2kzz h ALA 570 N 1.81 0.04 -0.78 3.86 0.00 -1.17 -2.82 119.26 120.20 2kzz h ALA 570 Ca 0.03 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.61 2kzz h ALA 570 Cb 0.21 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2kzz h ALA 570 CO 0.01 -0.09 0.51 0.45 0.00 0.00 0.00 179.25 180.13 2kzz h HIS 571 N -0.51 0.97 0.00 0.00 3.86 -0.88 -2.54 115.15 116.06 2kzz h HIS 571 Ca -0.00 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 2kzz h HIS 571 Cb 0.70 -0.33 -0.00 0.00 1.06 0.00 0.00 27.41 28.84 2kzz h HIS 571 CO 0.14 0.60 -0.09 1.49 0.86 0.00 0.00 177.93 180.93 2kzz h GLU 572 N 1.04 0.00 -0.14 2.45 4.81 -0.80 -2.71 114.58 119.23 2kzz h GLU 572 Ca 0.29 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.32 2kzz h GLU 572 Cb -0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2kzz h GLU 572 CO -0.07 0.09 -0.72 0.82 -0.73 0.00 0.00 179.01 178.40 2kzz h ILE 573 N 0.00 1.32 0.00 2.32 2.04 -1.18 -3.46 117.51 118.55 2kzz h ILE 573 Ca -0.00 -1.99 0.00 0.00 1.00 0.00 0.00 64.86 63.87 2kzz h ILE 573 Cb 0.23 1.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2kzz h ILE 573 CO 0.01 0.62 0.00 0.00 0.00 0.00 0.00 178.15 178.78 2kzz n ALA 574 N -2.56 0.00 -4.08 1.87 0.00 -1.03 -5.10 120.51 109.62 2kzz n ALA 574 Ca -0.06 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.19 2kzz n ALA 574 Cb 0.71 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.10 2kzz n ALA 574 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kzz n GLY 575 N 5.00 3.30 0.11 0.00 0.00 -1.19 -4.96 105.19 107.45 2kzz n GLY 575 Ca 0.00 -1.94 0.01 0.00 0.00 0.00 0.00 46.02 44.09 2kzz n GLY 575 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2kzz n GLU 576 N -0.58 -0.20 -3.93 1.61 0.28 -1.26 -4.86 120.64 111.70 2kzz n GLU 576 Ca 0.01 0.13 -0.23 0.00 -0.16 0.00 0.00 57.16 56.92 2kzz n GLU 576 Cb 0.46 -0.26 -0.02 0.00 1.43 0.00 0.00 31.44 33.05 2kzz n GLU 576 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2kzz s GLU 577 N -1.14 3.44 -0.12 3.44 8.01 -1.26 -4.68 118.70 126.40 2kzz s GLU 577 Ca 0.00 -0.69 -0.33 0.00 0.01 0.00 0.00 54.97 53.96 2kzz s GLU 577 Cb 0.00 -2.90 0.13 0.00 -4.31 0.00 0.00 34.13 27.05 2kzz s GLU 577 CO 0.00 0.44 1.22 -0.59 0.01 0.00 0.00 175.26 176.34 2kzz s PHE 578 N -1.92 -0.11 0.56 1.61 -0.71 -1.26 -5.14 117.98 111.01 2kzz s PHE 578 Ca 0.34 0.03 -0.10 0.00 -1.04 0.00 0.00 56.93 56.16 2kzz s PHE 578 Cb -0.10 0.53 -0.05 0.00 -1.21 0.00 0.00 43.02 42.20 2kzz s PHE 578 CO 0.29 -0.25 0.95 -0.80 -1.34 0.00 0.00 175.22 174.07 2kzz s ASN 579 N -2.47 6.30 -0.55 1.98 0.01 -1.26 -4.96 114.94 113.99 2kzz s ASN 579 Ca 0.11 1.30 -0.02 0.00 -0.71 0.00 0.00 52.86 53.54 2kzz s ASN 579 Cb 0.01 -2.41 0.30 0.00 0.41 0.00 0.00 41.25 39.56 2kzz s ASN 579 CO -0.04 -0.74 2.14 0.18 -1.51 0.00 0.00 177.10 177.13 2kzz n LEU 580 N -2.40 7.11 -4.45 0.60 7.99 -1.26 -4.67 117.00 119.92 2kzz n LEU 580 Ca 0.05 -4.01 -0.35 0.00 -0.01 0.00 0.00 56.01 51.69 2kzz n LEU 580 Cb 0.54 -1.05 -0.13 0.00 -0.11 0.00 0.00 43.42 42.67 2kzz n LEU 580 CO 0.55 1.47 -0.33 -0.94 -1.51 0.00 0.00 177.39 176.62 2kzz s SER 581 N -0.75 4.81 1.18 -1.43 1.04 -1.26 -4.95 113.70 112.33 2kzz s SER 581 Ca 0.51 -0.20 -0.15 0.00 0.48 0.00 0.00 55.95 56.59 2kzz s SER 581 Cb 0.39 -1.82 0.22 0.00 0.10 0.00 0.00 66.02 64.91 2kzz s SER 581 CO -0.10 0.07 0.78 -1.54 0.98 0.00 0.00 173.24 173.43 2kzz n SER 582 N 4.23 -1.75 -2.92 7.02 3.41 -1.26 -2.20 113.62 120.14 2kzz n SER 582 Ca -0.17 -0.98 -0.10 0.00 -0.26 0.00 0.00 58.87 57.35 2kzz n SER 582 Cb 0.52 -0.72 -0.02 0.00 -0.26 0.00 0.00 64.21 63.73 2kzz n SER 582 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2kzz n THR 583 N -4.17 -0.11 0.03 6.66 -2.24 -1.26 -4.39 114.28 108.80 2kzz n THR 583 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2kzz n THR 583 Cb 0.42 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 2kzz n THR 583 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2kzz n LYS 584 N -2.88 0.00 -0.00 -0.78 4.76 -1.25 -5.02 118.16 112.99 2kzz n LYS 584 Ca 0.01 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.52 2kzz n LYS 584 Cb 0.50 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.60 2kzz n LYS 584 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2kzz n GLN 585 N -2.58 1.02 -0.05 1.97 1.13 -0.93 -4.57 117.38 113.36 2kzz n GLN 585 Ca 0.00 -0.09 -0.16 0.00 -1.94 0.00 0.00 57.00 54.80 2kzz n GLN 585 Cb 0.00 -1.27 -0.13 0.00 0.11 0.00 0.00 30.24 28.95 2kzz n GLN 585 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2kzz h LEU 586 N 0.00 0.09 -1.02 1.08 3.38 -1.81 -3.35 115.31 113.67 2kzz h LEU 586 Ca 0.00 -0.91 0.05 0.00 0.09 0.00 0.00 57.88 57.11 2kzz h LEU 586 Cb 0.54 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 2kzz h LEU 586 CO 0.00 1.17 0.65 0.06 0.09 0.00 0.00 178.44 180.41 2kzz h GLN 587 N -0.87 1.21 0.00 1.13 3.07 -1.88 0.21 115.11 117.97 2kzz h GLN 587 Ca -0.09 -0.07 0.00 0.00 0.09 0.00 0.00 58.65 58.58 2kzz h GLN 587 Cb 1.18 -0.27 0.00 0.00 0.08 0.00 0.00 27.48 28.47 2kzz h GLN 587 CO -0.01 0.80 0.00 0.25 0.09 0.00 0.00 178.83 179.96 2kzz n THR 588 N -4.46 1.27 0.00 1.86 -2.24 -1.26 -3.12 114.28 106.34 2kzz n THR 588 Ca 0.14 0.32 -0.00 0.00 -2.27 0.00 0.00 64.05 62.23 2kzz n THR 588 Cb 0.12 -1.15 -0.00 0.00 -2.10 0.00 0.00 70.33 67.20 2kzz n THR 588 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2kzz n ILE 589 N -1.47 0.22 -0.40 2.28 2.08 -0.52 -4.55 119.36 117.00 2kzz n ILE 589 Ca 0.03 0.19 -0.06 0.00 0.56 0.00 0.00 62.75 63.47 2kzz n ILE 589 Cb 0.11 -1.27 -0.02 0.00 -0.75 0.00 0.00 39.64 37.70 2kzz n ILE 589 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2kzz h LEU 590 N -0.05 -1.77 0.00 1.39 3.38 -0.73 -0.86 115.31 116.66 2kzz h LEU 590 Ca 0.00 0.32 -0.05 0.00 0.09 0.00 0.00 57.88 58.24 2kzz h LEU 590 Cb 0.05 0.85 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2kzz h LEU 590 CO 0.00 -0.26 -1.09 -0.26 0.09 0.00 0.00 178.44 176.92 2kzz h PHE 591 N -0.01 0.00 0.00 1.13 0.04 -1.74 -3.29 116.94 113.07 2kzz h PHE 591 Ca 0.26 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.03 2kzz h PHE 591 Cb 0.51 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.66 2kzz h PHE 591 CO -0.94 0.16 0.00 1.49 -0.60 0.00 0.00 178.31 178.42 2kzz h GLU 592 N 0.00 0.00 -0.16 1.51 4.22 -1.47 -2.54 114.58 116.14 2kzz h GLU 592 Ca -0.04 0.00 -0.10 0.00 0.08 0.00 0.00 59.36 59.29 2kzz h GLU 592 Cb 1.17 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.34 2kzz h GLU 592 CO 0.01 0.00 -0.46 0.36 -2.18 0.00 0.00 179.01 176.74 2kzz n LYS 593 N -2.35 1.89 0.00 1.92 2.85 -0.39 -5.02 118.16 117.06 2kzz n LYS 593 Ca 0.03 -3.40 0.00 0.00 -1.05 0.00 0.00 58.31 53.89 2kzz n LYS 593 Cb 0.27 -1.74 0.00 0.00 -0.65 0.00 0.00 35.03 32.92 2kzz n LYS 593 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 2kzz n GLN 594 N -1.07 0.00 -1.27 -1.58 7.27 -0.96 -5.01 117.38 114.75 2kzz n GLN 594 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.32 2kzz n GLN 594 Cb 0.78 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.43 2kzz n GLN 594 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2kzz n GLY 595 N 0.26 0.36 2.96 1.69 0.00 -1.26 -4.37 105.19 104.83 2kzz n GLY 595 Ca 0.00 -1.67 -0.28 0.00 0.00 0.00 0.00 46.02 44.07 2kzz n GLY 595 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kzz s ILE 596 N -2.61 1.28 0.00 -0.61 1.01 -1.26 -4.87 121.20 114.14 2kzz s ILE 596 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.20 2kzz s ILE 596 Cb 0.00 -1.25 0.00 0.00 0.01 0.00 0.00 42.46 41.22 2kzz s ILE 596 CO 0.00 0.41 0.00 2.29 0.00 0.00 0.00 174.94 177.64 2kzz n LYS 597 N 4.84 0.00 -0.71 2.79 2.85 -1.26 -4.83 118.16 121.84 2kzz n LYS 597 Ca -0.15 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.79 2kzz n LYS 597 Cb 0.50 0.00 0.16 0.00 -0.65 0.00 0.00 35.03 35.04 2kzz n LYS 597 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 2kzz n PRO 598 N -0.36 -0.92 -0.76 -1.58 -0.02 -1.26 -5.00 135.00 125.11 2kzz n PRO 598 Ca 0.00 -0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.25 2kzz n PRO 598 Cb 0.00 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 2kzz n PRO 598 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 2kzz n LEU 599 N -2.23 0.00 -3.67 2.45 -0.00 -1.26 -5.03 117.00 107.26 2kzz n LEU 599 Ca 0.05 0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.82 2kzz n LEU 599 Cb 0.56 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.81 2kzz n LEU 599 CO 0.51 -0.31 -0.35 -0.54 -0.00 0.00 0.00 177.39 176.71 2kzz s LYS 600 N -0.52 0.21 0.36 1.47 1.02 -1.26 -4.70 119.74 116.33 2kzz s LYS 600 Ca 0.00 -0.02 -0.28 0.00 0.02 0.00 0.00 55.97 55.69 2kzz s LYS 600 Cb 0.00 -1.49 -0.10 0.00 -0.52 0.00 0.00 37.83 35.72 2kzz s LYS 600 CO 0.00 -0.55 1.40 0.15 -0.92 0.00 0.00 175.35 175.43 2kzz s LYS 601 N 2.07 4.19 -0.34 1.68 3.01 -1.26 -4.96 119.74 124.12 2kzz s LYS 601 Ca 0.02 2.40 -0.01 0.00 -1.01 0.00 0.00 55.97 57.38 2kzz s LYS 601 Cb -0.15 -2.99 0.26 0.00 -1.01 0.00 0.00 37.83 33.94 2kzz s LYS 601 CO -0.07 -0.40 1.95 -2.37 0.51 0.00 0.00 175.35 174.97 2kzz n THR 602 N 0.56 2.78 0.00 2.17 5.66 -1.26 -4.59 114.28 119.60 2kzz n THR 602 Ca 0.01 -1.70 0.00 0.00 -3.05 0.00 0.00 64.05 59.31 2kzz n THR 602 Cb 0.41 -1.23 0.00 0.00 -1.55 0.00 0.00 70.33 67.95 2kzz n THR 602 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2kzz n PRO 607 N 0.12 0.00 -0.08 1.09 -0.01 -1.26 -4.87 135.00 129.98 2kzz n PRO 607 Ca 0.34 0.00 -0.16 0.00 -0.01 0.00 0.00 63.50 63.66 2kzz n PRO 607 Cb 0.66 -0.18 -0.11 0.00 -0.01 0.00 0.00 33.50 33.86 2kzz n PRO 607 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 175.50 176.15 2kzz h SER 608 N 0.00 0.00 -0.27 2.55 4.64 -1.83 -3.18 113.55 115.46 2kzz h SER 608 Ca 0.00 -0.71 -0.18 0.00 -0.47 0.00 0.00 61.79 60.42 2kzz h SER 608 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 2kzz h SER 608 CO 0.00 1.17 0.20 0.35 -0.87 0.00 0.00 176.83 177.68 2kzz n THR 609 N -4.54 2.47 0.00 2.95 -2.24 -1.26 -3.28 114.28 108.38 2kzz n THR 609 Ca -0.19 -1.20 0.00 0.00 -2.27 0.00 0.00 64.05 60.39 2kzz n THR 609 Cb 0.53 -1.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.31 2kzz n THR 609 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2kzz n SER 610 N 0.98 0.00 -3.37 3.42 7.64 -1.26 -4.93 113.62 116.10 2kzz n SER 610 Ca 0.18 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.89 2kzz n SER 610 Cb 0.56 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.68 2kzz n SER 610 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2kzz s GLU 611 N -1.00 0.59 -0.91 1.43 2.02 -1.20 -4.73 118.70 114.90 2kzz s GLU 611 Ca 0.00 -0.76 -0.02 0.00 0.02 0.00 0.00 54.97 54.21 2kzz s GLU 611 Cb 0.00 -0.72 0.22 0.00 0.10 0.00 0.00 34.13 33.73 2kzz s GLU 611 CO 0.00 -1.17 0.81 -1.21 0.02 0.00 0.00 175.26 173.71 2kzz s GLU 612 N 1.57 3.35 0.40 1.61 0.41 -1.25 -4.56 118.70 120.22 2kzz s GLU 612 Ca 0.16 -3.29 0.22 0.00 -0.41 0.00 0.00 54.97 51.65 2kzz s GLU 612 Cb -0.15 -4.00 1.22 0.00 -1.78 0.00 0.00 34.13 29.42 2kzz s GLU 612 CO -0.08 -1.26 1.69 0.28 -0.49 0.00 0.00 175.26 175.40 2kzz h VAL 613 N 4.03 0.32 -0.78 2.63 2.07 -1.93 -1.79 116.25 120.79 2kzz h VAL 613 Ca 0.16 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.57 2kzz h VAL 613 Cb 0.81 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 2kzz h VAL 613 CO 0.87 0.05 0.39 -0.07 0.02 0.00 0.00 177.57 178.83 2kzz h LEU 614 N 0.26 1.01 -0.06 2.57 3.38 -1.91 -2.94 115.31 117.62 2kzz h LEU 614 Ca 0.71 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.56 2kzz h LEU 614 Cb 1.95 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.44 2kzz h LEU 614 CO -0.41 0.85 -0.11 -1.84 0.09 0.00 0.00 178.44 177.02 2kzz n GLU 615 N -4.38 0.27 -0.04 1.13 0.28 -0.67 -2.66 120.64 114.56 2kzz n GLU 615 Ca 0.07 -0.06 -0.14 0.00 -0.16 0.00 0.00 57.16 56.87 2kzz n GLU 615 Cb 0.13 -1.50 -0.12 0.00 1.43 0.00 0.00 31.44 31.38 2kzz n GLU 615 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2kzz h GLU 616 N 0.15 0.02 -0.38 3.44 3.07 -1.52 -3.18 114.58 116.18 2kzz h GLU 616 Ca 0.00 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.83 2kzz h GLU 616 Cb 0.42 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.32 2kzz h GLU 616 CO 0.00 0.78 0.20 -0.07 -1.40 0.00 0.00 179.01 178.52 2kzz h LEU 617 N -0.72 0.46 -1.17 1.33 3.38 -1.59 -2.51 115.31 114.48 2kzz h LEU 617 Ca -0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2kzz h LEU 617 Cb 0.79 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2kzz h LEU 617 CO 0.01 0.38 0.37 0.00 0.09 0.00 0.00 178.44 179.28 