#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bze n GLY -20 N 0.00 -1.39 3.61 3.03 0.00 -1.26 -5.09 105.19 104.09 2bze n GLY -20 Ca 0.00 -1.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.56 2bze n GLY -20 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bze s SER -19 N -0.81 6.49 -0.15 1.61 0.01 -1.26 -4.99 113.70 114.60 2bze s SER -19 Ca 0.00 0.94 0.02 0.00 1.31 0.00 0.00 55.95 58.22 2bze s SER -19 Cb 0.00 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.70 2bze s SER -19 CO 0.00 -1.29 -0.20 -0.44 0.41 0.00 0.00 173.24 171.72 2bze s SER -18 N 3.39 3.05 -0.09 2.44 0.01 -1.26 -4.95 113.70 116.29 2bze s SER -18 Ca 0.58 -0.60 0.02 0.00 1.31 0.00 0.00 55.95 57.26 2bze s SER -18 Cb -0.14 -1.42 -0.07 0.00 0.21 0.00 0.00 66.02 64.60 2bze s SER -18 CO 0.29 0.04 -0.05 1.57 0.41 0.00 0.00 173.24 175.49 2bze n HIS -17 N 4.34 0.00 0.00 2.43 -0.00 -1.26 -5.03 115.22 115.71 2bze n HIS -17 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.52 2bze n HIS -17 Cb 0.51 -0.35 0.00 0.00 -0.00 0.00 0.00 29.99 30.15 2bze n HIS -17 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2bze n HIS -16 N -2.64 0.00 0.00 1.57 -0.00 -1.26 -4.27 115.22 108.62 2bze n HIS -16 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.57 2bze n HIS -16 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.68 2bze n HIS -16 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2bze n HIS -15 N 0.00 0.00 -3.49 4.41 -0.00 -1.26 -5.01 115.22 109.87 2bze n HIS -15 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.72 57.47 2bze n HIS -15 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 29.99 29.86 2bze n HIS -15 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2bze s HIS -14 N 0.00 0.03 -0.24 1.57 5.04 -1.26 -5.12 115.29 115.32 2bze s HIS -14 Ca 0.00 -0.61 -0.09 0.00 -1.54 0.00 0.00 55.06 52.82 2bze s HIS -14 Cb 0.00 -0.74 -0.04 0.00 0.04 0.00 0.00 32.58 31.84 2bze s HIS -14 CO 0.00 -0.86 0.12 -1.58 -2.34 0.00 0.00 174.74 170.08 2bze s HIS -13 N 2.20 3.23 -0.13 3.88 5.65 -1.26 -5.05 115.29 123.80 2bze s HIS -13 Ca 0.09 0.03 -0.29 0.00 0.25 0.00 0.00 55.06 55.13 2bze s HIS -13 Cb -0.15 -2.24 -0.01 0.00 -1.18 0.00 0.00 32.58 29.00 2bze s HIS -13 CO -0.35 -0.05 1.09 -1.01 -0.65 0.00 0.00 174.74 173.77 2bze s HIS -12 N 1.15 3.31 0.09 3.88 0.09 -1.26 -4.92 115.29 117.63 2bze s HIS -12 Ca 0.06 1.40 0.01 0.00 -0.00 0.00 0.00 55.06 56.53 2bze s HIS -12 Cb -0.14 -3.30 -0.25 0.00 -0.00 0.00 0.00 32.58 28.89 2bze s HIS -12 CO 0.05 -0.72 1.17 0.77 -0.00 0.00 0.00 174.74 176.01 2bze h SER -11 N 7.40 0.23 0.00 1.40 0.02 -1.97 -3.41 113.55 117.22 2bze h SER -11 Ca -0.28 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 2bze h SER -11 Cb 1.12 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.59 2bze h SER -11 CO 0.91 1.20 -0.70 -1.20 -1.14 0.00 0.00 176.83 175.89 2bze n SER -10 N -3.44 1.32 0.00 3.07 7.64 -1.26 -5.15 113.62 115.80 2bze n SER -10 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.83 2bze n SER -10 Cb 0.99 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.19 2bze n SER -10 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bze n GLY -9 N 2.72 -0.31 2.64 0.23 0.00 -1.26 -5.12 105.19 104.08 2bze n GLY -9 Ca 0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 46.02 45.43 2bze n GLY -9 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2bze n LEU -8 N 0.00 -7.25 -4.45 0.99 7.94 -1.26 -4.87 117.00 108.10 2bze n LEU -8 Ca 0.00 1.68 -0.44 0.00 -1.11 0.00 0.00 56.01 56.15 2bze n LEU -8 Cb 0.00 -3.27 -0.07 0.00 0.53 0.00 0.00 43.42 40.61 2bze n LEU -8 CO 0.00 -3.41 0.23 0.54 -1.11 0.00 0.00 177.39 173.64 2bze s VAL -7 N -1.28 4.99 0.23 1.96 0.11 -1.26 -5.04 120.40 120.12 2bze s VAL -7 Ca -0.09 -0.53 -0.21 0.00 -2.93 0.00 0.00 61.98 58.21 2bze s VAL -7 Cb 0.01 -4.20 -0.08 0.00 -1.53 0.00 0.00 36.38 30.57 2bze s VAL -7 CO 0.77 -0.66 0.77 -2.16 -3.33 0.00 0.00 175.10 170.48 2bze s PRO -6 N 2.34 4.34 -0.41 1.54 0.04 -1.26 -5.05 135.00 136.54 2bze s PRO -6 Ca 0.13 0.98 -0.07 0.00 0.04 0.00 0.00 61.00 62.07 2bze s PRO -6 Cb -0.19 -2.90 0.09 0.00 0.04 0.00 0.00 34.50 31.53 2bze s PRO -6 CO 0.12 0.39 0.24 1.03 0.04 0.00 0.00 177.00 178.82 2bze s ARG -5 N -1.90 2.45 0.16 4.56 0.52 -1.26 -5.06 118.95 118.42 2bze s ARG -5 Ca 0.43 -1.55 0.02 0.00 -0.52 0.00 0.00 55.73 54.11 2bze s ARG -5 Cb -0.18 -3.71 0.02 0.00 0.52 0.00 0.00 34.95 31.61 2bze s ARG -5 CO 0.22 -0.98 0.18 0.41 0.02 0.00 0.00 175.30 175.15 2bze n GLY -4 N 4.82 2.35 2.48 -3.53 0.00 -1.26 -3.75 105.19 106.30 2bze n GLY -4 Ca -0.08 -2.18 -0.17 0.00 0.00 0.00 0.00 46.02 43.58 2bze n GLY -4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bze n SER -3 N -2.47 -5.10 -4.07 1.61 7.64 -1.26 -4.96 113.62 105.01 2bze n SER -3 Ca 0.03 0.37 -0.12 0.00 1.01 0.00 0.00 58.87 60.16 2bze n SER -3 Cb 0.17 -4.14 -0.11 0.00 -1.01 0.00 0.00 64.21 59.12 2bze n SER -3 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2bze s HIS -2 N -2.68 0.66 0.13 1.43 4.02 -1.26 -5.12 115.29 112.47 2bze s HIS -2 Ca 0.00 -0.61 0.08 0.00 1.02 0.00 0.00 55.06 55.55 2bze s HIS -2 Cb 0.00 -0.40 -0.04 0.00 -1.02 0.00 0.00 32.58 31.12 2bze s HIS -2 CO 0.00 -0.12 -0.19 1.41 1.02 0.00 