#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mvn n LEU 318 N 0.00 -2.44 -4.69 0.55 4.77 -1.21 -4.87 117.00 109.10 3mvn n LEU 318 Ca 0.00 -1.01 -0.42 0.00 -0.03 0.00 0.00 56.01 54.55 3mvn n LEU 318 Cb 0.00 -2.29 -0.03 0.00 -2.33 0.00 0.00 43.42 38.77 3mvn n LEU 318 CO 0.00 0.46 0.83 -0.70 -1.33 0.00 0.00 177.39 176.65 3mvn s GLU 319 N -6.34 4.43 -0.26 3.23 2.12 -0.72 -4.85 118.70 116.31 3mvn s GLU 319 Ca 0.19 1.52 -0.29 0.00 0.36 0.00 0.00 54.97 56.74 3mvn s GLU 319 Cb -0.07 -3.52 0.01 0.00 0.26 0.00 0.00 34.13 30.81 3mvn s GLU 319 CO 0.88 -0.31 1.16 0.08 -0.54 0.00 0.00 175.26 176.53 3mvn s VAL 320 N 1.82 4.42 -0.14 3.70 1.01 -1.26 -0.66 120.40 129.29 3mvn s VAL 320 Ca 0.52 1.67 0.19 0.00 0.00 0.00 0.00 61.98 64.36 3mvn s VAL 320 Cb -0.22 -4.24 -0.13 0.00 0.00 0.00 0.00 36.38 31.79 3mvn s VAL 320 CO 0.22 -0.33 0.79 0.29 0.00 0.00 0.00 175.10 176.07 3mvn n LYS 321 N 6.77 0.62 0.00 2.72 4.76 0.76 -4.96 118.16 128.83 3mvn n LYS 321 Ca 0.13 0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.72 3mvn n LYS 321 Cb 0.46 -1.77 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 3mvn n LYS 321 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3mvn n GLY 322 N 1.36 0.72 2.75 0.72 0.00 -1.16 -5.00 105.19 104.59 3mvn n GLY 322 Ca -0.09 -0.96 -0.19 0.00 0.00 0.00 0.00 46.02 44.79 3mvn n GLY 322 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mvn s VAL 323 N -2.00 0.08 -0.04 1.61 1.01 -1.26 -0.94 120.40 118.85 3mvn s VAL 323 Ca 0.00 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.22 3mvn s VAL 323 Cb 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.16 3mvn s VAL 323 CO 0.00 0.17 -0.03 0.54 0.00 0.00 0.00 175.10 175.78 3mvn s VAL 324 N 1.60 0.47 -1.49 2.92 0.11 -0.52 -4.83 120.40 118.65 3mvn s VAL 324 Ca -0.02 -0.07 -0.13 0.00 -2.93 0.00 0.00 61.98 58.84 3mvn s VAL 324 Cb -0.13 -0.52 0.07 0.00 -1.53 0.00 0.00 36.38 34.28 3mvn s VAL 324 CO -0.03 0.22 1.01 -3.20 -3.33 0.00 0.00 175.10 169.76 3mvn n ASN 325 N 4.16 -5.20 -1.85 3.54 4.05 -1.26 -0.84 115.26 117.86 3mvn n ASN 325 Ca -0.23 -0.70 -0.20 0.00 0.45 0.00 0.00 54.58 53.89 3mvn n ASN 325 Cb 0.51 -4.13 -0.06 0.00 1.23 0.00 0.00 39.78 37.32 3mvn n ASN 325 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 3mvn n ASN 326 N -2.85 -5.53 -4.41 1.20 5.15 -1.26 -4.02 115.26 103.54 3mvn n ASN 326 Ca 0.03 0.35 -0.35 0.00 -0.60 0.00 0.00 54.58 54.01 3mvn n ASN 326 Cb 0.53 -4.80 -0.13 0.00 -0.53 0.00 0.00 39.78 34.86 3mvn n ASN 326 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3mvn s ILE 327 N -2.83 3.82 -0.12 -1.44 1.01 -0.02 -0.55 121.20 121.07 3mvn s ILE 327 Ca 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 60.65 60.17 3mvn s ILE 327 Cb 0.00 -2.73 -0.05 0.00 0.01 0.00 0.00 42.46 39.69 3mvn s ILE 327 CO 0.00 0.42 0.29 -0.89 0.00 0.00 0.00 174.94 174.76 3mvn s THR 328 N 1.18 5.28 -0.17 2.92 2.01 -0.63 -1.44 115.64 124.79 3mvn s THR 328 Ca 0.03 0.56 -0.02 0.00 0.31 0.00 0.00 61.69 62.57 3mvn s THR 328 Cb -0.14 -3.61 -0.01 0.00 0.01 0.00 0.00 72.50 68.74 3mvn s THR 328 CO 0.01 0.47 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.63 3mvn s VAL 329 N -0.10 3.29 0.10 3.82 1.01 -0.12 -0.28 120.40 128.13 3mvn s VAL 329 Ca 0.18 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 61.70 3mvn s VAL 329 Cb -0.14 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 3mvn s VAL 329 CO 0.06 0.48 -0.24 -0.31 0.00 0.00 0.00 175.10 175.09 3mvn s TYR 330 N 0.77 2.08 -0.03 5.22 2.02 -0.30 -0.17 117.35 126.93 3mvn s TYR 330 Ca -0.03 -0.40 0.04 0.00 -0.37 0.00 0.00 57.07 56.31 3mvn s TYR 330 Cb -0.15 -1.16 -0.03 0.00 -0.40 0.00 0.00 41.96 40.23 3mvn s TYR 330 CO 0.02 0.24 -0.13 -0.51 -1.57 0.00 0.00 175.55 173.59 3mvn s ASP 331 N -1.81 4.11 -0.01 2.29 1.01 0.17 -1.12 116.67 121.31 3mvn s ASP 331 Ca 0.10 -0.21 -0.09 0.00 0.71 0.00 0.00 52.55 53.07 3mvn s ASP 331 Cb -0.10 -0.87 0.01 0.00 1.01 0.00 0.00 42.92 42.97 3mvn s ASP 331 CO 0.04 0.33 0.19 -0.62 0.21 0.00 0.00 175.17 175.32 3mvn s ASP 332 N -0.90 -0.06 0.00 0.27 2.15 0.25 -1.76 116.67 116.62 3mvn s ASP 332 Ca 0.13 -0.05 0.30 0.00 0.43 0.00 0.00 52.55 53.35 3mvn s ASP 332 Cb -0.11 0.26 1.39 0.00 -0.30 0.00 0.00 42.92 44.17 3mvn s ASP 332 CO 0.02 -0.35 1.99 0.49 -0.17 0.00 0.00 175.17 177.16 3mvn n PHE 333 N 1.62 0.00 -1.75 -5.34 3.72 -1.26 -1.61 117.46 112.85 3mvn n PHE 333 Ca -0.21 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.77 3mvn n PHE 333 Cb 0.56 -0.36 -0.02 0.00 -0.94 0.00 0.00 39.48 38.72 3mvn n PHE 333 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3mvn n ALA 334 N -1.36 2.64 -1.63 4.37 0.00 -1.26 -3.86 120.51 119.41 3mvn n ALA 334 Ca 0.11 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.93 3mvn n ALA 334 Cb 0.28 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.25 3mvn n ALA 334 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3mvn n HIS 335 N 2.31 0.00 -4.35 0.00 1.44 -1.26 -3.55 115.22 109.81 3mvn n HIS 335 Ca 0.09 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.50 3mvn n HIS 335 Cb 0.37 0.09 -0.11 0.00 0.12 0.00 0.00 29.99 30.46 3mvn n HIS 335 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 3mvn s HIS 336 N 0.00 2.63 0.22 -1.40 3.76 -1.26 -4.62 115.29 114.62 3mvn s HIS 336 Ca 0.00 -0.21 -0.17 0.00 -0.15 0.00 0.00 55.06 54.53 3mvn s HIS 336 Cb 0.00 -1.41 0.24 0.00 1.11 0.00 0.00 32.58 32.52 3mvn s HIS 336 CO 0.00 0.38 1.57 -1.35 -0.85 0.00 0.00 174.74 174.49 3mvn h PRO 337 N 3.87 -0.05 -0.36 8.40 0.11 -1.94 0.56 132.00 142.60 3mvn h PRO 337 Ca -0.49 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.67 3mvn h PRO 337 Cb 1.17 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 3mvn h PRO 337 CO 0.49 -0.03 0.11 1.15 -0.21 0.00 0.00 178.00 179.51 3mvn h THR 338 N -0.05 0.88 -0.23 -1.15 2.02 -1.97 -0.01 112.91 112.40 3mvn h THR 338 Ca 0.33 -0.09 -0.15 0.00 0.77 0.00 0.00 66.41 67.28 3mvn h THR 338 Cb 0.60 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 3mvn h THR 338 CO -0.88 0.05 -0.46 0.00 0.37 0.00 0.00 175.52 174.60 3mvn h ALA 339 N 1.24 0.77 -0.52 6.16 0.00 -1.78 -2.07 119.26 123.06 3mvn h ALA 339 Ca 0.16 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 3mvn h ALA 339 Cb 0.15 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3mvn h ALA 339 CO -0.18 0.66 0.32 0.82 0.00 0.00 0.00 179.25 180.88 3mvn h ILE 340 N 0.48 1.15 -0.00 0.00 2.04 -0.60 -0.20 117.51 120.39 3mvn h ILE 340 Ca 0.03 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.58 3mvn h ILE 340 Cb 0.98 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 3mvn h ILE 340 CO 0.09 0.15 -0.06 0.74 0.00 0.00 0.00 178.15 179.07 3mvn h THR 341 N 0.69 0.84 -0.66 -0.27 2.02 -0.91 -1.24 112.91 113.39 3mvn h THR 341 Ca 0.19 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.38 3mvn h THR 341 Cb -0.03 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 3mvn h THR 341 CO -0.04 0.00 0.42 0.00 0.37 0.00 0.00 175.52 176.28 3mvn h ALA 342 N 0.89 0.85 -0.20 6.16 0.00 -1.16 -1.83 119.26 123.95 3mvn h ALA 342 Ca 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3mvn h ALA 342 Cb 0.14 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3mvn h ALA 342 CO -0.07 0.22 0.02 1.15 0.00 0.00 0.00 179.25 180.57 3mvn h THR 343 N 0.85 1.24 -0.82 0.00 2.02 -0.71 0.40 112.91 115.88 3mvn h THR 343 Ca 0.25 -0.79 -0.02 0.00 0.77 0.00 0.00 66.41 66.63 3mvn h THR 343 Cb -0.05 1.36 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 3mvn h THR 343 CO -0.08 0.24 0.44 0.40 0.37 0.00 0.00 175.52 176.89 3mvn h ILE 344 N 0.13 1.25 -0.77 3.11 2.04 -1.20 -1.94 117.51 120.13 3mvn h ILE 344 Ca 0.06 -0.63 -0.05 0.00 1.00 0.00 0.00 64.86 65.24 3mvn h ILE 344 Cb 0.34 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 3mvn h ILE 344 CO 0.01 0.28 0.30 -0.78 0.00 0.00 0.00 178.15 177.96 3mvn h ASP 345 N 1.15 1.07 -0.39 1.72 3.58 -1.15 0.80 116.42 123.19 3mvn h ASP 345 Ca 0.29 -0.18 -0.07 0.00 0.42 0.00 0.00 57.03 57.49 3mvn h ASP 345 Cb 0.05 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.81 3mvn h ASP 345 CO -0.04 0.95 -0.01 0.00 -2.88 0.00 0.00 179.24 177.26 3mvn h ALA 346 N 1.16 1.09 -0.21 -0.78 0.00 -0.71 -1.79 119.26 118.02 3mvn h ALA 346 Ca 0.26 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3mvn h ALA 346 Cb 0.22 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3mvn h ALA 346 CO -0.02 0.57 -0.33 1.25 0.00 0.00 0.00 179.25 180.73 3mvn h LEU 347 N 0.73 0.65 -0.94 0.00 5.85 -0.80 -3.10 115.31 