2kzz h ALA 618 N 1.70 1.30 0.00 1.53 0.00 -1.48 0.87 119.26 123.18 2kzz h ALA 618 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2kzz h ALA 618 Cb 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2kzz h ALA 618 CO -0.02 -0.30 -0.51 -0.07 0.00 0.00 0.00 179.25 178.35 2kzz h LEU 619 N 0.00 0.00 0.00 0.00 -0.00 -1.58 -3.41 115.31 110.32 2kzz h LEU 619 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2kzz h LEU 619 Cb 0.73 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.39 2kzz h LEU 619 CO 0.00 0.51 -0.47 -0.90 -0.00 0.00 0.00 178.44 177.58 2kzz n ASP 620 N -3.62 0.38 -4.72 -0.43 5.68 0.21 -5.07 116.55 108.98 2kzz n ASP 620 Ca -0.00 0.00 -0.42 0.00 -0.50 0.00 0.00 54.79 53.87 2kzz n ASP 620 Cb 0.58 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.53 2kzz n ASP 620 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 2kzz s TYR 621 N -1.89 3.29 -0.11 2.11 2.02 0.28 -4.99 117.35 118.05 2kzz s TYR 621 Ca 0.00 1.07 -0.27 0.00 -0.37 0.00 0.00 57.07 57.51 2kzz s TYR 621 Cb 0.00 -3.61 -0.28 0.00 -0.40 0.00 0.00 41.96 37.67 2kzz s TYR 621 CO 0.00 -2.06 0.80 -1.00 -1.57 0.00 0.00 175.55 171.72 2kzz h PRO 622 N 6.53 0.10 -0.14 -1.71 0.13 -1.89 -3.34 132.00 131.67 2kzz h PRO 622 Ca -0.42 -0.17 0.05 0.00 -0.87 0.00 0.00 66.00 64.59 2kzz h PRO 622 Cb 1.21 0.06 -0.06 0.00 0.13 0.00 0.00 31.00 32.34 2kzz h PRO 622 CO 0.84 1.08 -0.25 1.25 -0.23 0.00 0.00 178.00 180.68 2kzz h LEU 623 N -0.79 -0.79 -1.86 1.56 5.85 -1.95 -1.95 115.31 115.37 2kzz h LEU 623 Ca -0.05 0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.87 2kzz h LEU 623 Cb 1.22 0.35 -0.02 0.00 0.37 0.00 0.00 40.66 42.58 2kzz h LEU 623 CO 0.05 -0.30 0.26 1.55 -0.34 0.00 0.00 178.44 179.66 2kzz h PRO 624 N -0.31 0.16 -0.29 5.25 0.13 -1.87 -2.00 132.00 133.07 2kzz h PRO 624 Ca 0.10 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 2kzz h PRO 624 Cb 0.47 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.55 2kzz h PRO 624 CO -0.33 0.11 0.15 -0.22 -0.23 0.00 0.00 178.00 177.48 2kzz h LYS 625 N 0.17 0.42 0.00 0.86 3.64 -1.53 -0.91 116.57 119.23 2kzz h LYS 625 Ca 0.17 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.42 2kzz h LYS 625 Cb 0.47 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2kzz h LYS 625 CO -0.03 0.39 -0.36 -0.39 -2.27 0.00 0.00 179.45 176.79 2kzz h VAL 626 N 0.34 0.97 0.02 2.00 -1.51 -1.07 -2.21 116.25 114.80 2kzz h VAL 626 Ca 0.10 -1.38 -0.22 0.00 -1.23 0.00 0.00 66.70 63.97 2kzz h VAL 626 Cb 0.10 1.81 -0.00 0.00 -2.13 0.00 0.00 31.29 31.07 2kzz h VAL 626 CO -0.01 0.35 -0.95 0.40 -1.23 0.00 0.00 177.57 176.13 2kzz h ILE 627 N 0.00 1.46 0.63 7.19 2.04 -1.20 -2.17 117.51 125.46 2kzz h ILE 627 Ca -0.00 -2.61 -0.03 0.00 1.00 0.00 0.00 64.86 63.22 2kzz h ILE 627 Cb 0.78 2.51 0.01 0.00 -0.74 0.00 0.00 36.82 39.38 2kzz h ILE 627 CO 0.05 0.77 -0.30 0.25 0.00 0.00 0.00 178.15 178.91 2kzz h LEU 628 N 0.16 -0.72 -2.98 1.44 5.85 -0.91 -2.63 115.31 115.52 2kzz h LEU 628 Ca -0.07 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 2kzz h LEU 628 Cb 1.60 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.82 2kzz h LEU 628 CO 0.16 -0.50 -0.00 -0.08 -0.34 0.00 0.00 178.44 177.67 2kzz h GLU 629 N -0.88 0.00 0.26 1.25 4.22 -1.49 -2.91 114.58 115.03 2kzz h GLU 629 Ca -0.09 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.34 2kzz h GLU 629 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2kzz h GLU 629 CO 0.14 0.00 -0.12 -0.92 -2.18 0.00 0.00 179.01 175.93 2kzz h TYR 630 N 0.00 -0.32 -0.71 0.92 3.20 -1.18 -3.07 116.97 115.81 2kzz h TYR 630 Ca -0.00 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.00 2kzz h TYR 630 Cb 0.00 0.11 -0.13 0.00 1.54 0.00 0.00 36.73 38.25 2kzz h TYR 630 CO 0.00 -0.20 -0.22 0.00 -1.64 0.00 0.00 178.16 176.10 2kzz h ARG 631 N -0.76 -0.03 -0.54 1.82 3.08 -1.28 0.21 114.38 116.87 2kzz h ARG 631 Ca -0.04 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.10 2kzz h ARG 631 Cb 0.27 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.26 2kzz h ARG 631 CO 0.06 -0.02 0.17 0.78 -1.07 0.00 0.00 179.97 179.88 2kzz h GLY 632 N -0.03 0.72 1.24 0.04 0.00 -1.66 -0.49 103.07 102.88 2kzz h GLY 632 Ca 0.33 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.51 2kzz h GLY 632 CO -0.75 -0.03 0.08 1.41 0.00 0.00 0.00 176.54 177.25 2kzz h LEU 633 N 0.33 0.89 -0.83 3.11 3.38 -0.90 -2.23 115.31 119.06 2kzz h LEU 633 Ca 0.27 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2kzz h LEU 633 Cb 0.34 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2kzz h LEU 633 CO -0.30 0.91 0.04 0.00 0.09 0.00 0.00 178.44 179.17 2kzz h ALA 634 N 1.20 1.02 0.78 1.53 0.00 -0.21 -1.61 119.26 121.98 2kzz h ALA 634 Ca 0.18 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2kzz h ALA 634 Cb 0.41 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.99 2kzz h ALA 634 CO 0.01 0.61 -0.38 -0.22 0.00 0.00 0.00 179.25 179.28 2kzz h LYS 635 N 0.86 -1.01 -0.97 0.00 3.64 -0.94 -3.14 116.57 115.01 2kzz h LYS 635 Ca 0.17 0.07 0.17 0.00 -1.27 0.00 0.00 60.65 59.79 2kzz h LYS 635 Cb 0.45 0.23 -0.09 0.00 -0.41 0.00 0.00 32.23 32.41 2kzz h LYS 635 CO 0.02 -0.66 0.61 1.25 -2.27 0.00 0.00 179.45 178.39 2kzz h LEU 636 N -1.22 0.71 0.38 5.20 5.85 -1.38 -1.10 115.31 123.75 2kzz h LEU 636 Ca -0.11 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2kzz h LEU 636 Cb 0.82 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.79 2kzz h LEU 636 CO 0.18 0.30 -0.18 0.50 -0.34 0.00 0.00 178.44 178.90 2kzz h LYS 637 N 0.72 -0.49 0.00 1.25 3.64 -1.30 -1.74 116.57 118.65 2kzz h LYS 637 Ca 0.52 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.86 2kzz h LYS 637 Cb 0.85 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.77 2kzz h LYS 637 CO -0.29 -0.23 -0.37 0.66 -2.27 0.00 0.00 179.45 176.95 2kzz h SER 638 N -0.69 0.00 -0.02 4.20 4.64 -1.45 -0.36 113.55 119.87 2kzz h SER 638 Ca -0.05 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.17 2kzz h SER 638 Cb 0.49 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.59 2kzz h SER 638 CO 0.09 0.37 -0.36 0.74 -0.87 0.00 0.00 176.83 176.80 2kzz h THR 639 N 0.00 1.48 0.00 2.95 2.02 -1.17 -3.34 112.91 114.86 2kzz h THR 639 Ca -0.00 -1.92 -0.03 0.00 0.77 0.00 0.00 66.41 65.23 2kzz h THR 639 Cb 0.88 2.60 -0.00 0.00 -1.74 0.00 0.00 68.15 69.88 2kzz h THR 639 CO 0.05 0.54 -0.98 -1.22 0.37 0.00 0.00 175.52 174.28 2kzz n TYR 640 N -4.41 0.00 -0.35 3.16 4.01 -0.66 -4.30 117.16 114.61 2kzz n TYR 640 Ca -0.10 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.71 2kzz n TYR 640 Cb 0.55 -0.06 0.25 0.00 -0.31 0.00 0.00 39.34 39.76 2kzz n TYR 640 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2kzz h THR 641 N -0.07 0.95 0.00 -0.72 2.02 -1.42 0.16 112.91 113.83 2kzz h THR 641 Ca -0.04 -0.34 -0.26 0.00 0.77 0.00 0.00 66.41 66.54 2kzz h THR 641 Cb 0.92 -0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 2kzz h THR 641 CO -0.03 0.18 -1.69 0.47 0.37 0.00 0.00 175.52 174.83 2kzz n ASP 642 N -4.58 0.78 -0.06 4.18 8.00 -0.18 -4.51 116.55 120.17 2kzz n ASP 642 Ca 0.18 0.36 -0.07 0.00 0.71 0.00 0.00 54.79 55.97 2kzz n ASP 642 Cb 0.33 0.13 -0.07 0.00 -0.02 0.00 0.00 41.12 41.49 2kzz n ASP 642 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2kzz h LYS 643 N 0.00 0.00 -0.92 -1.24 1.79 -1.60 -3.40 116.57 111.20 2kzz h LYS 643 Ca -0.27 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.31 2kzz h LYS 643 Cb 1.89 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 32.42 2kzz h LYS 643 CO 0.06 0.51 -0.48 1.28 -1.08 0.00 0.00 179.45 179.75 2kzz n LEU 644 N -4.69 -0.84 0.29 2.94 4.32 0.52 -1.03 117.00 118.51 2kzz n LEU 644 Ca -0.05 1.63 0.19 0.00 -0.02 0.00 0.00 56.01 57.75 2kzz n LEU 644 Cb 0.25 -0.27 0.98 0.00 -1.62 0.00 0.00 43.42 42.75 2kzz n LEU 644 CO 0.17 -1.38 1.16 -0.65 -1.22 0.00 0.00 177.39 175.48 2kzz h PRO 645 N 0.00 0.00 -0.00 3.23 0.11 -1.78 0.28 132.00 133.84 2kzz h PRO 645 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 2kzz h PRO 645 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 2kzz h PRO 645 CO -0.88 0.00 -0.20 1.28 -0.21 0.00 0.00 178.00 177.99 2kzz n LEU 646 N -3.30 0.51 -0.45 2.35 4.32 -0.20 -3.58 117.00 116.64 2kzz n LEU 646 Ca -0.01 0.03 0.12 0.00 -0.02 0.00 0.00 56.01 56.13 2kzz n LEU 646 Cb 0.23 -0.23 0.24 0.00 -1.62 0.00 0.00 43.42 42.04 2kzz n LEU 646 CO 0.21 0.10 0.56 0.23 -1.22 0.00 0.00 177.39 177.28 2kzz n MET 647 N -1.08 1.26 -2.02 3.23 2.81 0.09 -4.91 117.12 116.50 2kzz n MET 647 Ca 0.11 -0.90 -0.42 0.00 -1.81 0.00 0.00 57.70 54.68 2kzz n MET 647 Cb 0.31 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.31 2kzz n MET 647 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2kzz s ILE 648 N -2.36 2.77 -0.23 2.02 1.01 -1.23 -4.52 121.20 118.65 2kzz s ILE 648 Ca 0.25 0.60 -0.23 0.00 0.00 0.00 0.00 60.65 61.26 2kzz s ILE 648 Cb 0.19 -3.38 -0.01 0.00 0.01 0.00 0.00 42.46 39.27 2kzz s ILE 648 CO 0.49 0.07 0.76 0.21 0.00 0.00 0.00 174.94 176.46 2kzz s ASN 649 N 0.78 6.77 0.48 3.58 3.84 -0.56 -4.94 114.94 124.89 2kzz s ASN 649 Ca 0.64 0.95 0.23 0.00 0.21 0.00 0.00 52.86 54.89 2kzz s ASN 649 Cb -0.41 -2.40 1.26 0.00 -0.55 0.00 0.00 41.25 39.14 2kzz s ASN 649 CO 0.36 -0.44 1.91 -0.65 -2.79 0.00 0.00 177.10 175.50 2kzz h PRO 650 N 7.66 0.20 0.01 0.43 0.11 -1.92 1.31 132.00 139.80 2kzz h PRO 650 Ca -0.26 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 65.61 2kzz h PRO 650 Cb 1.11 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2kzz h PRO 650 CO 0.83 0.13 -0.97 -0.22 -0.21 0.00 0.00 178.00 177.57 2kzz h LYS 651 N 0.20 0.38 0.00 1.05 3.64 -1.96 -3.38 116.57 116.51 2kzz h LYS 651 Ca 0.38 -0.43 -0.13 0.00 -1.27 0.00 0.00 60.65 59.20 2kzz h LYS 651 Cb 1.19 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 2kzz h LYS 651 CO -0.08 1.11 -1.59 0.25 -2.27 0.00 0.00 179.45 176.87 2kzz n THR 652 N -3.72 0.48 -1.05 1.00 -2.24 -0.81 -4.99 114.28 102.95 2kzz n THR 652 Ca -0.07 -0.35 -0.02 0.00 -2.27 0.00 0.00 64.05 61.35 2kzz n THR 652 Cb 0.85 -0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 68.56 2kzz n THR 652 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kzz n GLY 653 N 2.31 0.53 3.40 3.38 0.00 0.44 -5.00 105.19 110.26 2kzz n GLY 653 Ca -0.12 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 45.13 2kzz n GLY 653 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kzz s ARG 654 N -1.43 1.51 -0.16 1.61 0.52 -1.25 -4.66 118.95 115.09 2kzz s ARG 654 Ca 0.00 -1.79 -0.11 0.00 -0.52 0.00 0.00 55.73 53.31 2kzz s ARG 654 Cb 0.00 -0.89 -0.05 0.00 0.52 0.00 0.00 34.95 34.54 2kzz s ARG 654 CO 0.00 -0.08 0.21 0.08 0.02 0.00 0.00 175.30 175.53 2kzz s VAL 655 N -3.24 5.36 -0.38 3.52 1.01 -0.01 -1.49 120.40 125.17 2kzz s VAL 655 Ca 0.31 0.37 -0.00 0.00 0.00 0.00 0.00 61.98 62.66 2kzz s VAL 655 Cb 0.06 -3.53 0.11 0.00 0.00 0.00 0.00 36.38 33.01 2kzz s VAL 655 CO 0.12 0.46 0.15 -1.00 0.00 0.00 0.00 175.10 174.83 2kzz s HIS 656 N 0.05 3.66 0.64 5.22 0.09 -1.26 -0.71 115.29 122.97 2kzz s HIS 656 Ca 0.13 -2.64 -0.14 0.00 -0.00 0.00 0.00 55.06 52.42 2kzz s HIS 656 Cb -0.12 -3.12 -0.02 0.00 -0.00 0.00 0.00 32.58 29.33 2kzz s HIS 656 CO 0.02 -0.96 1.06 -0.08 -0.00 0.00 0.00 174.74 174.78 2kzz s THR 657 N 1.04 3.89 -0.37 1.30 -1.32 -1.26 -4.82 115.64 114.11 2kzz s THR 657 Ca 0.09 0.77 -0.12 0.00 -1.21 0.00 0.00 61.69 61.22 2kzz s THR 657 Cb -0.21 -3.38 0.01 0.00 -1.51 0.00 0.00 72.50 67.41 2kzz s THR 657 CO -0.06 -0.65 0.22 -0.44 -2.21 0.00 0.00 174.62 171.48 2kzz s SER 658 N -3.22 5.83 0.07 8.08 0.01 -0.59 -4.77 113.70 119.11 2kzz s SER 658 Ca 0.61 -0.81 -0.19 0.00 1.31 0.00 0.00 55.95 56.88 2kzz s SER 658 Cb -0.15 -2.07 -0.07 0.00 0.21 0.00 0.00 66.02 63.95 2kzz s SER 658 CO 0.45 -0.35 0.55 -0.31 0.41 0.00 0.00 173.24 173.99 2kzz s TYR 659 N 1.62 3.79 -0.23 2.43 2.02 -1.26 -1.30 117.35 124.42 2kzz s TYR 659 Ca 0.04 1.23 -0.02 0.00 -0.37 0.00 0.00 57.07 57.95 2kzz s TYR 659 Cb -0.18 -2.47 0.01 0.00 -0.40 0.00 0.00 41.96 38.92 2kzz s TYR 659 CO 0.08 0.59 -0.07 -1.01 -1.57 0.00 0.00 175.55 173.57 2kzz s HIS 660 N -1.12 2.99 -0.15 2.71 3.76 -0.75 -4.98 115.29 117.75 2kzz s HIS 660 Ca 0.29 -1.33 0.17 0.00 -0.15 0.00 0.00 55.06 54.03 2kzz s HIS 660 Cb -0.19 -2.06 -0.04 0.00 1.11 0.00 0.00 32.58 31.40 2kzz s HIS 660 CO 0.18 -0.67 1.10 0.37 -0.85 0.00 0.00 174.74 174.87 2kzz h GLN 661 N 8.05 0.00 -1.76 1.40 4.15 -1.94 -2.99 115.11 122.02 2kzz h GLN 661 Ca -0.37 0.00 -0.60 0.00 0.77 0.00 0.00 58.65 58.44 2kzz h GLN 661 Cb 1.13 0.00 -0.41 0.00 0.21 0.00 0.00 27.48 28.41 2kzz h GLN 661 CO 0.59 0.34 -0.59 0.00 -1.93 0.00 0.00 178.83 177.25 2kzz n ALA 662 N -2.30 5.06 -0.00 3.38 0.00 -1.26 -4.76 120.51 120.62 2kzz n ALA 662 Ca -0.04 -4.43 -0.00 0.00 0.00 0.00 0.00 53.44 48.97 2kzz n ALA 662 Cb 0.77 -0.69 -0.00 0.00 0.00 0.00 0.00 19.45 19.53 2kzz n ALA 662 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2kzz n VAL 663 N -0.41 0.02 -2.05 0.00 0.31 -1.26 -4.73 118.33 110.20 2kzz n VAL 663 Ca 0.38 -0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.37 2kzz n VAL 663 Cb 0.56 -1.07 0.01 0.00 -0.91 0.00 0.00 33.84 32.43 2kzz n VAL 663 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2kzz s THR 664 N -2.01 3.72 0.16 2.52 -4.23 -1.26 -4.96 115.64 109.58 2kzz s THR 664 Ca -0.00 0.83 0.03 0.00 -1.18 0.00 0.00 61.69 61.37 2kzz s THR 664 Cb 0.00 -3.35 -0.16 0.00 1.34 0.00 0.00 72.50 70.33 2kzz s THR 664 CO 0.01 -0.46 1.35 0.00 -0.54 0.00 0.00 174.62 174.98 2kzz h ALA 665 N 0.48 0.48 0.00 3.99 0.00 -1.91 -3.30 119.26 119.00 2kzz h ALA 665 Ca -0.47 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 53.68 2kzz h ALA 665 Cb 1.