0.00 174.74 176.86 2bze s MET -1 N -2.11 1.19 0.25 1.40 -2.45 -1.26 -2.94 119.30 113.39 2bze s MET -1 Ca -0.06 -1.29 -0.31 0.00 -1.25 0.00 0.00 55.69 52.79 2bze s MET -1 Cb -0.06 -1.34 -0.11 0.00 1.25 0.00 0.00 34.83 34.57 2bze s MET -1 CO -0.01 0.29 1.58 0.08 1.05 0.00 0.00 175.02 178.01 2bze s VAL 345 N -1.65 2.25 0.00 10.11 1.01 0.23 -4.79 120.40 127.56 2bze s VAL 345 Ca 0.11 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.29 2bze s VAL 345 Cb -0.08 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.17 2bze s VAL 345 CO 0.05 0.03 0.00 -0.24 0.00 0.00 0.00 175.10 174.94 2bze n SER 346 N 2.74 0.24 -4.42 3.32 2.88 -1.26 -4.88 113.62 112.25 2bze n SER 346 Ca 0.10 -0.04 -0.32 0.00 -1.33 0.00 0.00 58.87 57.28 2bze n SER 346 Cb 0.38 0.14 -0.14 0.00 -0.75 0.00 0.00 64.21 63.84 2bze n SER 346 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2bze s LEU 347 N -0.32 2.49 0.59 2.46 1.43 -1.26 -4.98 118.68 119.09 2bze s LEU 347 Ca 0.00 -0.33 0.29 0.00 -1.03 0.00 0.00 54.13 53.06 2bze s LEU 347 Cb 0.00 -1.48 1.55 0.00 0.03 0.00 0.00 46.19 46.29 2bze s LEU 347 CO 0.00 0.32 1.97 -0.65 0.23 0.00 0.00 176.35 178.22 2bze h PRO 348 N 5.25 0.00 -0.30 1.29 0.11 -1.89 -1.19 132.00 135.26 2bze h PRO 348 Ca -0.46 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.57 2bze h PRO 348 Cb 1.14 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2bze h PRO 348 CO 0.49 0.00 -0.15 0.93 -0.21 0.00 0.00 178.00 179.05 2bze h GLU 349 N 0.00 0.53 0.03 1.05 5.08 -1.93 0.36 114.58 119.70 2bze h GLU 349 Ca 0.16 -0.17 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 2bze h GLU 349 Cb 0.91 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2bze h GLU 349 CO -0.00 0.67 -0.99 0.93 -1.00 0.00 0.00 179.01 178.61 2bze h GLU 350 N 0.48 0.35 0.00 2.33 5.08 -1.64 -1.60 114.58 119.58 2bze h GLU 350 Ca 0.08 -0.41 -0.06 0.00 -1.00 0.00 0.00 59.36 57.98 2bze h GLU 350 Cb 0.55 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2bze h GLU 350 CO 0.04 1.11 -0.26 -0.07 -1.00 0.00 0.00 179.01 178.82 2bze h LEU 351 N 0.18 0.00 0.00 1.33 3.38 -1.22 -2.89 115.31 116.09 2bze h LEU 351 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2bze h LEU 351 Cb 1.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.40 2bze h LEU 351 CO 0.17 0.26 -0.03 0.78 0.09 0.00 0.00 178.44 179.71 2bze h ASN 352 N 0.00 0.00 0.49 -0.43 2.35 0.36 0.60 115.58 118.95 2bze h ASN 352 Ca -0.00 -0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.45 2bze h ASN 352 Cb 1.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.36 2bze h ASN 352 CO 0.03 0.00 -1.49 0.08 -1.65 0.00 0.00 177.43 174.41 2bze h ARG 353 N 0.00 0.24 -0.02 0.81 0.11 -1.21 -3.27 114.38 111.05 2bze h ARG 353 Ca 0.00 -0.41 0.00 0.00 0.10 0.00 0.00 59.98 59.67 2bze h ARG 353 Cb 0.95 0.15 0.00 0.00 1.11 0.00 0.00 29.97 32.18 2bze h ARG 353 CO 0.00 1.11 0.00 1.33 0.10 0.00 0.00 179.97 182.51 2bze n VAL 354 N -3.45 0.01 -1.81 0.08 0.24 -1.10 -4.67 118.33 107.63 2bze n VAL 354 Ca -0.15 -0.19 -0.39 0.00 -2.04 0.00 0.00 64.34 61.58 2bze n VAL 354 Cb 1.04 0.22 0.03 0.00 -1.47 0.00 0.00 33.84 33.66 2bze n VAL 354 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bze s ARG 355 N -1.99 3.26 -0.14 7.34 1.70 0.20 -2.68 118.95 126.64 2bze s ARG 355 Ca 0.40 2.24 0.01 0.00 -0.47 0.00 0.00 55.73 57.91 2bze s ARG 355 Cb 0.21 -2.33 0.02 0.00 -0.57 0.00 0.00 34.95 32.28 2bze s ARG 355 CO 0.34 -1.09 -0.15 -0.51 -1.08 0.00 0.00 175.30 172.80 2bze s LEU 356 N -3.36 1.73 0.40 -1.89 1.43 -0.10 -4.92 118.68 111.97 2bze s LEU 356 Ca 0.69 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2bze s LEU 356 Cb -0.40 -1.18 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 2bze s LEU 356 CO 0.49 -0.03 0.60 -0.44 0.23 0.00 0.00 176.35 177.19 2bze s SER 357 N 1.31 6.02 0.46 2.29 0.01 -1.26 -3.37 113.70 119.16 2bze s SER 357 Ca 0.01 0.27 0.22 0.00 1.31 0.00 0.00 55.95 57.76 2bze s SER 357 Cb -0.14 -1.67 1.11 0.00 0.21 0.00 0.00 66.02 65.53 2bze s SER 357 CO -0.08 -0.51 1.95 0.08 0.41 0.00 0.00 173.24 175.08 2bze h ARG 358 N 0.60 0.00 0.00 12.44 0.11 -1.75 -0.93 114.38 124.85 2bze h ARG 358 Ca -0.47 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.55 2bze h ARG 358 Cb 1.24 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.31 2bze h ARG 358 CO 0.58 0.22 -0.29 0.45 0.10 0.00 0.00 179.97 181.03 2bze h HIS 359 N 0.00 0.00 -0.06 4.08 3.86 -1.92 0.22 115.15 121.33 2bze h HIS 359 Ca -0.00 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.00 2bze h HIS 359 Cb 0.51 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.00 2bze h HIS 359 CO 0.00 0.29 -0.78 0.87 0.86 0.00 0.00 177.93 179.17 2bze h LYS 360 N 0.00 0.63 -0.47 2.45 1.57 -1.57 -0.18 116.57 119.01 2bze h LYS 360 Ca -0.00 -0.60 -0.13 0.00 -1.87 0.00 0.00 60.65 58.04 2bze h LYS 360 Cb 0.63 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2bze h LYS 360 CO 0.04 1.21 -0.21 -0.07 -0.57 0.00 0.00 179.45 179.85 2bze h LEU 361 N 0.27 1.00 -0.26 2.94 3.38 -1.15 -0.92 115.31 120.57 2bze h LEU 361 Ca -0.08 -0.40 0.04 0.00 0.09 0.00 0.00 57.88 57.53 2bze h LEU 361 Cb 1.44 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 2bze h LEU 361 CO 0.16 1.17 0.04 -0.08 0.09 0.00 0.00 178.44 179.82 2bze h GLU 362 N 0.82 0.13 0.00 1.13 4.81 -0.49 0.26 114.58 121.24 2bze h GLU 362 Ca 0.11 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.21 2bze h GLU 362 Cb 0.79 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 2bze h GLU 362 CO 0.07 0.09 -0.55 0.07 -0.73 0.00 0.00 179.01 177.95 2bze h ARG 363 N 0.13 0.00 -0.00 1.92 0.11 -0.87 -2.79 114.38 112.88 2bze h ARG 363 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 2bze h ARG 363 Cb 0.