117.69 3mvn h LEU 347 Ca 0.14 -0.52 0.07 0.00 0.84 0.00 0.00 57.88 58.41 3mvn h LEU 347 Cb 0.47 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.24 3mvn h LEU 347 CO 0.02 1.05 0.60 -0.09 -0.34 0.00 0.00 178.44 179.68 3mvn h ARG 348 N 0.27 1.04 -0.52 1.25 9.65 -0.73 -0.42 114.38 124.92 3mvn h ARG 348 Ca 0.02 -0.06 0.14 0.00 -1.10 0.00 0.00 59.98 58.98 3mvn h ARG 348 Cb 0.91 -0.24 -0.02 0.00 -1.39 0.00 0.00 29.97 29.23 3mvn h ARG 348 CO 0.08 0.69 0.37 0.00 2.80 0.00 0.00 179.97 183.90 3mvn h ALA 349 N 1.44 2.42 0.03 2.80 0.00 -1.24 -0.20 119.26 124.50 3mvn h ALA 349 Ca 0.42 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.96 3mvn h ALA 349 Cb 0.20 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3mvn h ALA 349 CO -0.18 -0.56 -2.13 1.63 0.00 0.00 0.00 179.25 178.00 3mvn n LYS 350 N -4.40 0.68 0.01 0.00 4.01 -0.35 -4.56 118.16 113.56 3mvn n LYS 350 Ca 0.09 0.17 0.11 0.00 -0.51 0.00 0.00 58.31 58.17 3mvn n LYS 350 Cb 0.56 -1.64 -0.06 0.00 -0.51 0.00 0.00 35.03 33.38 3mvn n LYS 350 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 3mvn n VAL 351 N -3.10 0.09 -1.39 -0.18 0.24 -0.31 -5.03 118.33 108.64 3mvn n VAL 351 Ca -0.31 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 61.75 3mvn n VAL 351 Cb 1.07 0.36 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 3mvn n VAL 351 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3mvn n GLY 352 N 1.38 3.01 0.00 7.63 0.00 -0.10 -2.17 105.19 114.93 3mvn n GLY 352 Ca 0.01 -0.26 0.13 0.00 0.00 0.00 0.00 46.02 45.91 3mvn n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mvn n GLN 353 N 13.72 0.67 -1.95 1.61 0.00 -1.26 -4.84 117.38 125.34 3mvn n GLN 353 Ca 0.00 0.02 -0.34 0.00 0.00 0.00 0.00 57.00 56.68 3mvn n GLN 353 Cb 0.00 -1.50 0.03 0.00 0.00 0.00 0.00 30.24 28.77 3mvn n GLN 353 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 3mvn s GLN 354 N -2.21 2.98 0.13 2.61 -0.21 -0.92 -4.94 119.66 117.10 3mvn s GLN 354 Ca 0.34 1.54 -0.30 0.00 0.02 0.00 0.00 55.36 56.96 3mvn s GLN 354 Cb 0.18 -1.96 -0.06 0.00 1.00 0.00 0.00 33.01 32.16 3mvn s GLN 354 CO 0.34 -1.14 1.02 1.03 -2.12 0.00 0.00 175.29 174.42 3mvn s ARG 355 N -3.71 4.65 -0.28 2.91 0.52 -1.26 -4.93 118.95 116.84 3mvn s ARG 355 Ca 0.71 1.56 -0.11 0.00 -0.52 0.00 0.00 55.73 57.37 3mvn s ARG 355 Cb -0.23 -3.34 -0.04 0.00 0.52 0.00 0.00 34.95 31.86 3mvn s ARG 355 CO 0.35 0.14 0.18 0.42 0.02 0.00 0.00 175.30 176.42 3mvn s ILE 356 N -0.05 5.14 -0.45 1.52 1.01 -1.26 -0.85 121.20 126.25 3mvn s ILE 356 Ca 0.48 0.07 -0.12 0.00 0.00 0.00 0.00 60.65 61.08 3mvn s ILE 356 Cb -0.26 -3.47 0.08 0.00 0.01 0.00 0.00 42.46 38.82 3mvn s ILE 356 CO 0.32 0.23 0.33 -0.76 0.00 0.00 0.00 174.94 175.06 3mvn s LEU 357 N 1.73 5.41 -0.14 2.97 1.02 0.63 -0.68 118.68 129.62 3mvn s LEU 357 Ca 0.07 -1.45 -0.21 0.00 0.02 0.00 0.00 54.13 52.56 3mvn s LEU 357 Cb -0.16 -2.08 -0.03 0.00 0.02 0.00 0.00 46.19 43.94 3mvn s LEU 357 CO 0.10 -0.60 0.60 0.00 0.02 0.00 0.00 176.35 176.47 3mvn s ALA 358 N 1.52 3.47 -0.25 4.21 0.00 0.10 -0.54 121.76 130.28 3mvn s ALA 358 Ca 0.04 -0.14 0.02 0.00 0.00 0.00 0.00 51.96 51.87 3mvn s ALA 358 Cb -0.24 -2.87 0.06 0.00 0.00 0.00 0.00 23.12 20.07 3mvn s ALA 358 CO 0.04 -0.27 -0.06 0.08 0.00 0.00 0.00 175.76 175.54 3mvn s VAL 359 N 1.24 1.75 -0.09 0.00 1.01 0.87 -0.51 120.40 124.67 3mvn s VAL 359 Ca 0.30 -1.40 0.03 0.00 0.00 0.00 0.00 61.98 60.91 3mvn s VAL 359 Cb -0.16 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 3mvn s VAL 359 CO 0.12 -0.11 -0.18 -0.22 0.00 0.00 0.00 175.10 174.71 3mvn s LEU 360 N 1.29 2.46 -0.39 3.92 2.96 0.26 -4.27 118.68 124.90 3mvn s LEU 360 Ca -0.06 -0.38 -0.06 0.00 -0.22 0.00 0.00 54.13 53.41 3mvn s LEU 360 Cb -0.19 -1.50 0.08 0.00 0.50 0.00 0.00 46.19 45.08 3mvn s LEU 360 CO -0.06 0.23 0.19 -0.70 -1.32 0.00 0.00 176.35 174.69 3mvn s GLU 361 N -0.06 2.39 0.65 1.98 2.12 -1.26 -1.02 118.70 123.50 3mvn s GLU 361 Ca -0.04 -1.53 -0.12 0.00 0.36 0.00 0.00 54.97 53.64 3mvn s GLU 361 Cb -0.14 -3.61 -0.02 0.00 0.26 0.00 0.00 34.13 30.62 3mvn s GLU 361 CO 0.04 -0.93 1.05 -2.14 -0.54 0.00 0.00 175.26 172.74 3mvn s PRO 362 N 1.31 3.22 -0.01 4.30 0.02 -1.26 -4.63 135.00 137.95 3mvn s PRO 362 Ca 0.03 0.94 0.12 0.00 0.02 0.00 0.00 