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2kzz h ALA 665 CO 0.57 0.97 -0.69 1.79 0.00 0.00 0.00 179.25 181.89 2kzz h THR 666 N 0.08 0.00 0.00 0.00 1.35 -1.94 -3.45 112.91 108.95 2kzz h THR 666 Ca -0.04 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 2kzz h THR 666 Cb 1.57 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.51 2kzz h THR 666 CO 0.14 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 2kzz n GLY 667 N 1.20 0.74 3.79 5.82 0.00 -1.24 -3.97 105.19 111.52 2kzz n GLY 667 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 2kzz n GLY 667 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kzz s ARG 668 N -0.57 4.50 0.30 1.61 0.52 -1.26 -4.77 118.95 119.28 2kzz s ARG 668 Ca 0.00 1.27 -0.29 0.00 -0.52 0.00 0.00 55.73 56.19 2kzz s ARG 668 Cb 0.00 -2.66 -0.10 0.00 0.52 0.00 0.00 34.95 32.71 2kzz s ARG 668 CO 0.00 0.21 1.17 -0.51 0.02 0.00 0.00 175.30 176.19 2kzz s LEU 669 N -2.30 4.51 0.55 2.53 1.43 -1.26 -4.25 118.68 119.88 2kzz s LEU 669 Ca 0.53 2.42 0.07 0.00 -1.03 0.00 0.00 54.13 56.11 2kzz s LEU 669 Cb -0.16 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.48 2kzz s LEU 669 CO 0.21 -0.28 0.55 -0.94 0.23 0.00 0.00 176.35 176.12 2kzz s SER 670 N -0.74 4.82 0.03 2.29 1.04 -1.13 -4.94 113.70 115.07 2kzz s SER 670 Ca 0.46 -1.09 -0.16 0.00 0.48 0.00 0.00 55.95 55.64 2kzz s SER 670 Cb -0.35 0.35 0.03 0.00 0.10 0.00 0.00 66.02 66.15 2kzz s SER 670 CO 0.45 -1.18 0.35 -0.55 0.98 0.00 0.00 173.24 173.29 2kzz s SER 671 N -4.42 -0.21 0.18 7.02 0.15 -1.26 -1.82 113.70 113.35 2kzz s SER 671 Ca 0.45 -0.04 -0.15 0.00 0.70 0.00 0.00 55.95 56.90 2kzz s SER 671 Cb -0.04 0.38 0.02 0.00 -1.71 0.00 0.00 66.02 64.67 2kzz s SER 671 CO 0.28 -0.60 0.45 0.42 1.20 0.00 0.00 173.24 174.99 2kzz s THR 672 N -2.24 0.04 -0.97 6.45 -4.23 -0.42 -4.48 115.64 109.80 2kzz s THR 672 Ca -0.07 -0.95 -0.22 0.00 -1.18 0.00 0.00 61.69 59.27 2kzz s THR 672 Cb -0.02 -1.64 0.03 0.00 1.34 0.00 0.00 72.50 72.21 2kzz s THR 672 CO -0.01 -0.18 0.58 0.47 -0.54 0.00 0.00 174.62 174.94 2kzz n ASP 673 N -0.30 -3.77 -4.97 3.99 8.00 -1.26 -1.53 116.55 116.70 2kzz n ASP 673 Ca -0.09 -1.08 -0.21 0.00 0.71 0.00 0.00 54.79 54.12 2kzz n ASP 673 Cb 0.63 -1.39 -0.01 0.00 -0.02 0.00 0.00 41.12 40.33 2kzz n ASP 673 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2kzz s PRO 674 N -6.47 3.30 -1.00 -0.24 0.04 -1.26 -4.08 135.00 125.30 2kzz s PRO 674 Ca 0.31 -0.72 -0.20 0.00 0.04 0.00 0.00 61.00 60.43 2kzz s PRO 674 Cb -0.17 -2.78 0.10 0.00 0.04 0.00 0.00 34.50 31.68 2kzz s PRO 674 CO 0.84 0.18 1.30 1.21 0.04 0.00 0.00 177.00 180.57 2kzz s ASN 675 N -4.08 6.60 0.51 6.66 3.84 -1.26 -4.69 114.94 122.52 2kzz s ASN 675 Ca 0.40 -1.85 0.24 0.00 0.21 0.00 0.00 52.86 51.86 2kzz s ASN 675 Cb -0.09 -2.48 1.33 0.00 -0.55 0.00 0.00 41.25 39.46 2kzz s ASN 675 CO 0.32 -1.24 1.96 -0.07 -2.79 0.00 0.00 177.10 175.28 2kzz h LEU 676 N 11.48 0.09 -0.12 3.21 4.07 -1.90 -2.38 115.31 129.76 2kzz h LEU 676 Ca 0.19 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2kzz h LEU 676 Cb 1.00 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.73 2kzz h LEU 676 CO 1.26 0.05 0.00 0.00 -1.08 0.00 0.00 178.44 178.67 2kzz n GLN 677 N -4.39 0.04 -0.17 1.13 6.02 -1.26 -2.52 117.38 116.22 2kzz n GLN 677 Ca 0.12 0.27 0.12 0.00 -0.01 0.00 0.00 57.00 57.50 2kzz n GLN 677 Cb 0.65 -1.57 0.21 0.00 1.02 0.00 0.00 30.24 30.54 2kzz n GLN 677 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2kzz n ASN 678 N -1.64 3.43 -4.59 1.08 3.02 -0.89 -4.86 115.26 110.80 2kzz n ASN 678 Ca 0.03 -2.00 -0.43 0.00 -0.03 0.00 0.00 54.58 52.16 2kzz n ASN 678 Cb 0.19 -0.23 -0.02 0.00 -0.61 0.00 0.00 39.78 39.11 2kzz n ASN 678 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2kzz s ILE 679 N -1.54 4.03 0.06 2.41 1.01 -1.05 -4.95 121.20 121.17 2kzz s ILE 679 Ca 0.38 1.02 -0.34 0.00 0.00 0.00 0.00 60.65 61.71 2kzz s ILE 679 Cb 0.23 -4.48 -0.18 0.00 0.01 0.00 0.00 42.46 38.04 2kzz s ILE 679 CO 0.32 -1.00 0.86 -2.65 0.00 0.00 0.00 174.94 172.46 2kzz n PRO 680 N 8.10 0.00 -0.00 2.79 -0.02 -1.26 -4.96 135.00 139.65 2kzz n PRO 680 Ca 0.13 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2kzz n PRO 680 Cb 0.49 -1.28 -0.00 0.00 -0.02 0.00 0.00 33.50 32.69 2kzz n PRO 680 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2kzz n VAL 681 N 0.99 0.09 -2.83 -1.45 0.31 -1.26 -4.31 118.33 109.87 2kzz n VAL 681 Ca 0.18 0.48 -0.44 0.00 -0.01 0.00 0.00 64.34 64.56 2kzz n VAL 681 Cb 0.12 -1.55 -0.00 0.00 -0.91 0.00 0.00 33.84 31.50 2kzz n VAL 681 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2kzz s ARG 682 N -1.10 3.99 -0.27 5.55 0.52 -1.26 -4.70 118.95 121.68 2kzz s ARG 682 Ca -0.01 -2.28 -0.27 0.00 -0.52 0.00 0.00 55.73 52.65 2kzz s ARG 682 Cb 0.00 -5.19 0.16 0.00 0.52 0.00 0.00 34.95 30.45 2kzz s ARG 682 CO 0.02 -1.92 1.26 1.21 0.02 0.00 0.00 175.30 175.89 2kzz s ASN 683 N 3.38 -0.20 0.14 0.23 3.84 -1.26 -5.08 114.94 115.98 2kzz s ASN 683 Ca 0.45 0.33 -0.11 0.00 0.21 0.00 0.00 52.86 53.74 2kzz s ASN 683 Cb -0.01 0.32 -0.05 0.00 -0.55 0.00 0.00 41.25 40.95 2kzz s ASN 683 CO 0.01 -0.10 1.44 -0.08 -2.79 0.00 0.00 177.10 175.58 2kzz h GLU 684 N 3.12 0.89 -0.25 0.43 4.81 -1.95 -3.23 114.58 118.41 2kzz h GLU 684 Ca -0.22 -0.52 -0.04 0.00 -0.13 0.00 0.00 59.36 58.44 2kzz h GLU 684 Cb 1.18 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.60 2kzz h GLU 684 CO 0.19 1.17 -0.04 0.93 -0.73 0.00 0.00 179.01 180.52 2kzz h GLU 685 N 0.70 0.37 -0.51 1.92 4.39 -1.95 -1.34 114.58 118.15 2kzz h GLU 685 Ca 0.03 -0.08 -0.07 0.00 0.34 0.00 0.00 59.36 59.58 2kzz h GLU 685 Cb 1.09 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.66 2kzz h GLU 685 CO 0.11 0.44 0.02 0.78 -1.16 0.00 0.00 179.01 179.20 2kzz h GLY 686 N 0.74 0.92 1.49 -3.84 0.00 -1.75 -1.88 103.07 98.74 2kzz h GLY 686 Ca 0.08 -0.61 0.03 0.00 0.00 0.00 0.00 47.33 46.83 2kzz h GLY 686 CO 0.01 0.56 0.28 3.21 0.00 0.00 0.00 176.54 180.60 2kzz h ARG 687 N 0.79 0.44 -0.01 4.80 3.08 -1.27 -0.38 114.38 121.84 2kzz h ARG 687 Ca 0.16 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 60.01 2kzz h ARG 687 Cb 0.44 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 2kzz h ARG 687 CO 0.02 0.29 -0.77 0.00 -1.07 0.00 0.00 179.97 178.43 2kzz h ARG 688 N 0.45 0.09 0.45 0.04 3.08 -1.07 -2.24 114.38 115.18 2kzz h ARG 688 Ca 0.17 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 2kzz h ARG 688 Cb 0.11 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2kzz h ARG 688 CO -0.04 0.82 -0.22 0.82 -1.07 0.00 0.00 179.97 180.28 2kzz h ILE 689 N 0.06 0.55 -0.48 2.04 1.08 -0.66 -2.76 117.51 117.33 2kzz h ILE 689 Ca -0.02 -0.07 0.14 0.00 -0.39 0.00 0.00 64.86 64.52 2kzz h ILE 689 Cb 1.36 0.59 -0.02 0.00 -3.07 0.00 0.00 36.82 35.68 2kzz h ILE 689 CO 0.11 0.01 0.35 0.03 -0.69 0.00 0.00 178.15 177.96 2kzz h ARG 690 N -0.65 0.00 0.00 2.37 3.08 -1.17 0.59 114.38 118.60 2kzz h ARG 690 Ca -0.06 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 2kzz h ARG 690 Cb 0.49 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 2kzz h ARG 690 CO 0.10 0.00 -0.05 1.96 -1.07 0.00 0.00 179.97 180.91 2kzz h GLN 691 N 0.00 0.00 0.00 0.04 4.20 -1.10 -1.62 115.11 116.63 2kzz h GLN 691 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 2kzz h GLN 691 Cb 0.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 2kzz h GLN 691 CO -0.00 0.05 0.00 0.00 -0.67 0.00 0.00 178.83 178.21 2kzz n ALA 692 N -2.15 2.13 -2.93 3.87 0.00 0.20 -4.44 120.51 117.20 2kzz n ALA 692 Ca -0.01 -0.04 -0.44 0.00 0.00 0.00 0.00 53.44 52.95 2kzz n ALA 692 Cb 0.25 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.25 2kzz n ALA 692 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2kzz s PHE 693 N -3.08 2.98 0.19 0.00 0.40 -0.62 -0.86 117.98 116.99 2kzz s PHE 693 Ca 0.11 -1.10 0.06 0.00 -0.60 0.00 0.00 56.93 55.39 2kzz s PHE 693 Cb 0.14 -4.26 -0.04 0.00 0.51 0.00 0.00 43.02 39.38 2kzz s PHE 693 CO 0.50 -1.51 0.13 0.96 0.70 0.00 0.00 175.22 176.00 2kzz s ILE 694 N 3.07 4.39 0.00 0.64 -4.36 -0.57 0.01 121.20 124.39 2kzz s ILE 694 Ca 0.27 -1.19 -0.20 0.00 -0.26 0.00 0.00 60.65 59.27 2kzz s ILE 694 Cb -0.10 -3.27 -0.06 0.00 1.25 0.00 0.00 42.46 40.28 2kzz s ILE 694 CO -0.02 -0.16 0.57 0.00 0.24 0.00 0.00 174.94 175.57 2kzz s ALA 695 N -1.84 3.52 1.35 2.27 0.00 -1.03 -4.28 121.76 121.74 2kzz s ALA 695 Ca 0.31 0.00 -0.20 0.00 0.00 0.00 0.00 51.96 52.07 2kzz s ALA 695 Cb -0.09 -2.69 0.34 0.00 0.00 0.00 0.00 23.12 20.67 2kzz s ALA 695 CO 0.23 0.22 0.96 -1.25 0.00 0.00 0.00 175.76 175.92 2kzz s PRO 696 N -0.36 -2.36 0.21 0.00 0.04 -1.26 -4.81 135.00 126.45 2kzz s PRO 696 Ca 0.30 0.31 -0.32 0.00 0.04 0.00 0.00 61.00 61.33 2kzz s PRO 696 Cb -0.18 -1.43 -0.13 0.00 0.04 0.00 0.00 34.50 32.80 2kzz s PRO 696 CO 0.17 -4.54 1.63 -1.91 0.04 0.00 0.00 177.00 172.39 2kzz n GLU 697 N -5.42 2.49 -1.18 4.56 4.07 -1.26 -1.87 120.64 122.03 2kzz n GLU 697 Ca 0.10 0.90 -0.06 0.00 -0.06 0.00 0.00 57.16 58.03 2kzz n GLU 697 Cb 0.58 -2.69 -0.03 0.00 -0.06 0.00 0.00 31.44 29.24 2kzz n GLU 697 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2kzz n ASP 698 N 3.40 -4.07 -4.37 4.31 8.00 -1.26 -5.02 116.55 117.54 2kzz n ASP 698 Ca 0.15 0.15 -0.19 0.00 0.71 0.00 0.00 54.79 55.62 2kzz n ASP 698 Cb 0.33 -2.12 -0.10 0.00 -0.02 0.00 0.00 41.12 39.20 2kzz n ASP 698 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2kzz s TYR 699 N -2.13 1.71 0.06 1.24 1.51 -0.78 -1.66 117.35 117.29 2kzz s TYR 699 Ca 0.00 -0.98 0.00 0.00 -1.01 0.00 0.00 57.07 55.08 2kzz s TYR 699 Cb 0.00 -1.04 -0.03 0.00 -0.11 0.00 0.00 41.96 40.78 2kzz s TYR 699 CO 0.00 -0.07 -0.05 0.14 -1.11 0.00 0.00 175.55 174.46 2kzz s VAL 700 N -3.43 0.38 -0.05 0.71 -7.23 0.75 -4.63 120.40 106.89 2kzz s VAL 700 Ca 0.33 -1.58 -0.22 0.00 -1.81 0.00 0.00 61.98 58.69 2kzz s VAL 700 Cb 0.07 -1.22 -0.04 0.00 0.56 0.00 0.00 36.38 35.75 2kzz s VAL 700 CO 0.12 -0.79 0.66 -0.63 -0.31 0.00 0.00 175.10 174.15 2kzz s ILE 701 N -3.05 5.01 -0.12 -0.62 -1.09 -0.72 0.04 121.20 120.66 2kzz s ILE 701 Ca 0.02 1.36 0.03 0.00 -2.23 0.00 0.00 60.65 59.82 2kzz s ILE 701 Cb 0.02 -4.00 -0.00 0.00 -1.58 0.00 0.00 42.46 36.90 2kzz s ILE 701 CO -0.05 0.30 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.06 2kzz s VAL 702 N 0.51 2.32 -0.25 2.92 1.01 -0.43 -1.53 120.40 124.96 2kzz s VAL 702 Ca 0.35 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 2kzz s VAL 702 Cb -0.18 -1.92 -0.00 0.00 0.00 0.00 0.00 36.38 34.28 2kzz s VAL 702 CO 0.17 0.55 0.00 -0.55 0.00 0.00 0.00 175.10 175.27 2kzz s SER 703 N 0.47 4.63 -0.28 3.32 0.15 0.17 -1.38 113.70 120.79 2kzz s SER 703 Ca -0.14 -0.53 -0.06 0.00 0.70 0.00 0.00 55.95 55.93 2kzz s SER 703 Cb -0.17 -1.79 0.01 0.00 -1.71 0.00 0.00 66.02 62.36 2kzz s SER 703 CO 0.06 -0.08 0.05 0.00 1.20 0.00 0.00 173.24 174.46 2kzz s ALA 704 N 1.48 3.00 0.07 5.45 0.00 -0.74 -0.60 121.76 130.41 2kzz s ALA 704 Ca 0.04 -1.40 0.09 0.00 0.00 0.00 0.00 51.96 50.69 2kzz s ALA 704 Cb -0.15 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.90 2kzz s ALA 704 CO -0.01 -0.82 -0.23 0.34 0.00 0.00 0.00 175.76 175.04 2kzz s ASP 705 N 1.48 2.81 -0.60 0.00 2.15 -0.42 -1.01 116.67 121.09 2kzz s ASP 705 Ca 0.03 -0.60 -0.20 0.00 0.43 0.00 0.00 52.55 52.21 2kzz s ASP 705 Cb -0.17 -0.22 0.09 0.00 -0.30 0.00 0.00 42.92 42.32 2kzz s ASP 705 CO 0.01 0.18 0.77 -0.31 -0.17 0.00 0.00 175.17 175.64 2kzz s TYR 706 N -0.89 2.92 -0.21 -5.34 2.02 -0.37 -1.01 117.35 114.47 2kzz s TYR 706 Ca 0.10 -0.80 -0.31 0.00 -0.37 0.00 