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.21 2bze h ARG 363 CO -0.17 0.55 -0.17 0.91 0.10 0.00 0.00 179.97 181.19 2bze n TRP 364 N -3.53 0.00 0.32 4.08 8.01 -0.36 -3.52 117.44 122.44 2bze n TRP 364 Ca -0.00 0.00 0.12 0.00 -1.31 0.00 0.00 57.50 56.31 2bze n TRP 364 Cb 0.63 -0.26 0.54 0.00 -2.01 0.00 0.00 31.31 30.21 2bze n TRP 364 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2bze h HIS 366 N 0.00 0.00 -3.99 0.00 2.07 -1.76 -3.46 115.15 108.01 2bze h HIS 366 Ca 0.00 0.00 -0.46 0.00 -2.85 0.00 0.00 60.37 57.06 2bze h HIS 366 Cb 0.26 0.00 0.15 0.00 2.57 0.00 0.00 27.41 30.39 2bze h HIS 366 CO 0.00 0.68 0.23 -1.64 -3.07 0.00 0.00 177.93 174.13 2bze s MET 367 N -2.89 0.77 0.00 5.12 1.00 -0.37 -5.07 119.30 117.86 2bze s MET 367 Ca 0.03 0.55 0.00 0.00 0.00 0.00 0.00 55.69 56.27 2bze s MET 367 Cb 0.09 -1.77 0.00 0.00 0.00 0.00 0.00 34.83 33.14 2bze s MET 367 CO 0.77 -2.51 0.00 -2.30 0.00 0.00 0.00 175.02 170.98 2bze n PRO 368 N -4.03 0.09 -1.58 2.03 -0.02 -1.26 -4.84 135.00 125.38 2bze n PRO 368 Ca 0.06 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.13 2bze n PRO 368 Cb 0.57 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.02 2bze n PRO 368 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2bze s PHE 369 N -0.50 1.12 -2.24 6.00 2.99 -1.26 -4.76 117.98 119.34 2bze s PHE 369 Ca 0.00 0.94 0.20 0.00 0.00 0.00 0.00 56.93 58.07 2bze s PHE 369 Cb 0.00 -3.79 0.69 0.00 0.00 0.00 0.00 43.02 39.92 2bze s PHE 369 CO 0.00 -3.50 1.51 1.97 -0.00 0.00 0.00 175.22 175.20 2bze n PHE 370 N 13.36 0.25 -0.19 0.36 1.16 -1.26 -4.37 117.46 126.77 2bze n PHE 370 Ca 0.33 -0.12 0.16 0.00 -1.87 0.00 0.00 57.45 55.94 2bze n PHE 370 Cb 0.49 0.00 0.49 0.00 -1.61 0.00 0.00 39.48 38.85 2bze n PHE 370 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2bze h ALA 371 N 4.00 2.11 -0.27 1.98 0.00 -1.96 0.84 119.26 125.96 2bze h ALA 371 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 2bze h ALA 371 Cb 0.49 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2bze h ALA 371 CO 0.00 -0.33 -0.50 -0.22 0.00 0.00 0.00 179.25 178.20 2bze h LYS 372 N 0.44 0.77 -0.16 0.00 1.63 -1.93 -0.25 116.57 117.06 2bze h LYS 372 Ca 0.40 -0.46 -0.18 0.00 -0.85 0.00 0.00 60.65 59.56 2bze h LYS 372 Cb 0.90 0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.57 2bze h LYS 372 CO -0.14 1.08 -0.62 1.15 -3.45 0.00 0.00 179.45 177.48 2bze h THR 373 N 0.60 1.33 0.00 1.00 2.02 -1.31 -3.25 112.91 113.30 2bze h THR 373 Ca 0.02 -1.90 -0.16 0.00 0.77 0.00 0.00 66.41 65.15 2bze h THR 373 Cb 1.08 1.88 -0.02 0.00 -1.74 0.00 0.00 68.15 69.34 2bze h THR 373 CO 0.11 0.59 -1.03 -0.37 0.37 0.00 0.00 175.52 175.18 2bze h VAL 374 N 0.41 0.80 -2.73 3.16 -1.51 -0.82 -3.43 116.25 112.14 2bze h VAL 374 Ca -0.01 -2.29 -0.54 0.00 -1.23 0.00 0.00 66.70 62.63 2bze h VAL 374 Cb 1.19 2.30 -0.00 0.00 -2.13 0.00 0.00 31.29 32.65 2bze h VAL 374 CO 0.12 0.46 0.99 -0.89 -1.23 0.00 0.00 177.57 177.01 2bze s THR 375 N -2.89 3.52 0.00 7.19 2.01 -0.12 -1.41 115.64 123.94 2bze s THR 375 Ca 0.00 0.80 0.00 0.00 0.31 0.00 0.00 61.69 62.80 2bze s THR 375 Cb 0.08 -3.52 0.00 0.00 0.01 0.00 0.00 72.50 69.08 2bze s THR 375 CO 0.79 -0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.29 2bze n GLY 376 N 3.94 2.52 3.94 4.40 0.00 -0.40 -4.96 105.19 114.62 2bze n GLY 376 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 2bze n GLY 376 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bze s PHE 378 N -2.91 2.40 0.16 0.00 0.08 90.79 -0.63 117.98 207.87 2bze s PHE 378 Ca 0.55 -0.36 0.10 0.00 0.12 0.00 0.00 56.93 57.34 2bze s PHE 378 Cb -0.10 -1.41 -0.04 0.00 -0.57 0.00 0.00 43.02 40.89 2bze s PHE 378 CO 0.42 0.17 -0.22 0.54 -0.10 0.00 0.00 175.22 176.03 2bze s VAL 379 N -0.85 2.06 -0.71 -0.44 0.11 0.90 -0.92 120.40 120.55 2bze s VAL 379 Ca 0.13 -1.88 -0.18 0.00 -2.93 0.00 0.00 61.98 57.12 2bze s VAL 379 Cb -0.10 -1.92 0.13 0.00 -1.53 0.00 0.00 36.38 32.95 2bze s VAL 379 CO 0.03 -0.15 0.83 -0.60 -3.33 0.00 0.00 175.10 171.88 2bze s ARG 380 N -2.51 3.27 -0.03 1.54 6.06 -1.22 -1.77 118.95 124.30 2bze s ARG 380 Ca 0.16 -1.59 -0.03 0.00 -2.50 0.00 0.00 55.73 51.77 2bze s ARG 380 Cb -0.08 -4.44 -0.04 0.00 0.06 0.00 0.00 34.95 30.45 2bze s ARG 380 CO 0.07 -1.57 0.15 -1.50 -2.50 0.00 0.00 175.30 169.95 2bze s ILE 381 N 2.33 5.25 -0.18 4.11 1.10 -0.98 -0.15 121.20 132.69 2bze s ILE 381 Ca 0.18 -0.15 0.01 0.00 -0.51 0.00 0.00 60.65 60.17 2bze s ILE 381 Cb -0.17 -3.41 0.03 0.00 0.15 0.00 0.00 42.46 39.06 2bze s ILE 381 CO 0.00 0.39 -0.15 -0.83 -2.11 0.00 0.00 174.94 172.25 2bze s GLY 382 N -1.70 1.29 -1.00 1.50 0.00 -0.56 -0.27 107.32 106.58 2bze s GLY 382 Ca 0.24 -1.15 -0.05 0.00 0.00 0.00 0.00 44.72 43.75 2bze s