61.00 62.11 3mvn s PRO 362 Cb -0.22 -2.03 -0.16 0.00 0.02 0.00 0.00 34.50 32.11 3mvn s PRO 362 CO -0.00 -0.87 0.40 0.54 -0.33 0.00 0.00 177.00 176.73 3mvn n ARG 363 N -2.77 1.70 0.10 5.54 5.12 -1.26 -4.87 116.66 120.21 3mvn n ARG 363 Ca 0.07 -0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.94 3mvn n ARG 363 Cb 0.54 -1.19 0.00 0.00 -1.16 0.00 0.00 32.46 30.65 3mvn n ARG 363 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3mvn n LYS 373 N -1.61 0.00 -0.19 5.56 5.02 -1.26 -5.13 118.16 120.56 3mvn n LYS 373 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 3mvn n LYS 373 Cb 0.26 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.28 3mvn n LYS 373 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3mvn h HIS 374 N 0.00 1.13 -1.01 2.13 2.76 -1.94 -1.78 115.15 116.44 3mvn h HIS 374 Ca 0.00 -0.23 0.05 0.00 -2.20 0.00 0.00 60.37 57.99 3mvn h HIS 374 Cb 0.00 -0.28 -0.06 0.00 1.55 0.00 0.00 27.41 28.61 3mvn h HIS 374 CO 0.00 1.04 0.66 0.93 -1.30 0.00 0.00 177.93 179.26 3mvn h GLU 375 N 0.90 1.20 -0.17 5.26 5.08 -2.01 -0.66 114.58 124.17 3mvn h GLU 375 Ca 0.15 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 3mvn h GLU 375 Cb 0.64 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3mvn h GLU 375 CO 0.04 0.80 0.01 1.25 -1.00 0.00 0.00 179.01 180.11 3mvn h LEU 376 N 1.24 0.29 -0.43 1.33 5.85 -1.94 -1.64 115.31 120.01 3mvn h LEU 376 Ca 0.41 -0.29 0.07 0.00 0.84 0.00 0.00 57.88 58.92 3mvn h LEU 376 Cb 0.07 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 3mvn h LEU 376 CO -0.15 0.51 0.05 0.00 -0.34 0.00 0.00 178.44 178.52 3mvn h ALA 377 N 0.79 0.45 -0.77 1.25 0.00 -1.09 -1.80 119.26 118.09 3mvn h ALA 377 Ca 0.05 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.13 3mvn h ALA 377 Cb 0.36 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 3mvn h ALA 377 CO 0.01 -0.35 0.51 1.15 0.00 0.00 0.00 179.25 180.56 3mvn h THR 378 N 0.17 1.04 0.00 0.00 2.02 -0.96 -1.22 112.91 113.96 3mvn h THR 378 Ca 0.21 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 67.08 3mvn h THR 378 Cb 0.29 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 66.83 3mvn h THR 378 CO -0.31 0.15 -0.16 0.77 0.37 0.00 0.00 175.52 176.34 3mvn h SER 379 N 0.83 0.00 -0.16 4.18 4.64 -0.41 -2.74 113.55 119.89 3mvn h SER 379 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3mvn h SER 379 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3mvn h SER 379 CO -0.11 0.16 0.00 0.18 -0.87 0.00 0.00 176.83 176.19 3mvn n LEU 380 N -3.62 3.04 0.25 5.97 4.77 -0.48 -4.09 117.00 122.83 3mvn n LEU 380 Ca -0.01 -1.13 0.12 0.00 -0.03 0.00 0.00 56.01 54.96 3mvn n LEU 380 Cb 0.29 -0.09 0.62 0.00 -2.33 0.00 0.00 43.42 41.91 3mvn n LEU 380 CO 0.31 0.57 0.91 0.06 -1.33 0.00 0.00 177.39 177.90 3mvn h GLN 381 N 4.43 0.00 0.00 3.23 3.07 -1.21 -2.09 115.11 122.53 3mvn h GLN 381 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3mvn h GLN 381 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.51 3mvn h GLN 381 CO 0.00 0.15 0.00 -3.47 0.09 0.00 0.00 178.83 175.60 3mvn n ASP 382 N -3.46 0.77 -4.74 0.06 4.64 -1.26 -4.85 116.55 107.71 3mvn n ASP 382 Ca -0.01 0.57 -0.41 0.00 -1.38 0.00 0.00 54.79 53.57 3mvn n ASP 382 Cb 0.32 -0.78 -0.04 0.00 -1.04 0.00 0.00 41.12 39.58 3mvn n ASP 382 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3mvn s ALA 383 N -3.10 3.33 0.40 -1.67 0.00 -0.79 -4.91 121.76 115.02 3mvn s ALA 383 Ca 0.11 0.72 0.12 0.00 0.00 0.00 0.00 51.96 52.91 3mvn s ALA 383 Cb 0.13 -3.31 0.82 0.00 0.00 0.00 0.00 23.12 20.76 3mvn s ALA 383 CO 0.59 -0.10 1.90 -0.44 0.00 0.00 0.00 175.76 177.71 3mvn h ASP 384 N 5.07 0.06 -4.22 0.00 3.32 -1.23 -3.43 116.42 115.99 3mvn h ASP 384 Ca -0.44 -0.02 -0.14 0.00 0.02 0.00 0.00 57.03 56.46 3mvn h ASP 384 Cb 1.21 -0.02 -0.23 0.00 0.22 0.00 0.00 39.33 40.51 3mvn h ASP 384 CO 0.71 0.32 -0.33 -0.55 -1.72 0.00 0.00 179.24 177.67 3mvn s SER 385 N -6.95 -0.28 -0.06 6.45 0.15 -1.03 -4.17 113.70 107.81 3mvn s SER 385 Ca -0.04 0.45 0.04 0.00 0.70 0.00 0.00 55.95 57.11 3mvn s SER 385 Cb 0.15 0.54 -0.00 0.00 -1.71 0.00 0.00 66.02 65.00 3mvn s SER 385 CO 0.72 -0.22 -0.19 -0.69 1.20 0.00 0.00 173.24 174.06 3mvn s VAL 386 N -0.32 1.60 -0.08 4.45 1.01 -0.12 -0.72 120.40 