0.00 57.07 55.69 2kzz s TYR 706 Cb -0.10 -4.04 -0.08 0.00 -0.40 0.00 0.00 41.96 37.35 2kzz s TYR 706 CO 0.03 -1.36 2.14 0.43 -1.57 0.00 0.00 175.55 175.22 2kzz n SER 707 N 6.68 3.09 -3.93 2.29 7.64 -0.81 -3.13 113.62 125.44 2kzz n SER 707 Ca -0.08 0.44 -0.30 0.00 1.01 0.00 0.00 58.87 59.94 2kzz n SER 707 Cb 0.44 -1.45 -0.00 0.00 -1.01 0.00 0.00 64.21 62.18 2kzz n SER 707 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kzz n GLN 708 N 8.17 -0.56 -0.28 1.43 10.64 -1.26 -4.74 117.38 130.78 2kzz n GLN 708 Ca 0.31 -0.10 -0.02 0.00 -1.83 0.00 0.00 57.00 55.36 2kzz n GLN 708 Cb 0.36 -1.53 0.10 0.00 -0.86 0.00 0.00 30.24 28.31 2kzz n GLN 708 CO 0.00 0.00 0.00 0.97 -1.83 0.00 0.00 177.06 176.20 2kzz h ILE 709 N -0.81 1.09 -0.11 -0.39 2.10 -1.92 -1.94 117.51 115.52 2kzz h ILE 709 Ca -0.48 -0.32 -0.02 0.00 1.08 0.00 0.00 64.86 65.12 2kzz h ILE 709 Cb 0.95 0.07 -0.01 0.00 -1.09 0.00 0.00 36.82 36.74 2kzz h ILE 709 CO 0.37 0.17 -0.03 -0.33 -1.08 0.00 0.00 178.15 177.26 2kzz h GLU 710 N 0.94 0.16 -0.01 2.19 5.08 -1.87 0.36 114.58 121.41 2kzz h GLU 710 Ca 0.32 -0.02 -0.24 0.00 -1.00 0.00 0.00 59.36 58.42 2kzz h GLU 710 Cb 0.06 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.29 2kzz h GLU 710 CO -0.13 0.20 -0.98 1.25 -1.00 0.00 0.00 179.01 178.36 2kzz h LEU 711 N 0.15 0.75 -0.91 1.33 5.85 -1.81 -1.84 115.31 118.84 2kzz h LEU 711 Ca 0.04 -0.59 -0.10 0.00 0.84 0.00 0.00 57.88 58.07 2kzz h LEU 711 Cb 0.16 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 2kzz h LEU 711 CO 0.01 1.39 -0.26 0.03 -0.34 0.00 0.00 178.44 179.26 2kzz h ARG 712 N 0.34 0.50 -0.42 1.25 3.08 -0.48 -1.89 114.38 116.74 2kzz h ARG 712 Ca -0.10 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 59.67 2kzz h ARG 712 Cb 1.62 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.63 2kzz h ARG 712 CO 0.18 0.72 -0.08 0.82 -1.07 0.00 0.00 179.97 180.54 2kzz h ILE 713 N 0.44 1.27 -0.61 2.04 2.04 -0.23 -2.55 117.51 119.92 2kzz h ILE 713 Ca 0.06 -1.18 -0.04 0.00 1.00 0.00 0.00 64.86 64.71 2kzz h ILE 713 Cb 0.68 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 2kzz h ILE 713 CO 0.05 0.40 0.22 -0.03 0.00 0.00 0.00 178.15 178.79 2kzz h MET 714 N 0.63 0.90 -0.30 2.37 4.05 -1.05 -1.25 114.93 120.28 2kzz h MET 714 Ca 0.11 -0.15 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 2kzz h MET 714 Cb 0.61 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 31.24 2kzz h MET 714 CO 0.04 0.75 0.20 0.00 0.23 0.00 0.00 176.91 178.12 2kzz h ALA 715 N 1.36 0.38 0.25 0.39 0.00 -1.10 -1.47 119.26 119.08 2kzz h ALA 715 Ca 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2kzz h ALA 715 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2kzz h ALA 715 CO -0.01 -0.16 -0.12 1.25 0.00 0.00 0.00 179.25 180.20 2kzz h HIS 716 N 0.40 -0.32 0.00 0.00 6.17 -1.04 -1.99 115.15 118.37 2kzz h HIS 716 Ca 0.11 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.18 2kzz h HIS 716 Cb -0.04 0.10 0.00 0.00 2.52 0.00 0.00 27.41 29.99 2kzz h HIS 716 CO -0.06 -0.16 0.00 -0.07 0.71 0.00 0.00 177.93 178.35 2kzz h LEU 717 N -0.39 0.00 -1.57 0.26 3.38 -1.13 -1.76 115.31 114.10 2kzz h LEU 717 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2kzz h LEU 717 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2kzz h LEU 717 CO 0.06 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.05 2kzz n SER 718 N -2.55 2.17 -3.20 -0.43 3.41 -0.56 -4.79 113.62 107.67 2kzz n SER 718 Ca -0.00 -1.58 -0.19 0.00 -0.26 0.00 0.00 58.87 56.83 2kzz n SER 718 Cb 0.16 -0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.09 2kzz n SER 718 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2kzz n ARG 719 N 0.77 -2.80 -2.75 4.33 1.74 -0.66 -4.32 116.66 112.98 2kzz n ARG 719 Ca 0.08 0.35 -0.43 0.00 -0.77 0.00 0.00 57.85 57.09 2kzz n ARG 719 Cb 0.35 -4.98 -0.03 0.00 -1.02 0.00 0.00 32.46 26.77 2kzz n ARG 719 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2kzz s ASP 720 N -2.54 6.85 0.44 0.55 -1.08 -1.14 -4.92 116.67 114.83 2kzz s ASP 720 Ca 0.31 0.93 0.13 0.00 -0.52 0.00 0.00 52.55 53.40 2kzz s ASP 720 Cb -0.17 -2.50 0.97 0.00 -1.46 0.00 0.00 42.92 39.76 2kzz s ASP 720 CO 0.38 -0.78 2.00 0.50 0.52 0.00 0.00 175.17 177.80 2kzz h LYS 721 N 8.06 0.12 0.58 4.34 3.64 -1.91 -0.41 116.57 130.99 2kzz h LYS 721 Ca -0.22 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.11 2kzz h LYS 721 Cb 1.07 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.88 2kzz h LYS 721 CO 0.98 0.22 -0.28 0.78 -2.27 0.00 0.00 179.45 178.88 2kzz h GLY 722 N 0.51 -0.81 0.72 5.01 0.00 -1.91 0.76 103.07 107.35 2kzz h GLY 722 Ca 0.03 0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.67 2kzz h GLY 722 CO 0.01 -0.30 -0.16 1.41 0.00 0.00 0.00 176.54 177.51 2kzz h LEU 723 N -0.85 -0.44 -0.90 3.11 3.38 -1.93 -0.14 115.31 117.53 2kzz h LEU 723 Ca -0.08 0.05 0.15 0.00 0.09 0.00 0.00 57.88 58.10 2kzz h LEU 723 Cb 0.60 0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.42 2kzz h LEU 723 CO 0.13 -0.23 0.50 -0.07 0.09 0.00 0.00 178.44 178.86 2kzz h LEU 724 N -0.31 0.64 -0.45 1.67 4.07 -1.11 -0.26 115.31 119.56 2kzz h LEU 724 Ca 0.02 0.09 -0.16 0.00 0.08 0.00 0.00 57.88 57.91 2kzz h LEU 724 Cb 0.33 -0.02 -0.00 0.00 1.08 0.00 0.00 40.66 42.04 2kzz h LEU 724 CO -0.09 0.27 -0.49 0.74 -1.08 0.00 0.00 178.44 177.79 2kzz h THR 725 N 0.71 1.29 -0.19 0.22 2.02 0.16 -0.55 112.91 116.57 2kzz h THR 725 Ca 0.49 -1.69 0.05 0.00 0.77 0.00 0.00 66.41 66.04 2kzz h THR 725 Cb 0.68 1.60 -0.06 0.00 -1.74 0.00 0.00 68.15 68.63 2kzz h THR 725 CO -0.35 0.54 -0.25 0.00 0.37 0.00 0.00 175.52 175.83 2kzz h ALA 726 N 0.86 -0.19 -0.42 6.16 0.00 0.73 -0.46 119.26 125.95 2kzz h ALA 726 Ca 0.03 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2kzz h ALA 726 Cb 1.06 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 2kzz h ALA 726 CO 0.10 -0.69 -0.08 0.74 0.00 0.00 0.00 179.25 179.32 2kzz h PHE 727 N -0.29 0.79 -1.00 0.00 0.04 -1.39 -0.91 116.94 114.18 2kzz h PHE 727 Ca 0.12 -0.13 0.13 0.00 2.80 0.00 0.00 57.97 60.89 2kzz h PHE 727 Cb 0.47 -0.21 -0.09 0.00 2.20 0.00 0.00 35.95 38.32 2kzz h PHE 727 CO -0.37 0.78 0.63 0.00 -0.60 0.00 0.00 178.31 178.75 2kzz h ALA 728 N 1.24 1.55 -0.56 2.45 0.00 0.49 -2.01 119.26 122.42 2kzz h ALA 728 Ca 0.12 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 2kzz h ALA 728 Cb 0.54 -0.19 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 2kzz h ALA 728 CO 0.03 0.18 0.15 -0.85 0.00 0.00 0.00 179.25 178.75 2kzz n GLU 729 N -4.64 3.27 -2.23 0.00 0.28 -0.60 -4.97 120.64 111.75 2kzz n GLU 729 Ca 0.20 -3.05 -0.18 0.00 -0.16 0.00 0.00 57.16 53.97 2kzz n GLU 729 Cb 0.40 -2.07 -0.02 0.00 1.43 0.00 0.00 31.44 31.18 2kzz n GLU 729 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2kzz n GLY 730 N -0.38 -0.08 3.88 -1.84 0.00 -0.76 -5.00 105.19 101.02 2kzz n GLY 730 Ca 0.35 -0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 2kzz n GLY 730 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kzz s LYS 731 N -4.70 3.72 -0.52 1.61 1.02 -0.35 -4.99 119.74 115.53 2kzz s LYS 731 Ca 0.00 0.10 -0.26 0.00 0.02 0.00 0.00 55.97 55.83 2kzz s LYS 731 Cb 0.00 -2.86 -0.06 0.00 -0.52 0.00 0.00 37.83 34.39 2kzz s LYS 731 CO 0.00 0.47 2.31 0.34 -0.92 0.00 0.00 175.35 177.54 2kzz s ASP 732 N -2.16 4.58 0.54 2.83 -1.08 -1.26 -4.43 116.67 115.69 2kzz s ASP 732 Ca 0.40 0.92 0.34 0.00 -0.52 0.00 0.00 52.55 53.68 2kzz s ASP 732 Cb -0.13 -2.51 1.51 0.00 -1.46 0.00 0.00 42.92 40.34 2kzz s ASP 732 CO 0.21 -2.81 1.85 0.16 0.52 0.00 0.00 175.17 175.10 2kzz h ILE 733 N 7.54 0.48 -0.34 4.11 -0.00 -1.94 0.39 117.51 127.75 2kzz h ILE 733 Ca -0.24 0.00 -0.13 0.00 -0.00 0.00 0.00 64.86 64.49 2kzz h ILE 733 Cb 1.24 0.48 -0.01 0.00 -0.00 0.00 0.00 36.82 38.54 2kzz h ILE 733 CO 1.17 0.00 -0.30 0.45 -0.00 0.00 0.00 178.15 179.47 2kzz h HIS 734 N 0.00 0.85 0.00 0.16 3.86 -1.92 -0.19 115.15 117.91 2kzz h HIS 734 Ca 0.48 -0.22 -0.20 0.00 -1.16 0.00 0.00 60.37 59.28 2kzz h HIS 734 Cb 1.96 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 30.21 2kzz h HIS 734 CO 0.00 0.94 -0.93 0.00 0.86 0.00 0.00 177.93 178.80 2kzz h ARG 735 N 0.62 0.00 -0.13 2.45 3.08 -1.29 -2.22 114.38 116.88 2kzz h ARG 735 Ca 0.07 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 2kzz h ARG 735 Cb 0.82 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.87 2kzz h ARG 735 CO 0.07 0.93 -0.16 0.00 -1.07 0.00 0.00 179.97 179.74 2kzz h ALA 736 N 1.07 0.20 -0.38 0.04 0.00 -1.11 -0.35 119.26 118.73 2kzz h ALA 736 Ca -0.01 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.61 2kzz h ALA 736 Cb 1.70 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.41 2kzz h ALA 736 CO 0.12 0.10 0.12 1.15 0.00 0.00 0.00 179.25 180.74 2kzz h THR 737 N -0.05 0.87 -0.22 0.00 2.02 -1.05 -1.33 112.91 113.15 2kzz h THR 737 Ca 0.02 -0.09 -0.13 0.00 0.77 0.00 0.00 66.41 66.97 2kzz h THR 737 Cb 0.71 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 2kzz h THR 737 CO 0.04 0.05 -0.42 0.00 0.37 0.00 0.00 175.52 175.56 2kzz h ALA 738 N 1.26 0.87 0.00 6.16 0.00 -1.40 0.96 119.26 127.10 2kzz h ALA 738 Ca 0.18 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2kzz h ALA 738 Cb 0.17 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2kzz h ALA 738 CO -0.19 0.64 -0.07 0.00 0.00 0.00 0.00 179.25 179.63 2kzz h ALA 739 N 1.12 1.81 0.08 0.00 0.00 -0.02 0.59 119.26 122.84 2kzz h ALA 739 Ca 0.04 -0.07 -0.37 0.00 0.00 0.00 0.00 54.91 54.51 2kzz h ALA 739 Cb 0.91 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 2kzz h ALA 739 CO 0.08 0.09 -2.16 0.39 0.00 0.00 0.00 179.25 177.65 2kzz n GLU 740 N -4.35 0.72 -0.15 0.00 -0.58 -0.60 -1.35 120.64 114.34 2kzz n GLU 740 Ca -0.03 0.22 -0.11 0.00 -0.42 0.00 0.00 57.16 56.82 2kzz n GLU 740 Cb 0.15 -1.65 -0.01 0.00 -0.57 0.00 0.00 31.44 29.37 2kzz n GLU 740 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2kzz h VAL 741 N 0.05 1.27 -0.00 2.62 2.07 -0.66 -3.15 116.25 118.45 2kzz h VAL 741 Ca -0.48 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 65.74 2kzz h VAL 741 Cb 1.99 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 2kzz h VAL 741 CO 0.03 0.44 -0.58 0.49 0.02 0.00 0.00 177.57 177.98 2kzz n PHE 742 N -4.21 0.00 -2.78 1.57 3.72 0.19 -4.90 117.46 111.04 2kzz n PHE 742 Ca -0.01 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.33 2kzz n PHE 742 Cb 0.42 -0.11 0.03 0.00 -0.94 0.00 0.00 39.48 38.88 2kzz n PHE 742 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2kzz n GLY 743 N 1.45 -0.84 3.37 1.37 0.00 -1.15 -5.04 105.19 104.35 2kzz n GLY 743 Ca 0.07 0.36 -0.10 0.00 0.00 0.00 0.00 46.02 46.35 2kzz n GLY 743 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2kzz s LEU 744 N -4.25 0.25 0.60 0.99 2.34 -0.46 -5.02 118.68 113.14 2kzz s LEU 744 Ca 0.19 -0.34 -0.19 0.00 0.06 0.00 0.00 54.13 53.85 2kzz s LEU 744 Cb -0.03 1.96 -0.04 0.00 -0.56 0.00 0.00 46.19 47.53 2kzz s LEU 744 CO 0.57 -0.91 1.13 -2.65 -1.06 0.00 0.00 176.35 173.43 2kzz n PRO 745 N -0.27 1.09 -0.26 1.48 -0.02 -1.26 -4.56 135.00 131.20 2kzz n PRO 745 Ca -0.14 0.42 -0.05 0.00 -2.02 0.00 0.00 63.50 61.70 2kzz n PRO 745 Cb 0.64 -2.34 0.09 0.00 -0.02 0.00 0.00 33.50 31.86 2kzz n PRO 745 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2kzz h LEU 746 N 0.66 1.05 -0.89 2.45 5.85 -1.90 -2.55 115.31 119.99 2kzz h LEU 746 Ca -0.49 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.05 2kzz h LEU 746 Cb 1.35 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2kzz h LEU 746 CO 0.53 0.95 0.00 -0.33 -0.34 0.00 0.00 178.44 179.24 2kzz h GLU 747 N 1.11 0.00 -0.00 1.25 3.07 -1.96 -2.97 114.58 115.08 2kzz h GLU 747 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 2kzz h GLU 747 Cb 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 2kzz h GLU 747 CO -0.02 0.00 -0.77 0.25 -1.40 0.00 0.00 179.01 177.07 2kzz n THR 748 N -2.38 0.00 -1.67 1.13 -2.24 -0.97 -4.97 114.28 103.18 2kzz n THR 748 Ca 0.02 -0.07 -0.47 0.00 -2.27 0.00 0.00 64.05 61.25 2kzz n THR 748 Cb 0.23 0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 2kzz n THR 748 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2kzz n VAL 749 N -1.08 0.13 -1.85 2.28 3.14 -1.12 -4.95 118.33 114.87 2kzz n VAL 749 Ca 0.06 -0.02 -0.30 0.00 -2.96 0.00 0.00 64.34 61.12 2kzz n VAL 749 Cb 0.37 -1.57 0.05 0.00 -1.06 0.00 0.00 33.84 31.63 2kzz n VAL 749 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 2kzz s THR 750 N 1.59 3.41 0.36 1.55 -4.23 -1.26 -4.88 115.64 112.18 2kzz s THR 750 Ca 0.82 0.46 0.08 0.00 -1.18 0.00 0.00 61.69 61.87 2kzz s THR 750 Cb -0.70 -3.43 0.13 0.00 