GLY 382 CO 0.15 0.50 0.95 0.29 0.00 0.00 0.00 173.10 174.99 2bze n ILE 383 N 4.67 3.77 -4.94 0.90 -5.35 0.51 -4.86 119.36 114.06 2bze n ILE 383 Ca -0.17 -5.26 0.00 0.00 -0.27 0.00 0.00 62.75 57.05 2bze n ILE 383 Cb 0.48 -2.47 0.00 0.00 -1.74 0.00 0.00 39.64 35.92 2bze n ILE 383 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2bze n GLY 384 N 2.43 1.03 2.83 3.28 0.00 -1.26 -4.34 105.19 109.17 2bze n GLY 384 Ca 0.23 -0.61 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 2bze n GLY 384 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bze s ASN 385 N -4.00 0.08 0.00 1.61 4.22 -1.26 -0.88 114.94 114.71 2bze s ASN 385 Ca 0.00 0.01 0.00 0.00 -2.14 0.00 0.00 52.86 50.73 2bze s ASN 385 Cb 0.00 -0.04 0.00 0.00 1.28 0.00 0.00 41.25 42.49 2bze s ASN 385 CO 0.00 -0.05 0.25 1.57 -2.04 0.00 0.00 177.10 176.83 2bze n HIS 386 N 3.58 0.00 -3.65 1.54 -0.00 -1.26 -4.89 115.22 110.54 2bze n HIS 386 Ca -0.19 0.00 0.00 0.00 0.46 0.00 0.00 57.72 57.99 2bze n HIS 386 Cb 0.55 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.42 2bze n HIS 386 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 2bze n ASN 387 N -0.06 0.00 0.18 0.26 4.13 -1.26 -5.01 115.26 113.50 2bze n ASN 387 Ca 0.00 -0.66 0.13 0.00 1.68 0.00 0.00 54.58 55.73 2bze n ASN 387 Cb 0.10 0.00 0.69 0.00 -1.54 0.00 0.00 39.78 39.03 2bze n ASN 387 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 2bze h SER 388 N 0.00 0.00 -1.95 6.41 0.02 -2.03 -3.42 113.55 112.58 2bze h SER 388 Ca 0.00 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 2bze h SER 388 Cb 0.00 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 62.42 2bze h SER 388 CO 0.00 0.00 -0.66 -1.59 -1.14 0.00 0.00 176.83 173.44 2bze s LYS 389 N -4.98 1.92 0.71 3.45 -2.85 -1.26 -5.12 119.74 111.61 2bze s LYS 389 Ca -0.05 -1.85 -0.14 0.00 -1.00 0.00 0.00 55.97 52.93 2bze s LYS 389 Cb 0.17 -1.80 0.03 0.00 -2.06 0.00 0.00 37.83 34.17 2bze s LYS 389 CO 0.67 0.15 1.14 -2.14 0.10 0.00 0.00 175.35 175.27 2bze s PRO 390 N -3.65 2.42 -0.81 1.78 0.02 -1.26 -4.01 135.00 129.49 2bze s PRO 390 Ca 0.33 1.48 -0.16 0.00 0.02 0.00 0.00 61.00 62.66 2bze s PRO 390 Cb 0.01 -1.90 0.17 0.00 0.02 0.00 0.00 34.50 32.80 2bze s PRO 390 CO 0.18 -1.56 0.86 0.08 -0.33 0.00 0.00 177.00 176.23 2bze s VAL 391 N -2.34 5.18 0.08 3.83 1.01 -0.06 -4.89 120.40 123.21 2bze s VAL 391 Ca 0.68 -1.90 -0.12 0.00 0.00 0.00 0.00 61.98 60.64 2bze s VAL 391 Cb -0.23 -4.57 -0.06 0.00 0.00 0.00 0.00 36.38 31.52 2bze s VAL 391 CO 0.45 -1.19 0.45 -0.31 0.00 0.00 0.00 175.10 174.50 2bze s TYR 392 N 1.45 3.63 0.35 5.22 2.02 -1.26 -0.36 117.35 128.41 2bze s TYR 392 Ca 0.21 0.92 0.04 0.00 -0.37 0.00 0.00 57.07 57.87 2bze s TYR 392 Cb -0.11 -2.25 -0.03 0.00 -0.40 0.00 0.00 41.96 39.16 2bze s TYR 392 CO -0.06 0.53 0.16 1.03 -1.57 0.00 0.00 175.55 175.64 2bze s ARG 393 N -1.70 1.77 -0.31 -0.62 0.52 0.63 -4.97 118.95 114.27 2bze s ARG 393 Ca 0.32 -2.04 -0.11 0.00 -0.52 0.00 0.00 55.73 53.37 2bze s ARG 393 Cb -0.15 -0.27 -0.03 0.00 0.52 0.00 0.00 34.95 35.02 2bze s ARG 393 CO 0.17 -0.49 0.20 0.08 0.02 0.00 0.00 175.30 175.28 2bze s VAL 394 N -3.40 5.12 -0.06 3.52 1.01 -1.26 -2.32 120.40 123.01 2bze s VAL 394 Ca 0.32 -0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.25 2bze s VAL 394 Cb 0.04 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 2bze s VAL 394 CO 0.18 0.13 -0.23 0.00 0.00 0.00 0.00 175.10 175.17 2bze s ALA 395 N 1.71 2.05 0.06 5.51 0.00 -0.73 -4.57 121.76 125.80 2bze s ALA 395 Ca 0.06 -0.97 -0.26 0.00 0.00 0.00 0.00 51.96 50.80 2bze s ALA 395 Cb -0.17 -0.67 -0.06 0.00 0.00 0.00 0.00 23.12 22.23 2bze s ALA 395 CO 0.10 0.37 0.80 -2.00 0.00 0.00 0.00 175.76 175.02 2bze s GLU 396 N -0.02 4.54 -0.25 0.00 2.12 0.50 -0.34 118.70 125.24 2bze s GLU 396 Ca -0.07 1.14 -0.26 0.00 0.36 0.00 0.00 54.97 56.14 2bze s GLU 396 Cb -0.14 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.89 2bze s GLU 396 CO 0.04 0.29 0.92 0.42 -0.54 0.00 0.00 175.26 176.39 2bze s ILE 397 N -0.10 4.76 -0.70 -3.70 1.01 0.20 -0.43 121.20 122.23 2bze s ILE 397 Ca 0.40 1.71 0.01 0.00 0.00 0.00 0.00 60.65 62.77 2bze s ILE 397 Cb -0.21 -4.21 0.17 0.00 0.01 0.00 0.00 42.46 38.22 2bze s ILE 397 CO 0.24 -0.15 0.51 0.42 0.00 0.00 0.00 174.94 175.96 2bze s THR 398 N 3.03 3.41 0.11 2.92 -4.23 0.12 -1.28 115.64 119.72 2bze s THR 398 Ca 0.39 -3.67 0.00 0.00 -1.18 0.00 0.00 61.69 57.23 2bze s THR 398 Cb -0.15 -3.22 0.00 0.00 1.34 0.00 0.00 72.50 70.47 2bze s THR 398 CO 0.08 -0.95 0.00 0.61 -0.54 0.00 0.00 174.62 173.81 2bze n GLY 399 N 2.66 -1.71 3.14 3.99 0.00 -1.26 -2.44 105.19 109.57 2bze n GLY 399 Ca 0.14 -1.23 -0.27 0.00 0.00 0.00 0.00 46.02 44.67 2bze n GLY 399 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bze s VAL 400 N -0.92 1.54 0.16 1.61 1.01 -1.26 -1.80 120.40 120.74 2bze s VAL 400 Ca 0.00 -0.76 0.09 0.00 0.00 0.00 0.00 61.98 61.32 2bze s VAL 400 Cb 0.00 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2bze s VAL 400 CO 0.00 0.44 -0.15 0.68 0.00 0.00 0.00 175.10 176.07 2bze s VAL 401 N 0.17 2.89 -0.03 2.92 -7.23 0.17 -4.91 120.40 114.39 2bze s VAL 401 Ca -0.08 -1.70 -0.07 0.00 -1.81 0.00 0.00 61.98 58.32 2bze s VAL 401 Cb -0.13 -2.39 -0.05 0.00 