126.22 3mvn s VAL 386 Ca -0.04 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3mvn s VAL 386 Cb -0.03 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 34.98 3mvn s VAL 386 CO 0.02 0.46 -0.07 -0.36 0.00 0.00 0.00 175.10 175.14 3mvn s PHE 387 N 0.15 1.25 -0.09 5.22 0.08 0.33 -0.89 117.98 124.04 3mvn s PHE 387 Ca -0.08 -0.52 0.04 0.00 0.12 0.00 0.00 56.93 56.49 3mvn s PHE 387 Cb -0.14 -1.04 0.00 0.00 -0.57 0.00 0.00 43.02 41.28 3mvn s PHE 387 CO 0.04 -0.37 -0.22 0.42 -0.10 0.00 0.00 175.22 174.99 3mvn s ILE 388 N 1.30 1.89 -0.14 0.64 1.01 0.02 -0.57 121.20 125.36 3mvn s ILE 388 Ca -0.03 -0.93 -0.20 0.00 0.00 0.00 0.00 60.65 59.48 3mvn s ILE 388 Cb -0.14 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.66 3mvn s ILE 388 CO -0.03 0.52 0.58 -0.47 0.00 0.00 0.00 174.94 175.54 3mvn s TYR 389 N 0.30 3.47 -0.42 3.97 5.04 -0.19 -1.40 117.35 128.13 3mvn s TYR 389 Ca -0.16 0.98 -0.09 0.00 -2.44 0.00 0.00 57.07 55.36 3mvn s TYR 389 Cb -0.17 -2.70 0.08 0.00 0.35 0.00 0.00 41.96 39.53 3mvn s TYR 389 CO 0.07 0.02 0.27 1.14 -1.34 0.00 0.00 175.55 175.71 3mvn s GLN 390 N 1.14 2.59 0.13 4.97 -2.07 0.35 -4.31 119.66 122.46 3mvn s GLN 390 Ca 0.29 -1.49 0.10 0.00 -1.82 0.00 0.00 55.36 52.45 3mvn s GLN 390 Cb -0.16 -3.79 -0.15 0.00 -1.09 0.00 0.00 33.01 27.81 3mvn s GLN 390 CO 0.12 -0.97 1.20 -1.00 -1.32 0.00 0.00 175.29 173.32 3mvn h PRO 391 N 8.41 0.00 0.00 9.60 0.13 -1.89 -3.40 132.00 144.84 3mvn h PRO 391 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 3mvn h PRO 391 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3mvn h PRO 391 CO 0.77 0.78 0.00 -2.67 -0.23 0.00 0.00 178.00 176.65 3mvn n TRP 396 N -3.25 0.00 -3.44 1.56 4.27 -1.26 -5.14 117.44 110.18 3mvn n TRP 396 Ca -0.03 0.00 -0.40 0.00 -3.89 0.00 0.00 57.50 53.19 3mvn n TRP 396 Cb 0.91 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.76 3mvn n TRP 396 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 3mvn s GLN 397 N 0.00 3.82 0.37 -2.67 0.74 -1.26 -4.96 119.66 115.70 3mvn s GLN 397 Ca 0.00 -0.22 0.17 0.00 0.05 0.00 0.00 55.36 55.36 3mvn s GLN 397 Cb 0.00 -3.72 0.73 0.00 1.10 0.00 0.00 33.01 31.12 3mvn s GLN 397 CO 0.00 -0.36 1.78 0.28 -0.55 0.00 0.00 175.29 176.44 3mvn h VAL 398 N 5.45 1.04 -0.20 1.34 2.07 -2.01 -3.11 116.25 120.83 3mvn h VAL 398 Ca -0.32 -1.44 -0.01 0.00 0.82 0.00 0.00 66.70 65.76 3mvn h VAL 398 Cb 1.16 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 3mvn h VAL 398 CO 0.64 0.38 0.08 0.77 0.02 0.00 0.00 177.57 179.47 3mvn h SER 399 N 0.00 0.24 0.04 0.57 4.64 -1.99 -0.51 113.55 116.53 3mvn h SER 399 Ca -0.00 -0.01 -0.16 0.00 -0.47 0.00 0.00 61.79 61.14 3mvn h SER 399 Cb 0.80 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 3mvn h SER 399 CO 0.05 0.22 -0.55 -0.33 -0.87 0.00 0.00 176.83 175.35 3mvn h GLU 400 N 0.28 0.55 -0.33 4.77 5.08 -1.98 -1.28 114.58 121.66 3mvn h GLU 400 Ca 0.07 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 58.03 3mvn h GLU 400 Cb 0.05 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3mvn h GLU 400 CO -0.01 0.95 -0.00 0.28 -1.00 0.00 0.00 179.01 179.23 3mvn h VAL 401 N 0.42 1.26 0.00 3.13 2.07 -1.26 -3.25 116.25 118.62 3mvn h VAL 401 Ca 0.01 -0.97 -0.08 0.00 0.82 0.00 0.00 66.70 66.48 3mvn h VAL 401 Cb 1.10 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 3mvn h VAL 401 CO 0.10 0.32 -0.37 -0.07 0.02 0.00 0.00 177.57 177.57 3mvn h LEU 402 N 0.40 0.00 -1.94 2.57 3.38 -1.12 -3.08 115.31 115.51 3mvn h LEU 402 Ca 0.09 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.17 3mvn h LEU 402 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3mvn h LEU 402 CO 0.02 0.37 0.46 0.00 0.09 0.00 0.00 178.44 179.38 3mvn h ALA 403 N 1.63 2.05 0.00 1.53 0.00 -1.26 -1.28 119.26 121.93 3mvn h ALA 403 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3mvn h ALA 403 Cb 1.04 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3mvn h ALA 403 CO 0.05 -0.65 -0.31 0.09 0.00 0.00 0.00 179.25 178.43 3mvn n ASN 404 N -3.60 0.39 -4.65 0.00 3.02 -1.16 -4.79 115.26 104.46 3mvn n ASN 404 Ca 0.07 0.13 -0.35 0.00 -0.03 0.00 0.00 54.58 54.40 3mvn n ASN 404 Cb 0.62 -0.10 -0.09 0.00 -0.61 0.00 0.00 39.78 39.59 3mvn n ASN 404 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3mvn