1.34 0.00 0.00 72.50 69.84 2kzz s THR 750 CO 0.41 -0.60 1.85 0.28 -0.54 0.00 0.00 174.62 176.03 2kzz h SER 751 N -0.71 0.26 0.61 3.99 0.02 -1.98 -0.14 113.55 115.59 2kzz h SER 751 Ca -0.45 -0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 60.29 2kzz h SER 751 Cb 1.26 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.71 2kzz h SER 751 CO 0.63 0.47 -0.65 -0.08 -1.14 0.00 0.00 176.83 176.06 2kzz h GLU 752 N 0.25 0.03 0.03 3.45 4.81 -1.98 -1.09 114.58 120.08 2kzz h GLU 752 Ca 0.04 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.12 2kzz h GLU 752 Cb 0.49 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.88 2kzz h GLU 752 CO 0.03 0.67 -0.53 1.96 -0.73 0.00 0.00 179.01 180.41 2kzz h GLN 753 N 0.02 0.32 -0.65 1.92 4.20 -1.83 -1.57 115.11 117.52 2kzz h GLN 753 Ca -0.01 -0.37 0.00 0.00 0.06 0.00 0.00 58.65 58.33 2kzz h GLN 753 Cb 1.15 0.11 -0.03 0.00 0.30 0.00 0.00 27.48 29.01 2kzz h GLN 753 CO 0.09 1.08 0.42 -0.09 -0.67 0.00 0.00 178.83 179.66 2kzz h ARG 754 N -0.28 0.86 -0.02 1.46 2.43 -1.03 -0.77 114.38 117.02 2kzz h ARG 754 Ca -0.07 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 58.91 2kzz h ARG 754 Cb 1.29 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.63 2kzz h ARG 754 CO 0.10 0.57 -0.60 -0.09 -1.51 0.00 0.00 179.97 178.45 2kzz h ARG 755 N 0.88 0.08 -0.05 0.20 2.43 -1.19 -2.03 114.38 114.71 2kzz h ARG 755 Ca 0.24 -0.06 -0.24 0.00 -0.81 0.00 0.00 59.98 59.11 2kzz h ARG 755 Cb -0.09 0.01 0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2kzz h ARG 755 CO -0.05 0.66 -0.91 0.77 -1.51 0.00 0.00 179.97 178.93 2kzz h SER 756 N 0.06 0.79 -0.38 -3.80 0.02 -0.20 -2.76 113.55 107.28 2kzz h SER 756 Ca -0.01 -0.59 -0.04 0.00 -0.84 0.00 0.00 61.79 60.31 2kzz h SER 756 Cb 1.07 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.36 2kzz h SER 756 CO 0.08 1.38 0.06 0.00 -1.14 0.00 0.00 176.83 177.22 2kzz h ALA 757 N 0.58 0.51 -0.51 3.77 0.00 -1.15 -2.66 119.26 119.80 2kzz h ALA 757 Ca -0.09 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 2kzz h ALA 757 Cb 1.54 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2kzz h ALA 757 CO 0.17 0.22 0.07 -0.22 0.00 0.00 0.00 179.25 179.49 2kzz h LYS 758 N 0.48 0.80 -0.18 0.00 3.64 -1.42 0.33 116.57 120.23 2kzz h LYS 758 Ca 0.12 -0.18 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 2kzz h LYS 758 Cb 0.36 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2kzz h LYS 758 CO 0.01 0.76 -0.27 0.00 -2.27 0.00 0.00 179.45 177.68 2kzz h ALA 759 N 1.31 1.21 0.00 5.00 0.00 -1.39 -1.06 119.26 124.33 2kzz h ALA 759 Ca 0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2kzz h ALA 759 Cb 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2kzz h ALA 759 CO 0.01 0.52 -0.07 0.82 0.00 0.00 0.00 179.25 180.53 2kzz h ILE 760 N 0.30 1.62 -0.21 0.00 2.04 -1.07 -2.00 117.51 118.20 2kzz h ILE 760 Ca 0.04 -1.93 0.06 0.00 1.00 0.00 0.00 64.86 64.04 2kzz h ILE 760 Cb 0.64 2.91 -0.06 0.00 -0.74 0.00 0.00 36.82 39.57 2kzz h ILE 760 CO 0.05 0.51 -0.21 0.78 0.00 0.00 0.00 178.15 179.27 2kzz h ASN 761 N -0.73 -0.68 0.93 1.72 2.35 -0.23 -1.57 115.58 117.36 2kzz h ASN 761 Ca -0.01 0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.80 2kzz h ASN 761 Cb 0.87 0.32 -0.01 0.00 0.05 0.00 0.00 38.32 39.56 2kzz h ASN 761 CO 0.01 -0.26 -0.31 -0.26 -1.65 0.00 0.00 177.43 174.96 2kzz h PHE 762 N -0.23 0.00 -0.52 1.19 0.04 -1.31 -3.01 116.94 113.10 2kzz h PHE 762 Ca 0.13 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.79 2kzz h PHE 762 Cb 0.42 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.56 2kzz h PHE 762 CO -0.36 0.31 -0.11 0.78 -0.60 0.00 0.00 178.31 178.33 2kzz h GLY 763 N 2.17 1.07 0.60 -1.45 0.00 -0.51 -3.11 103.07 101.84 2kzz h GLY 763 Ca -0.00 -0.85 0.07 0.00 0.00 0.00 0.00 47.33 46.54 2kzz h GLY 763 CO 0.04 0.78 0.31 1.41 0.00 0.00 0.00 176.54 179.09 2kzz h LEU 764 N 0.88 0.43 -0.16 3.11 3.38 -1.25 0.57 115.31 122.26 2kzz h LEU 764 Ca 0.14 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.19 2kzz h LEU 764 Cb 0.67 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 2kzz h LEU 764 CO 0.05 0.27 -0.06 0.40 0.09 0.00 0.00 178.44 179.19 2kzz h ILE 765 N 0.57 0.78 -0.04 1.22 2.04 -1.63 -0.00 117.51 120.47 2kzz h ILE 765 Ca 0.29 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.15 2kzz h ILE 765 Cb 0.24 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2kzz h ILE 765 CO -0.21 0.00 0.00 -1.22 0.00 0.00 0.00 178.15 176.72 2kzz n TYR 766 N -5.21 0.05 -1.37 1.37 4.02 -0.98 -3.24 117.16 111.80 2kzz n TYR 766 Ca -0.03 -0.02 -0.13 0.00 -0.01 0.00 0.00 57.90 57.71 2kzz n TYR 766 Cb 0.13 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.40 2kzz n TYR 766 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2kzz n GLY 767 N 0.78 1.28 3.51 2.72 0.00 0.13 -4.84 105.19 108.77 2kzz n GLY 767 Ca 0.11 -0.11 -0.51 0.00 0.00 0.00 0.00 46.02 45.51 2kzz n GLY 767 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2kzz n MET 768 N -1.61 0.55 -1.91 1.61 2.81 0.18 -4.91 117.12 113.83 2kzz n MET 768 Ca -0.13 0.19 -0.33 0.00 -1.81 0.00 0.00 57.70 55.62 2kzz n MET 768 Cb 0.55 -1.56 0.03 0.00 -0.71 0.00 0.00 33.22 31.53 2kzz n MET 768 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2kzz s SER 769 N -0.28 5.35 0.51 7.83 1.04 -1.26 -4.74 113.70 122.15 2kzz s SER 769 Ca 0.75 2.01 0.35 0.00 0.48 0.00 0.00 55.95 59.54 2kzz s SER 769 Cb -0.98 -2.55 1.87 0.00 0.10 0.00 0.00 66.02 64.46 2kzz s SER 769 CO 0.55 -1.47 2.06 0.00 0.98 0.00 0.00 173.24 175.36 2kzz h ALA 770 N 0.35 1.00 0.03 5.32 0.00 -1.95 -0.54 119.26 123.47 2kzz h ALA 770 Ca -0.47 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.11 2kzz h ALA 770 Cb 1.25 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 2kzz h ALA 770 CO 0.55 0.00 -1.88 1.19 0.00 0.00 0.00 179.25 179.11 2kzz n PHE 771 N -2.72 0.94 -0.19 0.00 3.72 -1.26 -3.14 117.46 114.81 2kzz n PHE 771 Ca -0.02 0.29 -0.10 0.00 -0.05 0.00 0.00 57.45 57.57 2kzz n PHE 771 Cb 0.06 -1.16 0.01 0.00 -0.94 0.00 0.00 39.48 37.46 2kzz n PHE 771 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2kzz h GLY 772 N 2.87 1.04 1.27 1.37 0.00 -1.52 -1.74 103.07 106.35 2kzz h GLY 772 Ca -0.36 -0.76 0.01 0.00 0.00 0.00 0.00 47.33 46.22 2kzz h GLY 772 CO 0.07 0.70 0.47 -2.00 0.00 0.00 0.00 176.54 175.79 2kzz h LEU 773 N 0.84 0.80 -1.40 3.11 7.12 -1.32 0.10 115.31 124.57 2kzz h LEU 773 Ca 0.15 -0.02 -0.05 0.00 0.13 0.00 0.00 57.88 58.09 2kzz h LEU 773 Cb 0.54 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 40.46 2kzz h LEU 773 CO 0.03 0.58 -0.16 0.00 -0.13 0.00 0.00 178.44 178.75 2kzz h ALA 774 N 1.56 1.50 0.00 1.25 0.00 -1.31 -1.35 119.26 120.91 2kzz h ALA 774 Ca 0.27 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2kzz h ALA 774 Cb -0.07 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2kzz h ALA 774 CO -0.06 0.35 -0.10 0.00 0.00 0.00 0.00 179.25 179.44 2kzz h ARG 775 N 0.19 0.00 0.00 0.00 3.08 -0.16 -0.36 114.38 117.13 2kzz h ARG 775 Ca 0.04 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.81 2kzz h ARG 775 Cb 0.40 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.40 2kzz h ARG 775 CO 0.03 0.10 -1.74 1.04 -1.07 0.00 0.00 179.97 178.33 2kzz n GLN 776 N -3.13 0.64 0.03 0.04 1.13 -0.83 -4.26 117.38 111.00 2kzz n GLN 776 Ca 0.03 0.24 0.11 0.00 -1.94 0.00 0.00 57.00 55.44 2kzz n GLN 776 Cb 0.56 -1.76 0.03 0.00 0.11 0.00 0.00 30.24 29.18 2kzz n GLN 776 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2kzz n LEU 777 N -2.96 0.61 -0.24 1.08 7.94 -0.54 -4.98 117.00 117.90 2kzz n LEU 777 Ca -0.17 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.70 2kzz n LEU 777 Cb 1.02 -0.10 -0.01 0.00 0.53 0.00 0.00 43.42 44.85 2kzz n LEU 777 CO 0.44 0.03 -0.03 0.59 -1.11 0.00 0.00 177.39 177.31 2kzz n ASN 778 N -1.99 -4.47 -4.95 1.96 3.02 -0.16 -5.02 115.26 103.64 2kzz n ASN 778 Ca 0.02 0.08 -0.23 0.00 -0.03 0.00 0.00 54.58 54.42 2kzz n ASN 778 Cb 0.44 -2.24 0.02 0.00 -0.61 0.00 0.00 39.78 37.39 2kzz n ASN 778 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2kzz s ILE 779 N -1.75 3.55 0.78 2.41 -4.36 -1.10 -5.04 121.20 115.69 2kzz s ILE 779 Ca 0.00 -0.49 -0.11 0.00 -0.26 0.00 0.00 60.65 59.79 2kzz s ILE 779 Cb 0.00 -3.33 0.06 0.00 1.25 0.00 0.00 42.46 40.44 2kzz s ILE 779 CO 0.00 -0.24 1.08 -2.84 0.24 0.00 0.00 174.94 173.18 2kzz s PRO 780 N -4.67 2.18 0.85 0.37 0.02 -1.26 -4.67 135.00 127.83 2kzz s PRO 780 Ca 0.52 0.98 -0.10 0.00 0.02 0.00 0.00 61.00 62.42 2kzz s PRO 780 Cb -0.10 -1.90 0.10 0.00 0.02 0.00 0.00 34.50 32.62 2kzz s PRO 780 CO 0.39 -1.64 1.12 1.03 -0.33 0.00 0.00 177.00 177.56 2kzz s ARG 781 N -4.97 1.59 0.00 5.54 0.52 -1.26 -2.71 118.95 117.66 2kzz s ARG 781 Ca 0.61 1.33 0.00 0.00 -0.52 0.00 0.00 55.73 57.15 2kzz s ARG 781 Cb -0.16 -1.81 0.00 0.00 0.52 0.00 0.00 34.95 33.50 2kzz s ARG 781 CO 0.56 -2.16 0.00 1.63 0.02 0.00 0.00 175.30 175.35 2kzz n LYS 782 N -3.89 0.00 -0.00 3.54 4.01 -1.26 -4.43 118.16 116.12 2kzz n LYS 782 Ca 0.10 0.00 -0.15 0.00 -0.51 0.00 0.00 58.31 57.75 2kzz n LYS 782 Cb 0.53 -3.28 -0.14 0.00 -0.51 0.00 0.00 35.03 31.63 2kzz n LYS 782 CO 0.00 0.00 0.00 1.49 -1.11 0.00 0.00 177.40 177.78 2kzz h GLU 783 N 0.49 0.15 -0.12 1.97 4.57 -1.90 -2.93 114.58 116.80 2kzz h GLU 783 Ca 0.00 -0.25 -0.21 0.00 -1.18 0.00 0.00 59.36 57.72 2kzz h GLU 783 Cb 0.00 0.09 0.01 0.00 -0.16 0.00 0.00 28.75 28.69 2kzz h GLU 783 CO 0.00 0.88 -0.75 0.00 -1.18 0.00 0.00 179.01 177.96 2kzz h ALA 784 N 0.51 0.26 0.00 2.92 0.00 -1.74 -2.83 119.26 118.38 2kzz h ALA 784 Ca -0.35 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 53.94 2kzz h ALA 784 Cb 2.03 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.81 2kzz h ALA 784 CO 0.09 0.62 -0.10 0.37 0.00 0.00 0.00 179.25 180.23 2kzz h GLN 785 N 0.43 0.00 -0.13 0.00 5.75 -1.77 -1.96 115.11 117.44 2kzz h GLN 785 Ca -0.06 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 2kzz h GLN 785 Cb 1.39 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.94 2kzz h GLN 785 CO 0.15 0.10 -0.06 -0.22 -2.65 0.00 0.00 178.83 176.16 2kzz h LYS 786 N 0.00 0.26 -0.33 1.69 3.64 -1.30 -2.78 116.57 117.74 2kzz h LYS 786 Ca -0.00 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 2kzz h LYS 786 Cb 0.20 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2kzz h LYS 786 CO 0.01 0.59 0.19 1.88 -2.27 0.00 0.00 179.45 179.85 2kzz h TYR 787 N -0.08 0.45 -0.55 1.91 0.05 -1.19 -2.56 116.97 115.01 2kzz h TYR 787 Ca 0.03 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 2kzz h TYR 787 Cb 0.51 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.08 2kzz h TYR 787 CO 0.06 0.36 0.27 0.52 -1.05 0.00 0.00 178.16 178.32 2kzz h MET 788 N 0.42 0.77 -0.60 4.88 2.86 -1.44 -0.60 114.93 121.22 2kzz h MET 788 Ca 0.12 -0.09 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 2kzz h MET 788 Cb 0.05 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 2kzz h MET 788 CO -0.02 0.60 0.16 -0.44 1.06 0.00 0.00 176.91 178.26 2kzz h ASP 789 N 0.77 0.90 -0.27 1.22 3.32 -1.29 -1.15 116.42 119.92 2kzz h ASP 789 Ca 0.19 -0.23 -0.09 0.00 0.02 0.00 0.00 57.03 56.92 2kzz h ASP 789 Cb 0.08 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 2kzz h ASP 789 CO -0.03 0.90 -0.14 -0.07 -1.72 0.00 0.00 179.24 178.18 2kzz h LEU 790 N 0.87 0.69 0.30 1.55 3.38 -1.01 -2.42 115.31 118.67 2kzz h LEU 790 Ca 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2kzz h LEU 790 Cb 0.34 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2kzz h LEU 790 CO 0.00 0.85 -0.14 0.22 0.09 0.00 0.00 178.44 179.46 2kzz h TYR 791 N 0.63 -0.37 0.00 1.13 5.03 -0.63 -2.05 116.97 120.70 2kzz h TYR 791 Ca 0.10 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.40 2kzz h TYR 791 Cb 0.60 0.12 -0.00 0.00 1.55 0.00 0.00 36.73 39.00 2kzz h TYR 791 CO 0.03 -0.11 -0.03 0.74 -1.32 0.00 0.00 178.16 177.47 2kzz h PHE 792 N -0.59 0.00 0.00 -3.82 0.04 -1.17 0.56 116.94 111.96 2kzz h PHE 792 Ca -0.04 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.49 2kzz h PHE 792 Cb 0.43 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.54 2kzz h PHE 792 CO -0.01 0.03 -1.26 1.49 -0.60 0.00 0.00 178.31 177.96 2kzz h GLU 793 N 0.00 0.00 0.00 1.51 4.81 -1.27 -1.89 114.58 117.75 2kzz h GLU 793 Ca -0.00 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.05 2kzz h GLU 793 Cb 0.16 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2kzz h GLU 793 CO 0.00 0.82 -1.39 -0.09 -0.73 0.00 0.00 179.01 177.63 2kzz h ARG 794 N 0.00 0.00 -2.42 1.92 9.65 -0.57 -3.39 114.38 119.57 2kzz h ARG 794 Ca -0.11 0.00 -0.59 0.00 -1.10 