0.56 0.00 0.00 36.38 34.37 2bze s VAL 401 CO 0.04 -0.05 0.23 -1.83 -0.31 0.00 0.00 175.10 173.18 2bze s GLU 402 N -2.59 3.55 0.39 4.82 -1.05 -1.26 0.32 118.70 122.89 2bze s GLU 402 Ca 0.22 -0.07 0.08 0.00 -0.15 0.00 0.00 54.97 55.04 2bze s GLU 402 Cb -0.09 -3.13 -0.02 0.00 -0.44 0.00 0.00 34.13 30.45 2bze s GLU 402 CO 0.12 0.70 0.38 0.95 0.95 0.00 0.00 175.26 178.36 2bze s THR 403 N -1.20 2.97 -1.15 1.83 -4.23 0.14 -4.88 115.64 109.11 2bze s THR 403 Ca 0.23 -1.29 0.13 0.00 -1.18 0.00 0.00 61.69 59.58 2bze s THR 403 Cb -0.13 -3.06 0.53 0.00 1.34 0.00 0.00 72.50 71.18 2bze s THR 403 CO 0.13 -0.05 1.39 0.00 -0.54 0.00 0.00 174.62 175.54 2bze n ALA 404 N -1.55 3.01 -3.66 3.99 0.00 -1.26 -4.74 120.51 116.31 2bze n ALA 404 Ca 0.03 -1.16 -0.17 0.00 0.00 0.00 0.00 53.44 52.14 2bze n ALA 404 Cb 0.61 -1.03 -0.15 0.00 0.00 0.00 0.00 19.45 18.87 2bze n ALA 404 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2bze s LYS 405 N -1.82 0.05 -0.04 0.00 2.47 -1.26 -5.12 119.74 114.02 2bze s LYS 405 Ca 0.37 0.56 -0.30 0.00 -1.56 0.00 0.00 55.97 55.04 2bze s LYS 405 Cb 0.24 -0.31 -0.04 0.00 -1.46 0.00 0.00 37.83 36.27 2bze s LYS 405 CO 0.17 -0.32 1.19 0.08 0.16 0.00 0.00 175.35 176.62 2bze s VAL 406 N 2.31 4.26 0.19 4.02 1.01 -1.26 -4.29 120.40 126.63 2bze s VAL 406 Ca 0.03 1.59 0.02 0.00 0.00 0.00 0.00 61.98 63.62 2bze s VAL 406 Cb -0.12 -4.02 0.02 0.00 0.00 0.00 0.00 36.38 32.25 2bze s VAL 406 CO -0.06 0.02 0.16 0.00 0.00 0.00 0.00 175.10 175.22 2bze n TYR 407 N 4.95 -1.35 -3.86 5.22 4.11 -0.62 -4.89 117.16 120.72 2bze n TYR 407 Ca 0.10 -0.80 -0.36 0.00 -0.00 0.00 0.00 57.90 56.85 2bze n TYR 407 Cb 0.46 -0.16 -0.13 0.00 -0.00 0.00 0.00 39.34 39.51 2bze n TYR 407 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 2bze s GLN 408 N -2.79 2.97 0.32 -3.48 2.00 -1.26 -3.75 119.66 113.66 2bze s GLN 408 Ca 0.12 -0.91 0.04 0.00 -2.00 0.00 0.00 55.36 52.61 2bze s GLN 408 Cb -0.01 -3.18 -0.06 0.00 0.80 0.00 0.00 33.01 30.55 2bze s GLN 408 CO 0.07 -0.42 0.05 -1.17 -0.50 0.00 0.00 175.29 173.32 2bze s LEU 409 N 1.41 2.24 0.08 3.68 2.96 -1.25 -4.76 118.68 123.04 2bze s LEU 409 Ca 0.01 -1.36 -0.33 0.00 -0.22 0.00 0.00 54.13 52.23 2bze s LEU 409 Cb -0.17 -0.42 -0.18 0.00 0.50 0.00 0.00 46.19 45.92 2bze s LEU 409 CO -0.01 -0.58 0.80 0.61 -1.32 0.00 0.00 176.35 175.85 2bze n GLY 410 N -0.68 -0.84 3.55 7.98 0.00 -1.26 -3.76 105.19 110.18 2bze n GLY 410 Ca -0.03 0.56 -0.15 0.00 0.00 0.00 0.00 46.02 46.40 2bze n GLY 410 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bze n GLY 411 N 1.62 -0.20 3.05 -0.02 0.00 -1.26 -4.81 105.19 103.57 2bze n GLY 411 Ca 0.18 0.28 -0.11 0.00 0.00 0.00 0.00 46.02 46.38 2bze n GLY 411 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2bze s THR 412 N 12.53 0.39 -0.23 2.61 -1.32 -1.25 -5.14 115.64 123.24 2bze s THR 412 Ca 0.99 -1.19 0.01 0.00 -1.21 0.00 0.00 61.69 60.29 2bze s THR 412 Cb -0.25 -0.71 0.06 0.00 -1.51 0.00 0.00 72.50 70.09 2bze s THR 412 CO 0.16 -0.53 -0.06 -0.13 -2.21 0.00 0.00 174.62 171.85 2bze s ARG 413 N -2.02 1.65 0.01 7.08 3.00 -1.26 -3.79 118.95 123.62 2bze s ARG 413 Ca -0.08 -0.94 0.02 0.00 0.00 0.00 0.00 55.73 54.73 2bze s ARG 413 Cb -0.07 -2.53 -0.01 0.00 0.00 0.00 0.00 34.95 32.34 2bze s ARG 413 CO -0.02 -0.57 -0.06 -0.08 0.00 0.00 0.00 175.30 174.58 2bze s THR 414 N 1.41 0.46 -0.88 0.02 -1.32 -1.25 -4.93 115.64 109.15 2bze s THR 414 Ca -0.05 -0.40 -0.02 0.00 -1.21 0.00 0.00 61.69 60.01 2bze s THR 414 Cb -0.18 -0.42 0.33 0.00 -1.51 0.00 0.00 72.50 70.72 2bze s THR 414 CO -0.06 0.02 2.02 -0.46 -2.21 0.00 0.00 174.62 173.93 2bze n ASN 415 N 2.65 7.47 -4.00 8.08 6.94 -1.26 -1.59 115.26 133.54 2bze n ASN 415 Ca -0.15 -3.77 -0.08 0.00 -0.02 0.00 0.00 54.58 50.56 2bze n ASN 415 Cb 0.57 -1.10 -0.10 0.00 -2.36 0.00 0.00 39.78 36.80 2bze n ASN 415 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 2bze s LYS 416 N -4.01 0.60 0.26 -3.83 0.00 -1.26 0.29 119.74 111.79 2bze s LYS 416 Ca 0.49 -1.00 -0.01 0.00 0.00 0.00 0.00 55.97 55.46 2bze s LYS 416 Cb 0.38 0.22 -0.03 0.00 0.00 0.00 0.00 37.83 38.40 2bze s LYS 416 CO -0.34 -0.13 0.27 0.20 0.00 0.00 0.00 175.35 175.34 2bze s GLY 417 N -2.55 1.57 0.10 0.59 0.00 0.15 -4.56 107.32 102.62 2bze s GLY 417 Ca 0.01 -1.66 0.06 0.00 0.00 0.00 0.00 44.72 43.13 2bze s GLY 417 CO -0.08 -1.26 -0.07 1.08 0.00 0.00 0.00 173.10 172.78 2bze s LEU 418 N -3.21 3.17 -0.56 0.66 1.43 -0.85 0.46 118.68 119.77 2bze s LEU 418 Ca 0.36 -0.33 -0.22 0.00 -1.03 0.00 0.00 54.13 52.91 2bze s LEU 418 Cb 0.04 -1.94 0.05 0.00 0.03 0.00 0.00 46.19 44.37 2bze s LEU 418 CO 0.17 0.17 0.85 -1.58 0.23 0.00 0.00 176.35 176.19 2bze s GLN 419 N -2.27 3.22 0.09 1.70 2.00 -0.75 -2.13 119.66 121.52 2bze s GLN 419 Ca 0.23 -0.60 -0.13 0.00 -2.00 0.00 0.00 55.36 52.86 2bze s GLN 419 Cb -0.11 -4.11 -0.06 0.00 0.80 0.00 0.00 33.01 29.53 2bze s GLN 419 CO 0.15 -1.48 0.48 -0.51 -0.50 0.00 0.00 175.29 173.43 2bze s LEU 420 N 3.54 4.38 -0.05 3.68 1.43 0.11 0.11 118.68 131.89 2bze s LEU 420 Ca 0.24 0.98 0.01 0.00 -1.03 0.00 0.00 54.13 54.32 2bze s LEU 420 Cb -0.16 -3.02 0.02 0.00 0.03 0.00 0.00 46.19 43.06 2bze s LEU 420 CO 0.15 0.18 -0.05 -0.60 0.23 0.00 0.00 176.35 176.26 2bze s ARG 421 N -1.72 0.91 -0.69 1.70 3.52 0.43 -0.63 118.95 122.46 2bze s ARG 421 Ca 0.33 -0.13 -0.04 0.00 -0.13 0.00 0.00 55.73 55.77 2bze s ARG 421 Cb -0.15 -0.90 0.18 0.00 -1.56 0.00 0.00 34.95 32.51 2bze s ARG 421 CO 0.18 -0.08 0.53 -1.01 -0.81 0.00 0.00 175.30 174.11 2bze s HIS 422 N 0.94 3.51 0.00 5.12 3.76 -0.75 -0.37 115.29 127.51 2bze s HIS 422 Ca -0.11 -2.72 0.00 0.00 -0.15 0.00 0.00 55.06 52.08 2bze s HIS 422 Cb -0.14 -3.26 0.00 0.00 1.11 0.00 0.00 32.58 30.29 2bze s HIS 422 CO 0.00 -0.83 0.00 0.41 -0.85 0.00 0.00 174.74 173.47 2bze n GLY 423 N 3.29 2.11 3.22 -2.22 0.00 -1.26 -2.95 105.19 107.37 2bze n GLY 423 Ca 0.11 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 2bze n GLY 423 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bze s ASN 424 N -4.00 6.61 -0.29 1.61 0.01 -1.26 -4.85 114.94 112.78 2bze s ASN 424 Ca 0.00 -3.61 -0.02 0.00 -0.71 0.00 0.00 52.86 48.51 2bze s ASN 424 Cb 0.00 -2.05 0.12 0.00 0.41 0.00 0.00 41.25 39.72 2bze s ASN 424 CO 0.00 -0.25 0.20 -0.62 -1.51 0.00 0.00 177.10 174.93 2bze s ASP 425 N 0.62 2.71 -0.38 -1.22 2.15 -1.15 -5.05 116.67 114.36 2bze s ASP 425 Ca 0.28 -1.05 -0.10 0.00 0.43 0.00 0.00 52.55 52.12 2bze s ASP 425 Cb -0.09 0.03 0.04 0.00 -0.30 0.00 0.00 42.92 42.60 2bze s ASP 425 CO -0.10 -0.42 0.19 -1.58 -0.17 0.00 0.00 175.17 173.10 2bze s GLN 426 N 2.22 2.73 0.22 4.34 0.74 -1.26 -1.80 119.66 126.85 2bze s GLN 426 Ca 0.09 -1.17 0.02 0.00 0.05 0.00 0.00 55.36 54.35 2bze s GLN 426 Cb -0.15 -3.68 -0.05 0.00 1.10 0.00 0.00 33.01 30.23 2bze s GLN 426 CO -0.35 -0.74 0.04 1.03 -0.55 0.00 0.00 175.29 174.72 2bze s ARG 427 N 1.50 1.28 -0.32 1.67 0.52 0.20 -4.98 118.95 118.81 2bze s ARG 427 Ca 0.01 -1.66 -0.06 0.00 -0.52 0.00 0.00 55.73 53.50 2bze s ARG 427 Cb -0.20 -0.33 0.03 0.00 0.52 0.00 0.00 34.95 34.97 2bze s ARG 427 CO 0.05 -0.19 0.09 0.08 0.02 0.00 0.00 175.30 175.34 2bze s VAL 428 N -3.65 3.78 0.03 3.52 1.01 -1.26 0.06 120.40 123.89 2bze s VAL 428 Ca 0.31 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.34 2bze s VAL 428 Cb 0.07 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 2bze s VAL 428 CO 0.09 -0.07 -0.05 -0.36 0.00 0.00 0.00 175.10 174.71 2bze s PHE 429 N 1.43 2.92 0.38 5.22 0.08 -0.91 -4.96 117.98 122.15 2bze s PHE 429 Ca -0.00 -0.03 -0.10 0.00 0.12 0.00 0.00 56.93 56.92 2bze s PHE 429 Cb -0.19 -1.59 -0.06 0.00 -0.57 0.00 0.00 43.02 40.62 2bze s PHE 429 CO 0.02 0.41 0.74 1.03 -0.10 0.00 0.00 175.22 177.32 2bze s ARG 430 N -1.69 3.76 0.59 0.44 3.00 -1.26 -2.02 118.95 121.78 2bze s ARG 430 Ca 0.19 0.40 0.35 0.00 0.00 0.00 0.00 55.73 56.68 2bze s ARG 430 Cb -0.11 -2.43 1.84 0.00 0.00 0.00 0.00 34.95 34.25 2bze s ARG 430 CO 0.11 0.01 2.19 -0.07 0.00 0.00 0.00 175.30 177.53 2bze h LEU 431 N 1.35 0.00 -1.38 2.53 3.38 -1.97 -2.03 115.31 117.18 2bze h LEU 431 Ca -0.47 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.45 2bze h LEU 431 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2bze h LEU 431 CO 0.64 0.04 -0.21 1.05 0.09 0.00 0.00 178.44 180.05 2bze h GLU 432 N 0.00 0.00 -0.09 1.13 4.11 -1.93 -2.87 114.58 114.93 2bze h GLU 432 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2bze h GLU 432 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2bze h GLU 432 CO 0.01 0.21 0.00 1.19 0.07 0.00 0.00 179.01 180.48 2bze n PHE 433 N -3.50 0.11 -3.23 2.06 3.72 -0.76 -4.83 117.46 111.03 2bze n PHE 433 Ca -0.01 -0.06 -0.38 0.00 -0.05 0.00 0.00 57.45 56.95 2bze n PHE 433 Cb 0.37 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.85 2bze n PHE 433 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2bze s VAL 434 N -1.89 5.11 0.15 -4.37 1.01 -1.08 -1.49 120.40 117.84 2bze s VAL 434 Ca 0.33 1.13 -0.19 0.00 0.00 0.00 0.00 61.98 63.25 2bze s VAL 434 Cb 0.17 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.58 2bze s VAL 434 CO 0.27 0.33 0.64 -0.55 0.00 0.00 0.00 175.10 175.79 2bze s SER 435 N 0.51 7.04 0.00 3.32 0.15 0.79 -4.28 113.70 121.23 2bze s SER 435 Ca 0.30 1.32 0.26 0.00 0.70 0.00 0.00 55.95 58.53 2bze s SER 435 Cb -0.16 -2.38 0.63 0.00 -1.71 0.00 0.00 66.02 62.40 2bze s SER 435 CO 0.13 0.14 1.49 0.59 1.20 0.00 0.00 173.24 176.80 2bze n ASN 436 N 1.14 1.29 -4.78 5.45 3.02 -1.26 -4.10 115.26 116.02 2bze n ASN 436 Ca -0.06 -1.08 -0.37 0.00 -0.03 0.00 0.00 54.58 53.04 2bze n ASN 436 Cb 0.51 0.18 -0.05 0.00 -0.61 0.00 0.00 39.78 39.81 2bze n ASN 436 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2bze s GLN 437 N -2.44 4.39 1.13 3.52 1.11 -1.26 -4.94 119.66 121.17 2bze s GLN 437 Ca 0.25 1.45 -0.17 0.00 0.01 0.00 0.00 55.36 56.90 2bze s GLN 437 Cb 0.19 -2.70 0.25 0.00 -1.01 0.00 0.00 33.01 29.74 2bze s GLN 437 CO 0.51 0.07 1.12 -1.21 0.01 0.00 0.00 175.29 175.80 2bze s GLU 438 N -2.22 -0.65 0.09 2.91 2.02 -1.26 -4.91 118.70 114.67 2bze s GLU 438 Ca 0.53 0.03 -0.11 0.00 0.02 0.00 0.00 54.97 55.45 2bze s GLU 438 Cb -0.21 -1.65 -0.06 0.00 0.10 0.00 0.00 34.13 32.30 2bze s GLU 438 CO 0.27 -3.36 0.43 -0.06 0.02 0.00 0.00 175.26 172.57 2bze s PHE 439 N -3.08 3.59 0.42 1.61 0.40 -1.26 -5.10 117.98 114.56 2bze s PHE 439 Ca 0.70 0.85 0.07 0.00 -0.60 0.00 0.00 56.93 57.94 2bze s PHE 439 Cb -0.11 -2.20 -0.05 0.00 0.51 0.00 0.00 43.02 41.16 2bze s PHE 