s LEU 405 N -3.33 3.96 -0.01 3.41 1.43 -0.48 -4.97 118.68 118.69 3mvn s LEU 405 Ca 0.11 0.11 0.19 0.00 -1.03 0.00 0.00 54.13 53.51 3mvn s LEU 405 Cb 0.17 -2.03 -0.23 0.00 0.03 0.00 0.00 46.19 44.13 3mvn s LEU 405 CO 0.64 0.14 0.67 0.00 0.23 0.00 0.00 176.35 178.03 3mvn n ALA 406 N 3.78 3.88 -1.02 4.21 0.00 -1.26 -4.82 120.51 125.28 3mvn n ALA 406 Ca -0.16 -0.50 -0.30 0.00 0.00 0.00 0.00 53.44 52.48 3mvn n ALA 406 Cb 0.52 -0.67 0.16 0.00 0.00 0.00 0.00 19.45 19.46 3mvn n ALA 406 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3mvn s GLN 407 N -2.95 0.95 0.10 0.00 0.00 -1.26 -4.91 119.66 111.59 3mvn s GLN 407 Ca 0.02 0.97 -0.34 0.00 -0.00 0.00 0.00 55.36 56.02 3mvn s GLN 407 Cb 0.14 -1.76 -0.13 0.00 0.00 0.00 0.00 33.01 31.25 3mvn s GLN 407 CO 0.78 -2.50 1.65 -2.30 0.00 0.00 0.00 175.29 172.92 3mvn n PRO 408 N -4.08 2.16 -3.71 9.60 -0.02 -1.26 -4.89 135.00 132.80 3mvn n PRO 408 Ca 0.07 0.78 -0.14 0.00 -2.02 0.00 0.00 63.50 62.19 3mvn n PRO 408 Cb 0.54 -2.57 -0.14 0.00 -0.02 0.00 0.00 33.50 31.31 3mvn n PRO 408 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mvn s ALA 409 N 1.67 -0.30 0.00 3.55 0.00 -1.26 -0.95 121.76 124.49 3mvn s ALA 409 Ca 0.82 0.71 -0.02 0.00 0.00 0.00 0.00 51.96 53.47 3mvn s ALA 409 Cb -0.68 -0.64 -0.01 0.00 0.00 0.00 0.00 23.12 21.80 3mvn s ALA 409 CO 0.41 -0.33 0.03 -1.50 0.00 0.00 0.00 175.76 174.37 3mvn s ILE 410 N 1.63 0.07 0.16 0.00 2.07 -0.07 -4.99 121.20 120.07 3mvn s ILE 410 Ca -0.05 -0.56 0.09 0.00 -1.41 0.00 0.00 60.65 58.72 3mvn s ILE 410 Cb -0.12 -0.23 -0.04 0.00 0.13 0.00 0.00 42.46 42.20 3mvn s ILE 410 CO -0.06 -0.31 -0.15 -0.94 -1.91 0.00 0.00 174.94 171.57 3mvn s SER 411 N -0.95 3.98 0.01 4.50 1.04 -1.26 -0.80 113.70 120.22 3mvn s SER 411 Ca -0.10 -0.63 -0.03 0.00 0.48 0.00 0.00 55.95 55.66 3mvn s SER 411 Cb -0.06 -0.57 -0.01 0.00 0.10 0.00 0.00 66.02 65.48 3mvn s SER 411 CO -0.00 0.13 0.04 0.00 0.98 0.00 0.00 173.24 174.39 3mvn s ALA 412 N -1.54 -0.07 -1.00 5.32 0.00 -0.49 -4.94 121.76 119.04 3mvn s ALA 412 Ca 0.22 -0.30 0.17 0.00 0.00 0.00 0.00 51.96 52.05 3mvn s ALA 412 Cb -0.09 0.09 0.61 0.00 0.00 0.00 0.00 23.12 23.72 3mvn s ALA 412 CO 0.13 -0.15 1.52 -0.40 0.00 0.00 0.00 175.76 176.85 3mvn n ASP 413 N 1.82 4.22 -3.75 0.00 3.85 -1.26 -0.49 116.55 120.94 3mvn n ASP 413 Ca -0.21 -2.42 -0.12 0.00 -0.71 0.00 0.00 54.79 51.32 3mvn n ASP 413 Cb 0.56 -0.50 -0.12 0.00 -1.35 0.00 0.00 41.12 39.71 3mvn n ASP 413 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3mvn s ASP 414 N -1.09 -0.26 0.13 -1.12 2.15 -1.26 -4.88 116.67 110.34 3mvn s ASP 414 Ca 0.44 0.51 -0.15 0.00 0.43 0.00 0.00 52.55 53.78 3mvn s ASP 414 Cb 0.29 0.44 -0.01 0.00 -0.30 0.00 0.00 42.92 43.34 3mvn s ASP 414 CO 0.21 -0.13 1.60 0.58 -0.17 0.00 0.00 175.17 177.26 3mvn h VAL 415 N 5.41 1.25 -0.84 1.11 2.07 -1.96 -1.25 116.25 122.05 3mvn h VAL 415 Ca -0.34 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.23 3mvn h VAL 415 Cb 1.17 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 3mvn h VAL 415 CO 0.37 0.32 0.44 0.44 0.02 0.00 0.00 177.57 179.15 3mvn h ASP 416 N 0.54 1.07 -0.53 0.57 3.32 -1.98 0.46 116.42 119.88 3mvn h ASP 416 Ca 0.12 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3mvn h ASP 416 Cb 0.41 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 3mvn h ASP 416 CO 0.01 0.88 0.34 -0.33 -1.72 0.00 0.00 179.24 178.42 3mvn h GLU 417 N 1.18 0.71 -0.89 3.56 5.08 -1.96 -2.64 114.58 119.61 3mvn h GLU 417 Ca 0.29 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 3mvn h GLU 417 Cb 0.06 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 3mvn h GLU 417 CO -0.04 0.48 0.54 1.25 -1.00 0.00 0.00 179.01 180.24 3mvn h LEU 418 N 0.71 1.08 -1.65 1.33 5.85 -0.71 -1.03 115.31 120.89 3mvn h LEU 418 Ca 0.19 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.84 3mvn h LEU 418 Cb -0.06 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.70 3mvn h LEU 418 CO -0.04 0.83 0.00 0.52 -0.34 0.00 0.00 178.44 179.41 3mvn n VAL 419 N -4.39 0.00 0.00 1.05 0.31 0.11 -1.29 118.33 114.11 3mvn n VAL 419 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 3mvn n VAL 419 Cb 0.06 -0.29 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 