0.00 0.00 59.98 58.18 2kzz h ARG 794 Cb 1.86 0.00 -0.39 0.00 -1.39 0.00 0.00 29.97 30.05 2kzz h ARG 794 CO 0.11 0.32 -0.88 0.66 2.80 0.00 0.00 179.97 182.99 2kzz n TYR 795 N -2.92 0.56 0.09 2.20 4.01 0.19 -4.91 117.16 116.38 2kzz n TYR 795 Ca -0.10 -3.66 -0.03 0.00 -0.16 0.00 0.00 57.90 53.95 2kzz n TYR 795 Cb 0.85 -0.14 0.18 0.00 -0.31 0.00 0.00 39.34 39.92 2kzz n TYR 795 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2kzz h PRO 796 N 5.08 0.25 -0.03 -0.72 0.13 -1.55 -3.18 132.00 131.98 2kzz h PRO 796 Ca 0.19 -0.14 0.01 0.00 -0.87 0.00 0.00 66.00 65.20 2kzz h PRO 796 Cb 0.84 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.98 2kzz h PRO 796 CO 0.51 0.68 0.06 0.78 -0.23 0.00 0.00 178.00 179.81 2kzz h GLY 797 N 1.31 0.00 1.56 1.56 0.00 -1.84 -1.89 103.07 103.77 2kzz h GLY 797 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.09 2kzz h GLY 797 CO 0.08 0.00 -1.07 -2.08 0.00 0.00 0.00 176.54 173.46 2kzz h VAL 798 N 0.00 1.43 -0.09 4.60 2.07 -1.74 -2.61 116.25 119.91 2kzz h VAL 798 Ca 0.01 -2.67 -0.01 0.00 0.82 0.00 0.00 66.70 64.85 2kzz h VAL 798 Cb 0.14 2.64 -0.00 0.00 -1.52 0.00 0.00 31.29 32.54 2kzz h VAL 798 CO -0.00 0.79 -0.00 0.25 0.02 0.00 0.00 177.57 178.63 2kzz h LEU 799 N 0.17 0.16 -0.08 2.57 6.46 -1.51 -0.33 115.31 122.75 2kzz h LEU 799 Ca -0.11 -0.31 0.04 0.00 -0.12 0.00 0.00 57.88 57.38 2kzz h LEU 799 Cb 1.75 -0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 41.58 2kzz h LEU 799 CO 0.18 0.43 -0.29 -0.33 -0.62 0.00 0.00 178.44 177.82 2kzz h GLU 800 N -0.12 -0.37 -0.37 1.25 5.08 -1.56 0.18 114.58 118.66 2kzz h GLU 800 Ca 0.03 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.47 2kzz h GLU 800 Cb 0.35 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 2kzz h GLU 800 CO 0.00 -0.25 0.05 -0.92 -1.00 0.00 0.00 179.01 176.90 2kzz h TYR 801 N -0.39 0.08 -0.41 4.33 3.20 -1.39 0.45 116.97 122.84 2kzz h TYR 801 Ca 0.08 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.03 2kzz h TYR 801 Cb 0.51 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.75 2kzz h TYR 801 CO -0.35 -0.01 0.13 0.52 -1.64 0.00 0.00 178.16 176.81 2kzz h MET 802 N 0.17 0.28 -0.17 1.82 2.86 -0.01 -0.37 114.93 119.51 2kzz h MET 802 Ca 0.18 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.75 2kzz h MET 802 Cb 0.22 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 2kzz h MET 802 CO -0.25 0.18 -0.11 0.93 1.06 0.00 0.00 176.91 178.73 2kzz h GLU 803 N 0.29 0.36 -0.97 1.72 5.08 0.13 -2.50 114.58 118.69 2kzz h GLU 803 Ca 0.19 -0.17 0.11 0.00 -1.00 0.00 0.00 59.36 58.50 2kzz h GLU 803 Cb 0.19 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.36 2kzz h GLU 803 CO -0.21 0.70 0.62 -0.09 -1.00 0.00 0.00 179.01 179.02 2kzz h ARG 804 N 0.03 0.93 -0.14 2.33 2.43 0.12 0.20 114.38 120.28 2kzz h ARG 804 Ca 0.03 -0.06 -0.19 0.00 -0.81 0.00 0.00 59.98 58.96 2kzz h ARG 804 Cb 0.61 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2kzz h ARG 804 CO 0.03 0.61 -0.70 1.15 -1.51 0.00 0.00 179.97 179.56 2kzz h THR 805 N 0.95 1.33 0.00 0.20 2.02 -1.01 -2.37 112.91 114.03 2kzz h THR 805 Ca 0.47 -1.99 0.00 0.00 0.77 0.00 0.00 66.41 65.66 2kzz h THR 805 Cb 0.47 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 68.84 2kzz h THR 805 CO -0.23 0.62 0.00 0.03 0.37 0.00 0.00 175.52 176.31 2kzz h ARG 806 N 0.42 0.00 0.11 6.66 3.08 -0.72 -2.35 114.38 121.59 2kzz h ARG 806 Ca -0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2kzz h ARG 806 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 2kzz h ARG 806 CO 0.13 0.00 -0.05 0.00 -1.07 0.00 0.00 179.97 178.98 2kzz h ALA 807 N 2.27 -0.16 0.00 0.04 0.00 -0.64 -3.22 119.26 117.55 2kzz h ALA 807 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2kzz h ALA 807 Cb 0.53 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2kzz h ALA 807 CO 0.00 -0.15 -0.17 -0.56 0.00 0.00 0.00 179.25 178.38 2kzz h GLN 808 N -1.01 0.00 -0.36 0.00 3.07 -1.49 -2.22 115.11 113.10 2kzz h GLN 808 Ca -0.02 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.67 2kzz h GLN 808 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.66 2kzz h GLN 808 CO 0.03 0.17 0.02 0.00 0.09 0.00 0.00 178.83 179.13 2kzz h ALA 809 N 1.83 1.35 0.08 0.06 0.00 -1.54 -0.31 119.26 120.73 2kzz h ALA 809 Ca -0.00 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.52 2kzz h ALA 809 Cb 0.35 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.00 2kzz h ALA 809 CO 0.02 0.45 -0.78 0.87 0.00 0.00 0.00 179.25 179.81 2kzz h LYS 810 N 0.54 0.38 0.62 0.00 1.57 -1.43 -2.13 116.57 116.13 2kzz h LYS 810 Ca 0.12 -0.52 -0.02 0.00 -1.87 0.00 0.00 60.65 58.35 2kzz h LYS 810 Cb 0.32 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 2kzz h LYS 810 CO 0.01 1.20 -0.45 1.49 -0.57 0.00 0.00 179.45 181.13 2kzz h GLU 811 N -0.18 -1.00 -0.02 3.15 4.57 -1.26 -3.30 114.58 116.54 2kzz h GLU 811 Ca -0.12 0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2kzz h GLU 811 Cb 1.54 0.23 0.00 0.00 -0.16 0.00 0.00 28.75 30.35 2kzz h GLU 811 CO 0.15 -0.66 -0.44 0.00 -1.18 0.00 0.00 179.01 176.88 2kzz n GLN 812 N -5.57 1.22 -1.02 1.92 10.64 -0.14 -4.99 117.38 119.45 2kzz n GLN 812 Ca -0.13 -0.99 -0.01 0.00 -1.83 0.00 0.00 57.00 54.05 2kzz n GLN 812 Cb 0.45 -1.48 -0.00 0.00 -0.86 0.00 0.00 30.24 28.35 2kzz n GLN 812 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2kzz n GLY 813 N 1.41 0.40 3.51 2.61 0.00 -0.80 -4.99 105.19 107.33 2kzz n GLY 813 Ca 0.10 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 2kzz n GLY 813 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2kzz s TYR 814 N -1.76 -0.44 0.21 1.61 -0.85 -1.24 -0.49 117.35 114.38 2kzz s TYR 814 Ca 0.00 0.17 0.07 0.00 -0.52 0.00 0.00 57.07 56.79 2kzz s TYR 814 Cb 0.00 0.58 -0.05 0.00 0.38 0.00 0.00 41.96 42.87 2kzz s TYR 814 CO 0.00 -0.93 -0.13 0.14 -1.52 0.00 0.00 175.55 173.11 2kzz s VAL 815 N -3.79 1.66 0.18 -3.49 -7.23 -0.54 -4.26 120.40 102.93 2kzz s VAL 815 Ca 0.03 -2.19 0.04 0.00 -1.81 0.00 0.00 61.98 58.05 2kzz s VAL 815 Cb -0.02 -2.07 -0.05 0.00 0.56 0.00 0.00 36.38 34.80 2kzz s VAL 815 CO -0.08 -0.58 -0.05 -1.83 -0.31 0.00 0.00 175.10 172.25 2kzz s GLU 816 N -3.67 1.15 0.61 4.82 -1.05 -1.26 -0.90 118.70 118.41 2kzz s GLU 816 Ca 0.23 -1.53 0.02 0.00 -0.15 0.00 0.00 54.97 53.53 2kzz s GLU 816 Cb 0.00 -0.54 0.08 0.00 -0.44 0.00 0.00 34.13 33.23 2kzz s GLU 816 CO 0.07 -0.02 0.85 0.95 0.95 0.00 0.00 175.26 178.06 2kzz s THR 817 N -3.43 2.41 0.53 1.83 -4.23 0.39 -4.59 115.64 108.54 2kzz s THR 817 Ca 0.22 -0.70 0.20 0.00 -1.18 0.00 0.00 61.69 60.22 2kzz s THR 817 Cb 0.04 -2.70 0.32 0.00 1.34 0.00 0.00 72.50 71.50 2kzz s THR 817 CO 0.04 0.00 2.09 -0.07 -0.54 0.00 0.00 174.62 176.14 2kzz h LEU 818 N -0.11 0.00 0.00 4.79 4.07 -1.90 -1.02 115.31 121.14 2kzz h LEU 818 Ca -0.38 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.58 2kzz h LEU 818 Cb 1.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.02 2kzz h LEU 818 CO 0.45 0.00 -0.57 0.44 -1.08 0.00 0.00 178.44 177.69 2kzz h ASP 819 N 0.00 0.00 0.00 -0.43 3.32 -1.96 -3.48 116.42 113.88 2kzz h ASP 819 Ca 0.10 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2kzz h ASP 819 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2kzz h ASP 819 CO -0.00 0.09 0.00 0.61 -1.72 0.00 0.00 179.24 178.22 2kzz n GLY 820 N 1.32 1.49 3.73 2.75 0.00 -0.39 -4.49 105.19 109.61 2kzz n GLY 820 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2kzz n GLY 820 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2kzz n ARG 821 N -0.01 2.50 -4.31 1.61 0.63 -1.26 -3.36 116.66 112.45 2kzz n ARG 821 Ca 0.00 0.88 -0.30 0.00 -0.92 0.00 0.00 57.85 57.51 2kzz n ARG 821 Cb 0.00 -2.60 -0.10 0.00 0.45 0.00 0.00 32.46 30.21 2kzz n ARG 821 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2kzz s ARG 822 N -1.11 2.24 -0.21 -0.14 0.52 -1.26 -0.46 118.95 118.52 2kzz s ARG 822 Ca 0.61 -0.94 0.01 0.00 -0.52 0.00 0.00 55.73 54.88 2kzz s ARG 822 Cb -0.53 -2.35 0.05 0.00 0.52 0.00 0.00 34.95 32.64 2kzz s ARG 822 CO 0.55 0.53 -0.07 -1.17 0.02 0.00 0.00 175.30 175.16 2kzz s LEU 823 N -1.98 2.36 -0.08 2.53 2.96 -0.07 -4.67 118.68 119.72 2kzz s LEU 823 Ca 0.20 -1.01 -0.26 0.00 -0.22 0.00 0.00 54.13 52.84 2kzz s LEU 823 Cb -0.11 -1.17 -0.03 0.00 0.50 0.00 0.00 46.19 45.38 2kzz s LEU 823 CO 0.12 -0.20 0.84 -0.31 -1.32 0.00 0.00 176.35 175.48 2kzz s TYR 824 N 1.42 3.54 -0.55 5.38 2.02 -1.26 -1.46 117.35 126.44 2kzz s TYR 824 Ca -0.03 1.39 -0.07 0.00 -0.37 0.00 0.00 57.07 57.99 2kzz s TYR 824 Cb -0.17 -2.98 0.14 0.00 -0.40 0.00 0.00 41.96 38.55 2kzz s TYR 824 CO -0.07 -0.07 0.41 -0.51 -1.57 0.00 0.00 175.55 173.74 2kzz s LEU 825 N 1.38 5.61 0.43 -1.29 1.43 0.35 -4.94 118.68 121.66 2kzz s LEU 825 Ca 0.42 -2.33 0.24 0.00 -1.03 0.00 0.00 54.13 51.43 2kzz s LEU 825 Cb -0.18 -1.96 0.68 0.00 0.03 0.00 0.00 46.19 44.76 2kzz s LEU 825 CO 0.19 -0.55 1.72 1.55 0.23 0.00 0.00 176.35 179.49 2kzz h PRO 826 N 7.85 0.00 -0.48 1.29 0.13 -1.96 -3.25 132.00 135.58 2kzz h PRO 826 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 2kzz h PRO 826 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2kzz h PRO 826 CO 0.77 0.16 0.00 -0.25 -0.23 0.00 0.00 178.00 178.46 2kzz n ASP 827 N -3.21 4.81 0.15 1.44 8.00 -1.26 -4.52 116.55 121.97 2kzz n ASP 827 Ca 0.02 -2.80 0.03 0.00 0.71 0.00 0.00 54.79 52.75 2kzz n ASP 827 Cb 0.49 -0.59 0.43 0.00 -0.02 0.00 0.00 41.12 41.43 2kzz n ASP 827 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2kzz h ILE 828 N 3.25 1.15 -0.16 0.53 6.09 -1.87 -1.70 117.51 124.80 2kzz h ILE 828 Ca 0.00 -0.67 0.00 0.00 -1.37 0.00 0.00 64.86 62.82 2kzz h ILE 828 Cb 1.63 1.19 0.00 0.00 0.47 0.00 0.00 36.82 40.12 2kzz h ILE 828 CO 0.33 0.21 0.00 0.29 -3.07 0.00 0.00 178.15 175.90 2kzz n LYS 829 N -4.31 2.38 -0.16 2.19 5.02 -1.26 -4.91 118.16 117.10 2kzz n LYS 829 Ca -0.01 -2.58 0.16 0.00 -2.02 0.00 0.00 58.31 53.86 2kzz n LYS 829 Cb 0.24 -1.61 0.30 0.00 -0.02 0.00 0.00 35.03 33.94 2kzz n LYS 829 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2kzz n SER 830 N -0.71 0.18 0.00 4.39 2.88 -0.64 -4.74 113.62 114.97 2kzz n SER 830 Ca 0.17 0.84 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 2kzz n SER 830 Cb 0.72 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 2kzz n SER 830 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2kzz n SER 831 N -4.13 0.00 -4.93 -3.46 3.41 -1.26 -5.00 113.62 98.25 2kzz n SER 831 Ca 0.19 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.52 2kzz n SER 831 Cb 0.66 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.57 2kzz n SER 831 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2kzz s ASN 832 N -3.51 6.36 0.00 4.04 3.84 -1.26 -5.08 114.94 119.33 2kzz s ASN 832 Ca 0.00 0.26 0.00 0.00 0.21 0.00 0.00 52.86 53.33 2kzz s ASN 832 Cb 0.00 -1.95 0.00 0.00 -0.55 0.00 0.00 41.25 38.75 2kzz s ASN 832 CO 0.00 0.10 0.27 0.61 -2.79 0.00 0.00 177.10 175.29 2kzz n GLY 833 N -0.13 -0.53 0.29 1.21 0.00 -1.26 -3.60 105.19 101.17 2kzz n GLY 833 Ca -0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.01 2kzz n GLY 833 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kzz h ALA 834 N -2.00 1.73 -0.51 4.61 0.00 -1.98 -1.71 119.26 119.40 2kzz h ALA 834 Ca 0.00 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2kzz h ALA 834 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2kzz h ALA 834 CO 0.00 0.23 0.07 -0.09 0.00 0.00 0.00 179.25 179.46 2kzz h ARG 835 N 0.41 0.80 0.00 0.00 2.43 -1.94 -1.03 114.38 115.05 2kzz h ARG 835 Ca 0.11 -0.19 -0.10 0.00 -0.81 0.00 0.00 59.98 58.99 2kzz h ARG 835 Cb 0.01 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2kzz h ARG 835 CO -0.02 0.76 -0.66 -0.09 -1.51 0.00 0.00 179.97 178.46 2kzz h ARG 836 N 0.76 0.00 -0.30 0.20 2.43 -1.52 -2.96 114.38 113.00 2kzz h ARG 836 Ca 0.16 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.22 2kzz h ARG 836 Cb 0.36 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2kzz h ARG 836 CO 0.01 0.40 -0.25 0.00 -1.51 0.00 0.00 179.97 178.62 2kzz h ALA 837 N 1.55 0.43 -0.74 2.80 0.00 -0.93 -1.92 119.26 120.44 2kzz h ALA 837 Ca -0.03 -0.38 0.03 0.00 0.00 0.00 0.00 54.91 54.52 2kzz h ALA 837 Cb 1.37 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 2kzz h ALA 837 CO 0.05 0.42 0.47 0.00 0.00 0.00 0.00 179.25 180.19 2kzz h ALA 838 N 0.73 0.97 0.00 0.00 0.00 -1.21 -0.59 119.26 119.15 2kzz h ALA 838 Ca 0.05 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2kzz h ALA 838 Cb 0.80 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2kzz h ALA 838 CO 0.06 0.28 -0.19 0.00 0.00 0.00 0.00 179.25 179.40 