439 CO 0.56 0.50 0.17 0.95 0.70 0.00 0.00 175.22 178.10 2bze s THR 440 N -1.42 2.20 0.36 0.64 -4.23 -1.26 -4.84 115.64 107.09 2bze s THR 440 Ca 0.34 -1.72 0.07 0.00 -1.18 0.00 0.00 61.69 59.20 2bze s THR 440 Cb -0.14 -2.92 0.15 0.00 1.34 0.00 0.00 72.50 70.93 2bze s THR 440 CO 0.18 0.00 1.89 1.05 -0.54 0.00 0.00 174.62 177.20 2bze h GLU 441 N 1.42 0.35 -0.29 3.99 4.11 -1.98 0.11 114.58 122.28 2bze h GLU 441 Ca -0.43 -0.08 -0.03 0.00 0.07 0.00 0.00 59.36 58.89 2bze h GLU 441 Cb 1.26 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2bze h GLU 441 CO 0.70 0.45 0.05 1.03 0.07 0.00 0.00 179.01 181.32 2bze h SER 442 N 0.33 0.45 -0.35 3.06 0.87 -1.99 0.77 113.55 116.69 2bze h SER 442 Ca 0.07 -0.26 -0.05 0.00 -1.23 0.00 0.00 61.79 60.32 2bze h SER 442 Cb 0.38 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 2bze h SER 442 CO 0.02 0.59 0.02 -0.33 -0.53 0.00 0.00 176.83 176.60 2bze h GLU 443 N 0.29 0.60 -0.51 2.24 4.39 -1.86 -2.49 114.58 117.25 2bze h GLU 443 Ca 0.09 -0.18 0.03 0.00 0.34 0.00 0.00 59.36 59.64 2bze h GLU 443 Cb 0.33 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 2bze h GLU 443 CO 0.00 0.70 0.28 0.35 -1.16 0.00 0.00 179.01 179.19 2bze h PHE 444 N 0.42 0.52 -0.39 4.33 3.04 -0.60 -1.97 116.94 122.29 2bze h PHE 444 Ca 0.10 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.06 2bze h PHE 444 Cb 0.41 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.74 2bze h PHE 444 CO 0.03 0.28 0.21 0.52 -2.02 0.00 0.00 178.31 177.33 2bze h MET 445 N 0.55 0.53 0.00 1.11 2.86 -0.65 0.20 114.93 119.52 2bze h MET 445 Ca 0.21 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.68 2bze h MET 445 Cb 0.08 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 2bze h MET 445 CO -0.12 0.39 -0.61 0.87 1.06 0.00 0.00 176.91 178.49 2bze h LYS 446 N 0.53 0.00 0.01 1.72 1.57 -0.93 -0.15 116.57 119.32 2bze h LYS 446 Ca 0.14 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.69 2bze h LYS 446 Cb 0.02 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.35 2bze h LYS 446 CO -0.02 0.61 -0.90 2.35 -0.57 0.00 0.00 179.45 180.92 2bze h TRP 447 N 0.00 0.89 -0.55 -1.35 7.01 -0.75 -2.55 115.95 118.65 2bze h TRP 447 Ca -0.01 -0.49 0.10 0.00 2.11 0.00 0.00 58.89 60.61 2bze h TRP 447 Cb 1.19 -0.10 -0.08 0.00 -2.10 0.00 0.00 29.16 28.07 2bze h TRP 447 CO 0.00 1.32 0.08 -0.22 -2.79 0.00 0.00 178.44 176.83 2bze h LYS 448 N 0.21 0.20 0.00 2.65 1.63 -0.47 0.64 116.57 121.43 2bze h LYS 448 Ca -0.11 -0.01 -0.06 0.00 -0.85 0.00 0.00 60.65 59.61 2bze h LYS 448 Cb 1.58 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 33.16 2bze h LYS 448 CO 0.18 0.13 -0.29 1.05 -3.45 0.00 0.00 179.45 177.06 2bze h GLU 449 N 0.20 0.00 -0.12 1.90 4.11 -1.04 0.96 114.58 120.59 2bze h GLU 449 Ca 0.29 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.64 2bze h GLU 449 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2bze h GLU 449 CO -0.40 0.29 -0.22 0.00 0.07 0.00 0.00 179.01 178.75 2bze h ALA 450 N 1.71 0.19 -0.23 1.06 0.00 -0.63 0.10 119.26 121.46 2bze h ALA 450 Ca -0.00 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 2bze h ALA 450 Cb 0.55 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2bze h ALA 450 CO 0.04 0.15 0.02 0.52 0.00 0.00 0.00 179.25 179.98 2bze h MET 451 N -0.05 0.39 -0.64 0.00 2.86 -0.73 -0.96 114.93 115.80 2bze h MET 451 Ca 0.01 -0.11 -0.08 0.00 -2.06 0.00 0.00 59.70 57.46 2bze h MET 451 Cb 0.80 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.40 2bze h MET 451 CO 0.05 0.55 0.10 0.35 1.06 0.00 0.00 176.91 179.02 2bze h PHE 452 N 0.18 1.14 -0.29 -0.22 3.04 -0.78 0.18 116.94 120.19 2bze h PHE 452 Ca 0.07 -0.16 -0.10 0.00 3.98 0.00 0.00 57.97 61.75 2bze h PHE 452 Cb 0.36 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.54 2bze h PHE 452 CO 0.03 0.97 -0.25 1.03 -2.02 0.00 0.00 178.31 178.06 2bze h SER 453 N 0.99 0.58 1.60 0.41 0.87 -0.74 -2.70 113.55 114.57 2bze h SER 453 Ca 0.19 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2bze h SER 453 Cb 0.45 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2bze h SER 453 CO 0.01 0.82 0.00 0.00 -0.53 0.00 0.00 176.83 177.14 2bze h ALA 454 N 1.22 1.00 0.00 6.23 0.00 -0.38 -3.46 119.26 123.87 2bze h ALA 454 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2bze h ALA 454 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2bze h ALA 454 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 2bze n GLY 455 N 0.86 0.64 3.79 0.00 0.00 0.37 -4.88 105.19 105.96 2bze n GLY 455 Ca 0.04 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 2bze n GLY 455 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bze s MET 456 N -0.59 4.17 0.30 1.61 -1.94 0.32 -4.99 119.30 118.18 2bze s MET 456 Ca 0.00 0.56 -0.28 0.00 -1.71 0.00 0.00 55.69 54.26 2bze s MET 456 Cb 0.00 -3.30 -0.09 0.00 2.01 0.00 0.00 34.83 33.45 2bze s MET 456 CO 0.00 0.49 1.06 -1.14 -0.01 0.00 0.00 175.02 175.42 2bze s GLN 457 N -0.50 4.58 0.61 2.03 0.74 -1.26 -4.01 119.66 121.85 2bze s GLN 457 Ca 0.27 1.69 -0.17 0.00 0.05 0.00 0.00 55.36 57.19 2bze s GLN 457 Cb -0.17 -3.07 -0.02 0.00 1.10 0.00 0.00 33.01 30.85 2bze s GLN 457 CO 0.15 0.20 1.14 -0.51 -0.55 0.00 0.00 175.29 175.72 2bze s LEU 458 N -1.65 3.55 0.80 3.68 2.01 -1.26 -5.01 118.68 120.80 2bze s LEU 458 Ca 0.47 2.16 -0.11 0.00 0.01 0.00 0.00 54.13 56.66 2bze s LEU 458 Cb -0.29 -4.57 0.07 0.00 0.01 0.00 0.00 46.19 41.41 2bze s LEU 458 CO 0.37 -1.55 1.09 -2.16 1.01 0.00 0.00 176.35 175.11 2bze s PRO 459 N -3.67 2.10 0.31 1.29 0.04 -1.26 -4.80 135.00 129.01 2bze s PRO 459 Ca 0.71 0.85 0.07 0.00 0.04 0.00 0.00 61.00 62.67 2bze s PRO 459 Cb -0.24 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 2bze s PRO 459 CO 0.35 -1.66 0.38 0.95 0.04 0.00 0.00 177.00 177.06 2bze s THR 460 N -3.03 4.18 0.22 1.26 -4.23 -1.26 -0.60 115.64 112.18 2bze s THR 460 Ca 0.61 -1.12 0.29 0.00 -1.18 0.00 0.00 61.69 60.29 2bze s THR 460 Cb -0.16 -3.43 0.31 0.00 1.34 0.00 0.00 72.50 70.56 2bze s THR 460 CO 0.55 -0.21 1.97 -0.07 -0.54 0.00 0.00 174.62 176.33 2bze h LEU 461 N 1.08 0.00 -0.54 4.79 -0.00 -1.73 -1.47 115.31 117.44 2bze h LEU 461 Ca -0.47 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.41 2bze h LEU 461 Cb 1.25 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.88 2bze h LEU 461 CO 0.56 0.11 0.34 -0.78 -0.00 0.00 0.00 178.44 178.67 2bze h ASP 462 N 0.00 0.64 -0.22 -0.43 1.82 -1.84 0.97 116.42 117.36 2bze h ASP 462 Ca -0.00 -0.05 -0.15 0.00 -0.39 0.00 0.00 57.03 56.44 2bze h ASP 462 Cb 0.53 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.38 2bze h ASP 462 CO 0.01 0.50 -0.46 -0.33 -1.61 0.00 0.00 179.24 177.35 2bze h GLU 463 N 0.73 0.71 -0.86 0.28 5.08 -1.72 -2.39 114.58 116.41 2bze h GLU 463 Ca 0.20 -0.46 0.03 0.00 -1.00 0.00 0.00 59.36 58.12 2bze h GLU 463 Cb -0.03 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 2bze h GLU 463 CO -0.04 1.08 0.56 0.82 -1.00 0.00 0.00 179.01 180.43 2bze h ILE 464 N 0.42 1.16 -0.31 3.13 1.08 -1.13 0.30 117.51 122.17 2bze h ILE 464 Ca 0.01 -0.38 -0.00 0.00 -0.39 0.00 0.00 64.86 64.09 2bze h ILE 464 Cb 1.07 -0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 2bze h ILE 464 CO 0.10 0.20 0.18 -1.13 -0.69 0.00 0.00 178.15 176.81 2bze h ASN 465 N 1.10 0.38 -0.74 1.72 -0.73 -0.56 0.24 115.58 116.99 2bze h ASN 465 Ca 0.33 -0.07 -0.04 0.00 1.87 0.00 0.00 56.30 58.39 2bze h ASN 465 Cb -0.04 -0.10 -0.03 0.00 0.27 0.00 0.00 38.32 38.42 2bze h ASN 465 CO -0.10 0.35 0.31 0.11 -0.37 0.00 0.00 177.43 177.72 2bze h LYS 466 N 0.39 1.11 -0.05 6.67 6.56 -0.91 -0.91 116.57 129.42 2bze h LYS 466 Ca 0.11 -0.19 -0.01 0.00 -1.06 0.00 0.00 60.65 59.50 2bze h LYS 466 Cb 0.04 -0.19 -0.00 0.00 -0.57 0.00 0.00 32.23 31.52 2bze h LYS 466 CO -0.02 0.89 -0.02 0.87 -2.06 0.00 0.00 179.45 179.11 2bze h LYS 467 N 1.08 0.11 -0.52 3.15 1.79 -0.38 -0.51 116.57 121.29 2bze h LYS 467 Ca 0.25 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.67 2bze h LYS 467 Cb 0.19 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.81 2bze h LYS 467 CO -0.02 0.46 0.28 1.05 -1.08 0.00 0.00 179.45 180.14 2bze h GLU 468 N -0.26 0.72 -0.84 3.15 4.11 -0.46 0.66 114.58 121.66 2bze h GLU 468 Ca 0.01 -0.07 -0.03 0.00 0.07 0.00 0.00 59.36 59.34 2bze h GLU 468 Cb 0.43 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 2bze h GLU 468 CO 0.01 0.53 0.40 1.25 0.07 0.00 0.00 179.01 181.27 2bze h LEU 469 N 0.72 1.11 -0.55 3.06 7.12 -1.04 -0.83 115.31 124.91 2bze h LEU 469 Ca 0.19 -0.14 -0.14 0.00 0.13 0.00 0.00 57.88 57.91 2bze h LEU 469 Cb 0.03 -0.28 -0.01 0.00 -0.53 0.00 0.00 40.66 39.86 2bze h LEU 469 CO -0.03 0.94 -0.37 0.28 -0.13 0.00 0.00 178.44 179.13 2bze h SER 470 N 1.20 0.81 0.07 1.25 0.02 0.73 -1.45 113.55 116.19 2bze h SER 470 Ca 0.29 -0.36 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2bze h SER 470 Cb 0.13 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.44 2bze h SER 470 CO -0.03 1.09 -0.03 0.40 -1.14 0.00 0.00 176.83 177.11 2bze h ILE 471 N 0.64 1.12 -0.53 3.27 1.08 -0.64 -2.18 117.51 120.26 2bze h ILE 471 Ca 0.06 -0.68 -0.07 0.00 -0.39 0.00 0.00 64.86 63.78 2bze h ILE 471 Cb 0.91 1.56 -0.02 0.00 -3.07 0.00 0.00 36.82 36.20 2bze h ILE 471 CO 0.08 0.17 0.06 0.07 -0.69 0.00 0.00 178.15 177.84 2bze h LYS 472 N -0.40 0.86 0.00 2.37 2.10 -1.11 -1.41 116.57 118.97 2bze h LYS 472 Ca -0.01 -0.21 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 2bze h LYS 472 Cb 0.35 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2bze h LYS 472 CO 0.02 0.82 0.00 1.05 -2.00 0.00 0.00 179.45 179.34 2bze h GLU 473 N 0.81 0.00 0.13 0.07 4.11 -1.22 -1.61 114.58 116.86 2bze h GLU 473 Ca 0.17 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.36 2bze h GLU 473 Cb 0.40 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.66 2bze h GLU 473 CO 0.01 0.00 -1.16 0.00 0.07 0.00 0.00 179.01 177.93 2bze h ALA 474 N 2.00 0.06 0.00 1.06 0.00 -0.86 -3.37 119.26 118.15 2bze h ALA 474 Ca 0.00 -0.92 -0.13 0.00 0.00 0.00 0.00 54.91 53.86 2bze h ALA 474 Cb 0.84 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2bze h ALA 474 CO 0.00 0.63 -0.60 1.37 0.00 0.00 0.00 179.25 180.65 2bze h LEU 475 N -0.33 0.00 -1.48 0.00 8.10 -1.26 -3.52 115.31 116.82 2bze h LEU 475 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.75 2bze h LEU 475 Cb 1.72 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.94 2bze h LEU 475 CO 0.10 0.60 0.00 -3.20 -4.11 0.00 0.00 178.44 171.83