3mvn n VAL 419 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3mvn n ARG 421 N 0.78 0.00 -0.13 5.55 5.12 -0.39 -1.17 116.66 126.43 3mvn n ARG 421 Ca 0.00 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 3mvn n ARG 421 Cb 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.29 3mvn n ARG 421 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 3mvn h ILE 422 N 0.00 1.16 0.00 0.55 2.04 -1.47 -2.98 117.51 116.80 3mvn h ILE 422 Ca 0.00 -0.42 -0.07 0.00 1.00 0.00 0.00 64.86 65.38 3mvn h ILE 422 Cb 0.00 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3mvn h ILE 422 CO 0.00 0.16 -0.32 0.58 0.00 0.00 0.00 178.15 178.58 3mvn h VAL 423 N 0.49 1.22 0.00 1.67 2.07 -1.41 0.22 116.25 120.52 3mvn h VAL 423 Ca 0.14 -1.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.52 3mvn h VAL 423 Cb 0.08 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3mvn h VAL 423 CO -0.02 0.31 -0.21 1.56 0.02 0.00 0.00 177.57 179.23 3mvn h GLN 424 N 0.00 0.00 0.00 1.57 4.20 -1.78 -3.28 115.11 115.82 3mvn h GLN 424 Ca -0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 3mvn h GLN 424 Cb 0.56 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 3mvn h GLN 424 CO 0.04 0.21 -1.80 1.04 -0.67 0.00 0.00 178.83 177.66 3mvn n GLN 425 N -3.61 0.81 -2.43 1.46 6.02 -0.61 -5.02 117.38 113.99 3mvn n GLN 425 Ca -0.01 -0.10 -0.41 0.00 -0.01 0.00 0.00 57.00 56.47 3mvn n GLN 425 Cb 0.35 -1.37 -0.04 0.00 1.02 0.00 0.00 30.24 30.20 3mvn n GLN 425 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3mvn s ALA 426 N -2.88 3.41 0.09 -1.58 0.00 -0.03 -5.04 121.76 115.74 3mvn s ALA 426 Ca -0.06 0.91 0.04 0.00 0.00 0.00 0.00 51.96 52.86 3mvn s ALA 426 Cb 0.08 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 3mvn s ALA 426 CO 0.63 -0.28 -0.12 0.15 0.00 0.00 0.00 175.76 176.15 3mvn s LYS 427 N -0.70 0.85 0.22 0.00 1.02 -1.26 -4.97 119.74 114.90 3mvn s LYS 427 Ca 0.49 -1.09 -0.30 0.00 0.02 0.00 0.00 55.97 55.09 3mvn s LYS 427 Cb -0.32 -0.66 -0.15 0.00 -0.52 0.00 0.00 37.83 36.17 3mvn s LYS 427 CO 0.38 0.12 0.95 -2.30 -0.92 0.00 0.00 175.35 173.58 3mvn n PRO 428 N 0.82 0.92 -0.43 -1.68 -0.02 -1.26 -1.45 135.00 131.90 3mvn n PRO 428 Ca -0.18 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3mvn n PRO 428 Cb 0.56 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 3mvn n PRO 428 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3mvn n ASN 429 N 1.66 0.00 -4.79 2.55 3.02 0.29 -4.96 115.26 113.03 3mvn n ASN 429 Ca 0.14 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.38 3mvn n ASN 429 Cb 0.27 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.51 3mvn n ASN 429 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3mvn s ASP 430 N -3.12 4.83 -0.24 6.41 1.01 -0.53 -4.28 116.67 120.75 3mvn s ASP 430 Ca 0.00 1.61 0.01 0.00 0.71 0.00 0.00 52.55 54.87 3mvn s ASP 430 Cb 0.00 -2.39 0.06 0.00 1.01 0.00 0.00 42.92 41.60 3mvn s ASP 430 CO 0.00 -1.79 -0.04 -1.00 0.21 0.00 0.00 175.17 172.55 3mvn s HIS 431 N -3.02 2.33 -0.40 4.23 3.76 -0.03 -1.61 115.29 120.55 3mvn s HIS 431 Ca 0.60 -1.75 -0.19 0.00 -0.15 0.00 0.00 55.06 53.57 3mvn s HIS 431 Cb -0.15 -1.60 0.01 0.00 1.11 0.00 0.00 32.58 31.95 3mvn s HIS 431 CO 0.55 -0.78 0.53 0.42 -0.85 0.00 0.00 174.74 174.62 3mvn s ILE 432 N 1.42 4.98 -0.35 0.60 1.01 0.62 -0.27 121.20 129.20 3mvn s ILE 432 Ca -0.04 0.07 -0.09 0.00 0.00 0.00 0.00 60.65 60.58 3mvn s ILE 432 Cb -0.19 -4.06 0.02 0.00 0.01 0.00 0.00 42.46 38.25 3mvn s ILE 432 CO -0.07 -0.40 0.16 -0.22 0.00 0.00 0.00 174.94 174.41 3mvn s LEU 433 N 2.46 4.48 0.50 2.97 2.96 0.30 -1.15 118.68 131.20 3mvn s LEU 433 Ca 0.18 -0.95 0.07 0.00 -0.22 0.00 0.00 54.13 53.21 3mvn s LEU 433 Cb -0.15 -1.97 0.05 0.00 0.50 0.00 0.00 46.19 44.61 3mvn s LEU 433 CO 0.15 -0.33 0.69 -0.63 -1.32 0.00 0.00 176.35 174.91 3mvn s ILE 434 N 1.52 2.62 0.00 6.68 1.01 -0.28 -0.09 121.20 132.66 3mvn s ILE 434 Ca 0.01 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.72 3mvn s ILE 434 Cb -0.19 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.61 3mvn s ILE 434 CO 0.05 0.00 0.00 -0.24 0.00 0.00 0.00 174.94 174.75 3mvn n SER 436 N -2.09 0.00 -0.91 3.58 2.88 -0.64 -0.59 113.62 115.86 3mvn n SER 436 Ca 0.11 