2kzz h ALA 839 N 1.31 1.25 0.01 0.00 0.00 -1.34 0.09 119.26 120.58 2kzz h ALA 839 Ca 0.29 -0.18 -0.22 0.00 0.00 0.00 0.00 54.91 54.81 2kzz h ALA 839 Cb -0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2kzz h ALA 839 CO -0.10 0.24 -1.09 0.93 0.00 0.00 0.00 179.25 179.23 2kzz h GLU 840 N 0.00 0.02 -0.02 0.00 5.08 -0.35 -2.79 114.58 116.52 2kzz h GLU 840 Ca -0.00 -0.03 -0.21 0.00 -1.00 0.00 0.00 59.36 58.12 2kzz h GLU 840 Cb 0.49 0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.76 2kzz h GLU 840 CO 0.03 0.96 -0.79 0.00 -1.00 0.00 0.00 179.01 178.21 2kzz h ARG 841 N 0.00 0.58 -0.46 2.33 3.08 -0.59 -3.09 114.38 116.23 2kzz h ARG 841 Ca -0.05 -0.59 -0.01 0.00 0.07 0.00 0.00 59.98 59.41 2kzz h ARG 841 Cb 1.81 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 31.99 2kzz h ARG 841 CO 0.13 1.20 0.24 0.00 -1.07 0.00 0.00 179.97 180.47 2kzz h ALA 842 N 0.39 1.56 -0.22 0.04 0.00 -1.09 -1.61 119.26 118.33 2kzz h ALA 842 Ca -0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2kzz h ALA 842 Cb 1.46 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2kzz h ALA 842 CO 0.16 0.36 0.12 0.00 0.00 0.00 0.00 179.25 179.89 2kzz h ALA 843 N 1.63 0.28 -0.31 0.00 0.00 -1.45 0.13 119.26 119.56 2kzz h ALA 843 Ca 0.16 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2kzz h ALA 843 Cb 0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2kzz h ALA 843 CO -0.03 -0.18 -0.46 0.82 0.00 0.00 0.00 179.25 179.40 2kzz h ILE 844 N 0.25 1.28 0.50 0.00 2.04 -1.44 -3.37 117.51 116.77 2kzz h ILE 844 Ca 0.08 -1.65 -0.02 0.00 1.00 0.00 0.00 64.86 64.26 2kzz h ILE 844 Cb 0.07 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2kzz h ILE 844 CO -0.01 0.54 -0.24 -1.13 0.00 0.00 0.00 178.15 177.31 2kzz h ASN 845 N 0.65 -0.57 -0.91 1.72 -0.73 -1.02 -3.37 115.58 111.34 2kzz h ASN 845 Ca 0.04 0.02 0.21 0.00 1.87 0.00 0.00 56.30 58.43 2kzz h ASN 845 Cb 1.04 0.15 -0.17 0.00 0.27 0.00 0.00 38.32 39.61 2kzz h ASN 845 CO 0.10 -0.18 -0.14 0.00 -0.37 0.00 0.00 177.43 176.84 2kzz n ALA 846 N -2.69 0.31 -0.07 1.57 0.00 0.45 -0.75 120.51 119.32 2kzz n ALA 846 Ca -0.08 1.00 0.09 0.00 0.00 0.00 0.00 53.44 54.45 2kzz n ALA 846 Cb 0.27 -0.64 0.47 0.00 0.00 0.00 0.00 19.45 19.54 2kzz n ALA 846 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2kzz h PRO 847 N 0.00 0.47 0.21 0.00 0.11 -1.73 0.43 132.00 131.48 2kzz h PRO 847 Ca 0.48 -0.03 -0.32 0.00 0.11 0.00 0.00 66.00 66.24 2kzz h PRO 847 Cb 0.84 -0.11 0.02 0.00 0.11 0.00 0.00 31.00 31.86 2kzz h PRO 847 CO -0.91 0.31 -1.50 0.52 -0.21 0.00 0.00 178.00 176.20 2kzz h MET 848 N 0.48 0.43 -0.06 1.05 2.86 -1.13 -2.96 114.93 115.60 2kzz h MET 848 Ca 0.25 -0.74 -0.02 0.00 -2.06 0.00 0.00 59.70 57.12 2kzz h MET 848 Cb 0.37 0.28 -0.00 0.00 0.06 0.00 0.00 31.60 32.31 2kzz h MET 848 CO -0.07 1.36 -0.06 0.37 1.06 0.00 0.00 176.91 179.57 2kzz h GLN 849 N 0.03 0.14 -0.72 1.72 4.15 -1.31 -2.11 115.11 117.01 2kzz h GLN 849 Ca -0.28 -0.08 0.03 0.00 0.77 0.00 0.00 58.65 59.09 2kzz h GLN 849 Cb 2.05 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 29.70 2kzz h GLN 849 CO 0.21 0.59 0.46 0.78 -1.93 0.00 0.00 178.83 178.94 2kzz h GLY 850 N -0.30 1.04 1.59 2.39 0.00 -0.27 0.33 103.07 107.84 2kzz h GLY 850 Ca 0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 2kzz h GLY 850 CO 0.01 0.30 -0.07 -0.84 0.00 0.00 0.00 176.54 175.94 2kzz h THR 851 N 0.90 1.22 -0.18 4.70 2.02 -1.50 0.86 112.91 120.92 2kzz h THR 851 Ca 0.29 -0.92 -0.03 0.00 0.77 0.00 0.00 66.41 66.53 2kzz h THR 851 Cb 0.00 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2kzz h THR 851 CO -0.10 0.31 0.01 0.00 0.37 0.00 0.00 175.52 176.11 2kzz h ALA 852 N 1.45 0.24 -0.78 6.16 0.00 -0.63 -0.64 119.26 125.07 2kzz h ALA 852 Ca 0.09 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.90 2kzz h ALA 852 Cb 0.42 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 2kzz h ALA 852 CO 0.02 -0.07 0.45 0.00 0.00 0.00 0.00 179.25 179.65 2kzz h ALA 853 N 0.80 1.08 -0.35 0.00 0.00 -0.37 0.42 119.26 120.83 2kzz h ALA 853 Ca 0.05 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2kzz h ALA 853 Cb 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2kzz h ALA 853 CO 0.01 0.11 0.00 -0.44 0.00 0.00 0.00 179.25 178.93 2kzz h ASP 854 N 0.78 0.61 -0.58 0.00 3.32 -0.64 -1.13 116.42 118.79 2kzz h ASP 854 Ca 0.36 -0.31 0.03 0.00 0.02 0.00 0.00 57.03 57.13 2kzz h ASP 854 Cb 0.27 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 2kzz h ASP 854 CO -0.21 0.77 0.35 0.40 -1.72 0.00 0.00 179.24 178.82 2kzz h ILE 855 N 0.43 1.06 -0.52 0.35 2.04 -0.17 -0.40 117.51 120.30 2kzz h ILE 855 Ca 0.10 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 2kzz h ILE 855 Cb 0.45 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 2kzz h ILE 855 CO 0.02 0.12 0.16 0.40 0.00 0.00 0.00 178.15 178.85 2kzz h ILE 856 N 0.68 1.23 -0.46 -0.67 2.04 -0.80 -1.06 117.51 118.48 2kzz h ILE 856 Ca 0.23 -0.78 -0.04 0.00 1.00 0.00 0.00 64.86 65.28 2kzz h ILE 856 Cb 0.03 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2kzz h ILE 856 CO -0.10 0.29 0.15 0.11 0.00 0.00 0.00 178.15 178.59 2kzz h LYS 857 N 0.71 0.71 -0.53 2.37 1.57 -0.79 -1.19 116.57 119.42 2kzz h LYS 857 Ca 0.17 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2kzz h LYS 857 Cb 0.28 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 2kzz h LYS 857 CO -0.00 0.68 0.23 0.00 -0.57 0.00 0.00 179.45 179.78 2kzz h ARG 858 N 0.61 0.75 -0.35 3.15 3.08 -0.90 -1.74 114.38 118.98 2kzz h ARG 858 Ca 0.15 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 2kzz h ARG 858 Cb 0.26 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2kzz h ARG 858 CO -0.01 0.61 -0.17 0.00 -1.07 0.00 0.00 179.97 179.33 2kzz h ALA 859 N 1.50 0.49 -0.20 0.04 0.00 -0.60 -1.25 119.26 119.25 2kzz h ALA 859 Ca 0.18 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.76 2kzz h ALA 859 Cb 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2kzz h ALA 859 CO -0.02 0.41 0.08 0.52 0.00 0.00 0.00 179.25 180.25 2kzz h MET 860 N 0.51 0.18 -0.39 0.00 2.86 -0.74 0.21 114.93 117.56 2kzz h MET 860 Ca 0.08 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.73 2kzz h MET 860 Cb 0.71 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 2kzz h MET 860 CO 0.05 0.12 0.21 0.82 1.06 0.00 0.00 176.91 179.17 2kzz h ILE 861 N 0.19 1.01 -0.08 -1.22 2.04 -1.26 0.28 117.51 118.47 2kzz h ILE 861 Ca 0.08 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 2kzz h ILE 861 Cb 0.03 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2kzz h ILE 861 CO -0.07 0.08 0.04 0.00 0.00 0.00 0.00 178.15 178.20 2kzz h ALA 862 N 1.19 0.10 -0.56 1.87 0.00 -0.77 -0.11 119.26 120.99 2kzz h ALA 862 Ca 0.16 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 2kzz h ALA 862 Cb 0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2kzz h ALA 862 CO -0.10 -0.34 -0.08 0.28 0.00 0.00 0.00 179.25 179.01 2kzz h VAL 863 N 0.00 1.27 -0.21 0.00 2.07 -0.29 -2.42 116.25 116.67 2kzz h VAL 863 Ca 0.03 -1.23 -0.05 0.00 0.82 0.00 0.00 66.70 66.26 2kzz h VAL 863 Cb 0.12 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 2kzz h VAL 863 CO -0.00 0.44 -0.09 -0.78 0.02 0.00 0.00 177.57 177.15 2kzz h ASP 864 N 0.92 0.32 -0.12 0.57 3.58 -0.27 -1.22 116.42 120.20 2kzz h ASP 864 Ca 0.15 -0.06 -0.12 0.00 0.42 0.00 0.00 57.03 57.41 2kzz h ASP 864 Cb 0.64 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 2kzz h ASP 864 CO 0.04 0.45 -0.33 0.00 -2.88 0.00 0.00 179.24 176.53 2kzz h ALA 865 N 1.59 0.90 -0.29 -0.78 0.00 -0.61 0.20 119.26 120.27 2kzz h ALA 865 Ca 0.07 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 2kzz h ALA 865 Cb 0.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2kzz h ALA 865 CO 0.02 0.63 -0.24 2.35 0.00 0.00 0.00 179.25 182.01 2kzz h TRP 866 N 0.52 0.79 -0.24 0.00 7.01 -0.93 -2.26 115.95 120.85 2kzz h TRP 866 Ca 0.06 -0.23 0.02 0.00 2.11 0.00 0.00 58.89 60.85 2kzz h TRP 866 Cb 0.82 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.69 2kzz h TRP 866 CO 0.03 0.95 0.12 -0.07 -2.79 0.00 0.00 178.44 176.68 2kzz h LEU 867 N 0.41 0.17 -0.74 0.65 4.07 -0.96 0.25 115.31 119.16 2kzz h LEU 867 Ca 0.05 0.01 -0.09 0.00 0.08 0.00 0.00 57.88 57.93 2kzz h LEU 867 Cb 0.79 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.49 2kzz h LEU 867 CO 0.06 0.13 -0.04 1.56 -1.08 0.00 0.00 178.44 179.08 2kzz h GLN 868 N 0.25 0.93 0.01 1.13 1.08 -0.97 0.25 115.11 117.78 2kzz h GLN 868 Ca 0.10 -0.29 -0.00 0.00 -1.45 0.00 0.00 58.65 57.01 2kzz h GLN 868 Cb 0.03 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.38 2kzz h GLN 868 CO -0.07 0.94 -0.00 0.00 -0.95 0.00 0.00 178.83 178.75 2kzz h ALA 869 N 1.10 -0.01 0.00 3.87 0.00 -1.09 -3.37 119.26 119.76 2kzz h ALA 869 Ca 0.15 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 2kzz h ALA 869 Cb 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2kzz h ALA 869 CO 0.03 -0.07 -0.83 1.49 0.00 0.00 0.00 179.25 179.87 2kzz h GLU 870 N -0.89 0.00 -6.05 0.00 4.81 -0.59 -3.49 114.58 108.37 2kzz h GLU 870 Ca -0.00 0.00 -0.43 0.00 -0.13 0.00 0.00 59.36 58.80 2kzz h GLU 870 Cb 0.83 0.00 0.06 0.00 0.63 0.00 0.00 28.75 30.27 2kzz h GLU 870 CO 0.00 0.29 -0.74 0.94 -0.73 0.00 0.00 179.01 178.77 2kzz n GLN 871 N -3.01 -6.52 -1.01 1.92 -0.06 0.08 -5.00 117.38 103.79 2kzz n GLN 871 Ca -0.02 0.71 -0.29 0.00 -2.00 0.00 0.00 57.00 55.40 2kzz n GLN 871 Cb 0.72 -5.64 0.22 0.00 -4.06 0.00 0.00 30.24 21.47 2kzz n GLN 871 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2kzz s PRO 872 N -6.32 -0.60 -1.49 3.69 0.04 -1.26 -4.86 135.00 124.20 2kzz s PRO 872 Ca 0.50 0.31 -0.10 0.00 0.04 0.00 0.00 61.00 61.75 2kzz s PRO 872 Cb -0.24 -1.64 0.01 0.00 0.04 0.00 0.00 34.50 32.68 2kzz s PRO 872 CO 0.78 -3.37 2.53 0.54 0.04 0.00 0.00 177.00 177.52 2kzz n ARG 873 N -4.59 3.63 -3.85 4.56 1.74 -1.26 -4.85 116.66 112.04 2kzz n ARG 873 Ca 0.08 -2.70 -0.12 0.00 -0.77 0.00 0.00 57.85 54.35 2kzz n ARG 873 Cb 0.58 -2.92 -0.11 0.00 -1.02 0.00 0.00 32.46 28.99 2kzz n ARG 873 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2kzz s VAL 874 N 1.63 0.05 -0.04 1.55 0.11 -1.26 -1.63 120.40 120.81 2kzz s VAL 874 Ca 0.57 -0.37 0.04 0.00 -2.93 0.00 0.00 61.98 59.29 2kzz s VAL 874 Cb 0.16 -0.33 -0.00 0.00 -1.53 0.00 0.00 36.38 34.68 2kzz s VAL 874 CO -0.07 -0.21 -0.16 -0.13 -3.33 0.00 0.00 175.10 171.20 2kzz s ARG 875 N -0.70 1.74 -0.35 1.54 0.52 -0.87 -5.00 118.95 115.84 2kzz s ARG 875 Ca -0.08 -0.58 -0.21 0.00 -0.52 0.00 0.00 55.73 54.35 2kzz s ARG 875 Cb -0.05 -1.51 0.00 0.00 0.52 0.00 0.00 34.95 33.92 2kzz s ARG 875 CO 0.01 0.22 0.64 1.41 0.02 0.00 0.00 175.30 177.60 2kzz s MET 876 N 0.09 3.73 -0.13 3.54 -2.45 -1.26 -1.60 119.30 121.22 2kzz s MET 876 Ca -0.05 0.12 0.17 0.00 -1.25 0.00 0.00 55.69 54.68 2kzz s MET 876 Cb -0.12 -3.79 -0.25 0.00 1.25 0.00 0.00 34.83 31.93 2kzz s MET 876 CO 0.02 -0.71 0.17 0.44 1.05 0.00 0.00 175.02 176.00 2kzz n ILE 877 N 5.56 0.85 -3.91 10.11 -5.35 0.25 -4.56 119.36 122.30 2kzz n ILE 877 Ca -0.01 -0.66 -0.09 0.00 -0.27 0.00 0.00 62.75 61.72 2kzz n ILE 877 Cb 0.49 -0.35 -0.07 0.00 -1.74 0.00 0.00 39.64 37.97 2kzz n ILE 877 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2kzz s MET 878 N -2.71 1.01 -0.08 6.28 -1.94 -0.79 -4.68 119.30 116.39 2kzz s MET 878 Ca -0.08 -1.08 -0.03 0.00 -1.71 0.00 0.00 55.69 52.79 2kzz s MET 878 Cb 0.07 0.36 0.04 0.00 2.01 0.00 0.00 34.83 37.32 2kzz s MET 878 CO 0.75 -0.35 0.15 -1.14 -0.01 0.00 0.00 175.02 174.43 2kzz s GLN 879 N -3.92 0.04 -0.16 2.03 -0.44 -1.26 -0.63 119.66 115.32 2kzz s GLN 879 Ca 0.12 0.52 -0.08 0.00 -2.50 0.00 0.00 55.36 53.42 2kzz s GLN 879 Cb 0.04 -0.27 0.06 0.00 -1.64 0.00 0.00 33.01 31.20 2kzz s GLN 879 CO -0.05 -0.29 0.37 0.54 0.50 0.00 0.00 175.29 176.36 2kzz s VAL 880 N 2.11 -0.10 0.00 1.34 0.11 -0.71 -4.97 120.40 118.18 2kzz s VAL 880 Ca 0.01 0.12 0.00 0.00 -2.93 0.00 0.00 61.98 59.18 2kzz s VAL 880 Cb -0.12 -0.56 0.00 0.00 -1.53 0.00 0.00 36.38 34.17 2kzz s VAL 880 CO -0.06 0.05 0.00 1.41 -3.33 0.00 0.00 175.10 173.17 2kzz n HIS 881 N 4.39 0.00 -1.14 1.54 8.25 -1.26 -1.36 115.22 125.65 2kzz n HIS 881 Ca -0.22 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.12 2kzz n HIS 881 Cb 0.54 0.00 0.25 0.00 1.12 0.00 0.00 29.99 31.90 2kzz n HIS 881 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2kzz n ASP 882 N 5.35 4.26 -4.19 0.41 8.00 -1.26 -4.96 116.55 124.16 2kzz n ASP 882 Ca 0.00 -3.40 -0.16 0.00 0.71 0.00 0.00 54.79 51.94 2kzz n ASP 882 Cb 0.00 -0.77 -0.11 0.00 -0.02 0.00 0.00 41.12 40.22 2kzz n ASP 882 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2kzz