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.74 3mvn n SER 436 Cb 0.60 0.00 0.25 0.00 -0.75 0.00 0.00 64.21 64.31 3mvn n SER 436 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3mvn n ASN 437 N 0.00 2.64 -2.51 -3.46 6.94 -1.25 -4.09 115.26 113.53 3mvn n ASN 437 Ca 0.00 -1.96 -0.07 0.00 -0.02 0.00 0.00 54.58 52.54 3mvn n ASN 437 Cb 0.00 -0.29 -0.01 0.00 -2.36 0.00 0.00 39.78 37.11 3mvn n ASN 437 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3mvn n GLY 438 N 1.30 4.06 0.20 4.83 0.00 -1.26 -5.05 105.19 109.27 3mvn n GLY 438 Ca 0.17 -2.22 0.08 0.00 0.00 0.00 0.00 46.02 44.05 3mvn n GLY 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mvn h ALA 439 N 1.06 0.91 -6.19 4.61 0.00 -2.04 -3.47 119.26 114.14 3mvn h ALA 439 Ca -0.09 -0.26 -0.45 0.00 0.00 0.00 0.00 54.91 54.11 3mvn h ALA 439 Cb 0.27 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.02 3mvn h ALA 439 CO 0.14 0.36 -0.76 0.34 0.00 0.00 0.00 179.25 179.34 3mvn n PHE 440 N -3.32 -2.33 -1.55 0.00 -0.00 -1.26 -0.79 117.46 108.21 3mvn n PHE 440 Ca 0.01 0.91 -0.19 0.00 -0.00 0.00 0.00 57.45 58.19 3mvn n PHE 440 Cb 0.53 -4.22 -0.08 0.00 -0.00 0.00 0.00 39.48 35.71 3mvn n PHE 440 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3mvn n GLY 441 N -1.72 1.82 2.91 7.13 0.00 -1.26 -1.50 105.19 112.58 3mvn n GLY 441 Ca -0.02 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.77 3mvn n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mvn n GLY 442 N -0.49 -0.06 0.21 -0.02 0.00 0.03 -4.91 105.19 99.95 3mvn n GLY 442 Ca -0.19 -0.05 0.01 0.00 0.00 0.00 0.00 46.02 45.80 3mvn n GLY 442 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3mvn h ILE 443 N -1.83 1.23 -0.82 -0.61 2.10 -1.36 -1.30 117.51 114.92 3mvn h ILE 443 Ca -0.39 -1.10 -0.02 0.00 1.08 0.00 0.00 64.86 64.44 3mvn h ILE 443 Cb 1.25 1.47 -0.04 0.00 -1.09 0.00 0.00 36.82 38.41 3mvn h ILE 443 CO 0.38 0.33 0.43 1.12 -1.08 0.00 0.00 178.15 179.33 3mvn h HIS 444 N 0.15 1.14 -0.42 2.19 2.07 -1.87 0.44 115.15 118.85 3mvn h HIS 444 Ca 0.02 -0.04 -0.05 0.00 -2.85 0.00 0.00 60.37 57.46 3mvn h HIS 444 Cb 0.56 -0.36 -0.02 0.00 2.57 0.00 0.00 27.41 30.17 3mvn h HIS 444 CO 0.01 0.81 0.08 1.96 -3.07 0.00 0.00 177.93 177.71 3mvn h GLN 445 N 1.14 0.69 -0.63 5.12 7.50 -1.76 -2.07 115.11 125.11 3mvn h GLN 445 Ca 0.29 -0.18 0.06 0.00 0.50 0.00 0.00 58.65 59.32 3mvn h GLN 445 Cb 0.06 -0.08 -0.06 0.00 0.05 0.00 0.00 27.48 27.45 3mvn h GLN 445 CO -0.04 0.72 0.32 0.87 -1.50 0.00 0.00 178.83 179.20 3mvn h LYS 446 N 0.55 0.58 -0.18 1.46 1.57 -0.82 -1.77 116.57 117.96 3mvn h LYS 446 Ca 0.13 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 3mvn h LYS 446 Cb 0.36 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3mvn h LYS 446 CO 0.01 0.38 0.03 -0.07 -0.57 0.00 0.00 179.45 179.23 3mvn h LEU 447 N 0.60 0.28 -1.05 2.94 3.38 -0.84 0.11 115.31 120.71 3mvn h LEU 447 Ca 0.29 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 58.05 3mvn h LEU 447 Cb 0.22 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 3mvn h LEU 447 CO -0.20 0.46 0.63 -0.07 0.09 0.00 0.00 178.44 179.35 3mvn h LEU 448 N 0.08 1.04 0.01 1.67 3.38 -1.14 0.19 115.31 120.54 3mvn h LEU 448 Ca 0.05 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 3mvn h LEU 448 Cb 0.29 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3mvn h LEU 448 CO 0.00 0.69 -0.00 0.74 0.09 0.00 0.00 178.44 179.96 3mvn h THR 449 N 1.19 1.27 -0.09 0.22 2.02 -1.24 -3.31 112.91 112.98 3mvn h THR 449 Ca 0.40 -0.84 -0.10 0.00 0.77 0.00 0.00 66.41 66.64 3mvn h THR 449 Cb 0.06 1.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 3mvn h THR 449 CO -0.13 0.22 -0.37 0.00 0.37 0.00 0.00 175.52 175.60 3mvn h ALA 450 N 0.62 1.20 0.00 6.16 0.00 -0.10 -2.65 119.26 124.49 3mvn h ALA 450 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3mvn h ALA 450 Cb 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3mvn h ALA 450 CO 0.00 0.55 0.00 1.28 0.00 0.00 0.00 179.25 181.08 3mvn n LEU 451 N -4.06 0.00 -0.70 0.00 4.77 0.61 -5.07 117.00 112.54 3mvn n LEU 451 Ca -0.01 0.08 0.09 0.00 -0.03 0.00 0.00 56.01 56.13 3mvn n LEU 451 Cb 0.44 -0.08 0.07 0.00 -2.33 0.00 0.00 43.42 41.53 3mvn n LEU 451 CO 0.41 -0.02 0.53 0.00 -1.33 0.00 0.00 177.39 176.98