s GLU 883 N -3.12 0.89 -0.07 -1.24 -1.05 -0.46 -1.23 118.70 112.41 2kzz s GLU 883 Ca 0.55 -1.13 0.04 0.00 -0.15 0.00 0.00 54.97 54.28 2kzz s GLU 883 Cb 0.45 -0.71 -0.01 0.00 -0.44 0.00 0.00 34.13 33.41 2kzz s GLU 883 CO 0.11 0.13 -0.21 -0.51 0.95 0.00 0.00 175.26 175.74 2kzz s LEU 884 N -2.27 2.29 -0.06 1.83 1.43 -0.18 -1.74 118.68 119.97 2kzz s LEU 884 Ca 0.05 -0.43 0.05 0.00 -1.03 0.00 0.00 54.13 52.76 2kzz s LEU 884 Cb -0.05 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 2kzz s LEU 884 CO 0.02 0.24 -0.21 -0.69 0.23 0.00 0.00 176.35 175.94 2kzz s VAL 885 N -0.13 2.43 0.41 -1.59 1.01 0.20 -1.79 120.40 120.94 2kzz s VAL 885 Ca -0.04 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.05 2kzz s VAL 885 Cb -0.14 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2kzz s VAL 885 CO 0.04 0.57 0.07 -0.36 0.00 0.00 0.00 175.10 175.42 2kzz s PHE 886 N -0.25 1.91 -0.13 5.22 0.40 -0.48 0.84 117.98 125.50 2kzz s PHE 886 Ca -0.00 -1.08 0.01 0.00 -0.60 0.00 0.00 56.93 55.26 2kzz s PHE 886 Cb -0.13 -1.35 0.02 0.00 0.51 0.00 0.00 43.02 42.07 2kzz s PHE 886 CO 0.03 -0.04 -0.14 -1.21 0.70 0.00 0.00 175.22 174.56 2kzz s GLU 887 N -3.79 2.17 0.02 0.44 2.02 -0.63 -1.31 118.70 117.63 2kzz s GLU 887 Ca 0.24 -0.53 0.06 0.00 0.02 0.00 0.00 54.97 54.77 2kzz s GLU 887 Cb 0.05 -1.94 -0.02 0.00 0.10 0.00 0.00 34.13 32.31 2kzz s GLU 887 CO 0.12 -0.16 -0.19 0.08 0.02 0.00 0.00 175.26 175.14 2kzz s VAL 888 N 1.27 1.49 0.24 2.63 1.01 0.11 -2.05 120.40 125.10 2kzz s VAL 888 Ca -0.01 -1.02 -0.31 0.00 0.00 0.00 0.00 61.98 60.65 2kzz s VAL 888 Cb -0.14 -1.29 -0.11 0.00 0.00 0.00 0.00 36.38 34.85 2kzz s VAL 888 CO -0.06 0.24 1.58 -2.28 0.00 0.00 0.00 175.10 174.58 2kzz s HIS 889 N -0.68 2.90 0.41 5.22 2.46 -0.64 -0.18 115.29 124.78 2kzz s HIS 889 Ca 0.06 0.72 0.17 0.00 0.47 0.00 0.00 55.06 56.48 2kzz s HIS 889 Cb -0.08 -4.00 1.07 0.00 -0.13 0.00 0.00 32.58 29.44 2kzz s HIS 889 CO 0.01 -3.51 1.83 1.57 -2.47 0.00 0.00 174.74 172.17 2kzz h LYS 890 N 5.63 0.41 0.00 2.88 2.10 -1.60 0.36 116.57 126.35 2kzz h LYS 890 Ca -0.45 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 2kzz h LYS 890 Cb 1.21 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 2kzz h LYS 890 CO 0.84 0.27 -0.00 -0.25 -2.00 0.00 0.00 179.45 178.31 2kzz n ASP 891 N -4.54 0.53 -0.04 7.07 8.00 -1.26 -3.75 116.55 122.55 2kzz n ASP 891 Ca 0.21 0.55 0.09 0.00 0.71 0.00 0.00 54.79 56.35 2kzz n ASP 891 Cb 0.74 -0.69 -0.10 0.00 -0.02 0.00 0.00 41.12 41.05 2kzz n ASP 891 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2kzz n ASP 892 N -1.99 1.00 -0.30 -2.24 8.00 0.12 -4.79 116.55 116.34 2kzz n ASP 892 Ca 0.06 -1.00 0.03 0.00 0.71 0.00 0.00 54.79 54.59 2kzz n ASP 892 Cb 0.40 0.96 0.09 0.00 -0.02 0.00 0.00 41.12 42.54 2kzz n ASP 892 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2kzz n VAL 893 N -1.34 -0.38 0.10 2.53 0.31 -0.92 -2.34 118.33 116.30 2kzz n VAL 893 Ca 0.04 1.91 -0.13 0.00 -0.01 0.00 0.00 64.34 66.15 2kzz n VAL 893 Cb 0.31 -2.61 -0.08 0.00 -0.91 0.00 0.00 33.84 30.55 2kzz n VAL 893 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2kzz h ASP 894 N 0.00 -0.23 -0.16 4.52 3.32 -1.89 -1.14 116.42 120.84 2kzz h ASP 894 Ca 0.36 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 2kzz h ASP 894 Cb 0.57 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 2kzz h ASP 894 CO -0.84 0.11 -0.12 0.00 -1.72 0.00 0.00 179.24 176.67 2kzz h ALA 895 N 0.13 1.23 -0.17 3.45 0.00 -1.90 -1.96 119.26 120.04 2kzz h ALA 895 Ca -0.03 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.41 2kzz h ALA 895 Cb 0.43 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2kzz h ALA 895 CO 0.04 0.50 -0.70 0.28 0.00 0.00 0.00 179.25 179.38 2kzz h VAL 896 N 0.48 1.30 -0.34 0.00 2.07 -1.51 -2.67 116.25 115.58 2kzz h VAL 896 Ca 0.09 -1.95 -0.12 0.00 0.82 0.00 0.00 66.70 65.54 2kzz h VAL 896 Cb 0.50 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 2kzz h VAL 896 CO 0.03 0.61 -0.28 0.00 0.02 0.00 0.00 177.57 177.95 2kzz h ALA 897 N 0.71 0.86 -0.56 1.67 0.00 -1.05 -0.07 119.26 120.82 2kzz h ALA 897 Ca -0.03 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 2kzz h ALA 897 Cb 1.31 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2kzz h ALA 897 CO 0.14 0.63 0.25 0.87 0.00 0.00 0.00 179.25 181.14 2kzz h LYS 898 N 0.62 0.83 -0.13 0.00 1.57 -1.35 -2.02 116.57 116.08 2kzz h LYS 898 Ca 0.08 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2kzz h LYS 898 Cb 0.79 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 2kzz h LYS 898 CO 0.07 0.70 0.03 0.37 -0.57 0.00 0.00 179.45 180.05 2kzz h GLN 899 N 0.77 0.21 -0.86 3.15 5.75 -1.10 -1.21 115.11 121.83 2kzz h GLN 899 Ca 0.19 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.63 2kzz h GLN 899 Cb 0.16 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.65 2kzz h GLN 899 CO -0.02 0.38 0.49 0.82 -2.65 0.00 0.00 178.83 177.85 2kzz h ILE 900 N 0.01 1.24 -0.52 2.39 1.08 -1.01 -0.06 117.51 120.65 2kzz h ILE 900 Ca 0.04 -0.58 0.00 0.00 -0.39 0.00 0.00 64.86 63.93 2kzz h ILE 900 Cb 0.26 0.07 -0.03 0.00 -3.07 0.00 0.00 36.82 34.06 2kzz h ILE 900 CO 0.00 0.27 0.34 -0.74 -0.69 0.00 0.00 178.15 177.33 2kzz h HIS 901 N 1.19 0.66 -0.26 1.37 2.76 -1.11 -1.15 115.15 118.62 2kzz h HIS 901 Ca 0.30 0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.35 2kzz h HIS 901 Cb 0.00 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 28.74 2kzz h HIS 901 CO 0.01 0.42 -0.39 1.96 -1.30 0.00 0.00 177.93 178.63 2kzz h GLN 902 N 0.71 0.72 -0.62 5.26 4.20 -0.69 -2.41 115.11 122.27 2kzz h GLN 902 Ca 0.19 -0.43 -0.03 0.00 0.06 0.00 0.00 58.65 58.44 2kzz h GLN 902 Cb -0.07 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 2kzz h GLN 902 CO -0.04 1.05 0.26 -0.07 -0.67 0.00 0.00 178.83 179.36 2kzz h LEU 903 N 0.45 0.82 0.22 1.46 3.38 -0.83 -1.94 115.31 118.87 2kzz h LEU 903 Ca 0.02 -0.10 -0.33 0.00 0.09 0.00 0.00 57.88 57.57 2kzz h LEU 903 Cb 0.98 -0.21 0.04 0.00 0.09 0.00 0.00 40.66 41.56 2kzz h LEU 903 CO 0.09 0.72 -1.42 0.24 0.09 0.00 0.00 178.44 178.16 2kzz h MET 904 N 0.89 0.56 -0.39 1.13 2.86 -1.23 -2.51 114.93 116.25 2kzz h MET 904 Ca 0.21 -0.91 0.00 0.00 -2.06 0.00 0.00 59.70 56.95 2kzz h MET 904 Cb 0.15 0.33 0.00 0.00 0.06 0.00 0.00 31.60 32.14 2kzz h MET 904 CO -0.02 1.43 0.00 -0.85 1.06 0.00 0.00 176.91 178.53 2kzz n GLU 905 N -3.75 2.11 0.00 1.72 0.28 -0.91 -4.56 120.64 115.54 2kzz n GLU 905 Ca -0.16 -1.70 0.00 0.00 -0.16 0.00 0.00 57.16 55.14 2kzz n GLU 905 Cb 1.07 -1.42 0.00 0.00 1.43 0.00 0.00 31.44 32.53 2kzz n GLU 905 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2kzz n ASN 906 N 0.89 0.58 -1.95 -1.84 3.02 -0.73 -4.85 115.26 110.38 2kzz n ASN 906 Ca 0.17 0.00 -0.19 0.00 -0.03 0.00 0.00 54.58 54.54 2kzz n ASN 906 Cb 0.43 0.05 0.14 0.00 -0.61 0.00 0.00 39.78 39.79 2kzz n ASN 906 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kzz n THR 908 N -0.78 0.00 -2.92 0.00 -1.04 -1.26 -4.78 114.28 103.50 2kzz n THR 908 Ca 0.47 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 62.07 2kzz n THR 908 Cb 1.42 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.88 2kzz n THR 908 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2kzz s ARG 909 N 4.20 4.35 0.00 -2.82 0.52 -1.26 -4.93 118.95 119.02 2kzz s ARG 909 Ca 0.00 1.00 0.16 0.00 -0.52 0.00 0.00 55.73 56.37 2kzz s ARG 909 Cb 0.00 -3.53 0.60 0.00 0.52 0.00 0.00 34.95 32.54 2kzz s ARG 909 CO 0.00 -0.20 1.44 1.28 0.02 0.00 0.00 175.30 177.84 2kzz n LEU 910 N 4.74 1.45 -0.08 2.53 4.77 -1.26 -4.08 117.00 125.08 2kzz n LEU 910 Ca 0.03 -0.66 -0.05 0.00 -0.03 0.00 0.00 56.01 55.30 2kzz n LEU 910 Cb 0.50 -0.13 -0.16 0.00 -2.33 0.00 0.00 43.42 41.30 2kzz n LEU 910 CO 0.48 0.33 -1.03 -0.90 -1.33 0.00 0.00 177.39 174.93 2kzz n ASP 911 N 0.22 0.05 -4.77 -1.43 5.75 -1.26 -4.90 116.55 110.21 2kzz n ASP 911 Ca 0.14 0.02 -0.37 0.00 -0.01 0.00 0.00 54.79 54.56 2kzz n ASP 911 Cb 0.27 1.16 -0.06 0.00 -1.03 0.00 0.00 41.12 41.46 2kzz n ASP 911 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2kzz s VAL 912 N -2.72 5.19 -0.66 2.12 1.01 -1.26 -4.98 120.40 119.10 2kzz s VAL 912 Ca -0.09 0.75 -0.27 0.00 0.00 0.00 0.00 61.98 62.37 2kzz s VAL 912 Cb 0.08 -3.70 -0.00 0.00 0.00 0.00 0.00 36.38 32.75 2kzz s VAL 912 CO 0.85 0.44 1.62 -2.16 0.00 0.00 0.00 175.10 175.85 2kzz s PRO 913 N -0.03 2.88 0.10 2.72 0.04 -1.26 -4.97 135.00 134.47 2kzz s PRO 913 Ca 0.22 0.29 0.02 0.00 0.04 0.00 0.00 61.00 61.56 2kzz s PRO 913 Cb -0.15 -4.30 -0.04 0.00 0.04 0.00 0.00 34.50 30.06 2kzz s PRO 913 CO 0.09 -2.47 0.20 -0.51 0.04 0.00 0.00 177.00 174.35 2kzz s LEU 914 N 7.66 4.20 -0.05 -3.56 1.43 -1.26 -4.88 118.68 122.22 2kzz s LEU 914 Ca 0.54 0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.78 2kzz s LEU 914 Cb -0.11 -2.81 0.04 0.00 0.03 0.00 0.00 46.19 43.34 2kzz s LEU 914 CO 0.19 0.12 0.09 -0.22 0.23 0.00 0.00 176.35 176.76 2kzz s LEU 915 N -2.77 0.46 -0.23 1.79 2.96 -1.26 -4.98 118.68 114.65 2kzz s LEU 915 Ca 0.33 0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 54.36 2kzz s LEU 915 Cb -0.12 0.06 -0.01 0.00 0.50 0.00 0.00 46.19 46.62 2kzz s LEU 915 CO 0.27 -0.20 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.41 2kzz s VAL 916 N 1.71 3.67 -0.38 1.68 1.01 -1.26 -1.92 120.40 124.91 2kzz s VAL 916 Ca -0.02 -0.42 -0.17 0.00 0.00 0.00 0.00 61.98 61.37 2kzz s VAL 916 Cb -0.12 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.56 2kzz s VAL 916 CO -0.04 0.38 0.47 -0.70 0.00 0.00 0.00 175.10 175.21 2kzz s GLU 917 N 1.52 3.44 -0.23 2.72 2.56 -0.18 -4.90 118.70 123.63 2kzz s GLU 917 Ca 0.06 -0.40 -0.07 0.00 0.00 0.00 0.00 54.97 54.56 2kzz s GLU 917 Cb -0.15 -3.86 -0.03 0.00 2.00 0.00 0.00 34.13 32.09 2kzz s GLU 917 CO -0.01 -0.71 0.04 0.08 -0.56 0.00 0.00 175.26 174.11 2kzz s VAL 918 N 2.28 4.22 0.17 3.70 1.01 -1.26 -1.30 120.40 129.23 2kzz s VAL 918 Ca 0.16 -0.21 0.07 0.00 0.00 0.00 0.00 61.98 62.00 2kzz s VAL 918 Cb -0.16 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 2kzz s VAL 918 CO 0.14 0.38 -0.14 -0.83 0.00 0.00 0.00 175.10 174.65 2kzz s GLY 919 N 1.30 1.29 0.03 4.51 0.00 0.23 -4.97 107.32 109.70 2kzz s GLY 919 Ca 0.04 -1.53 -0.01 0.00 0.00 0.00 0.00 44.72 43.23 2kzz s GLY 919 CO 0.03 -1.61 -0.02 -1.35 0.00 0.00 0.00 173.10 170.15 2kzz s SER 920 N -3.01 0.30 0.00 1.64 1.04 -1.26 0.43 113.70 112.84 2kzz s SER 920 Ca 0.18 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.96 2kzz s SER 920 Cb -0.02 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.24 2kzz s SER 920 CO 0.05 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.47 2kzz n GLY 921 N 1.10 1.67 0.12 7.32 0.00 -0.58 -4.20 105.19 110.62 2kzz n GLY 921 Ca -0.21 -0.84 0.06 0.00 0.00 0.00 0.00 46.02 45.03 2kzz n GLY 921 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2kzz h GLU 922 N 0.00 0.00 -4.71 1.61 4.39 -1.91 -1.91 114.58 112.05 2kzz h GLU 922 Ca 0.00 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.36 2kzz h GLU 922 Cb 0.00 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 28.51 2kzz h GLU 922 CO 0.00 0.17 -0.55 0.54 -1.16 0.00 0.00 179.01 178.01 2kzz s ASN 923 N -5.73 0.84 0.25 1.42 2.20 -1.26 -2.47 114.94 110.19 2kzz s ASN 923 Ca -0.00 -1.55 -0.05 0.00 -0.94 0.00 0.00 52.86 50.32 2kzz s ASN 923 Cb 0.09 0.47 0.34 0.00 -2.00 0.00 0.00 41.25 40.14 2kzz s ASN 923 CO 0.78 -0.95 1.89 -0.25 -2.94 0.00 0.00 177.10 175.63 2kzz h TRP 924 N 2.39 1.15 -0.71 1.54 7.01 -0.36 -2.56 115.95 124.41 2kzz h TRP 924 Ca -0.31 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 60.68 2kzz h TRP 924 Cb 1.24 -0.38 -0.03 0.00 -2.10 0.00 0.00 29.16 27.89 2kzz h TRP 924 CO 0.98 0.64 0.30 0.22 -2.79 0.00 0.00 178.44 177.78 2kzz h ASP 925 N 1.17 0.95 -0.10 2.65 3.58 -1.81 -0.81 116.42 122.05 2kzz h ASP 925 Ca 0.39 -0.13 -0.08 0.00 0.42 0.00 0.00 57.03 57.63 2kzz h ASP 925 Cb 0.07 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.86 2kzz h ASP 925 CO -0.14 0.84 -0.18 1.56 -2.88 0.00 0.00 179.24 178.44 2kzz h GLN 926 N 1.02 0.49 0.00 0.28 4.20 -1.81 -3.18 115.11 116.12 2kzz h GLN 926 Ca 0.24 -0.16 -0.26 0.00 0.06 0.00 0.00 58.65 58.54 2kzz h GLN 926 Cb 0.17 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 2kzz h GLN 926 CO -0.02 0.65 -1.47 0.00 -0.67 0.00 0.00 178.83 177.32 2kzz h ALA 927 N 1.37 0.65 0.00 3.87 0.00 -1.32 -3.41 119.26 120.43 2kzz h ALA 927 Ca 0.08 -1.25 0.00 0.00 0.00 0.00 0.00 54.91 53.74 2kzz h ALA 927 Cb 0.56 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2kzz h ALA 927 CO 0.04 1.42 0.00 1.58 0.00 0.00 0.00 179.25 182.29