#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bze s GLY -20 N 0.00 2.16 0.39 3.17 0.00 -1.26 -5.00 107.32 106.77 2bze s GLY -20 Ca 0.00 1.45 0.04 0.00 0.00 0.00 0.00 44.72 46.20 2bze s GLY -20 CO 0.00 2.44 0.07 -1.35 0.00 0.00 0.00 173.10 174.26 2bze s SER -19 N 0.49 2.89 0.00 1.64 1.04 -1.26 -5.01 113.70 113.49 2bze s SER -19 Ca 0.62 -1.53 0.00 0.00 0.48 0.00 0.00 55.95 55.52 2bze s SER -19 Cb -0.45 0.20 0.00 0.00 0.10 0.00 0.00 66.02 65.88 2bze s SER -19 CO 0.44 -0.75 0.00 -0.24 0.98 0.00 0.00 173.24 173.67 2bze n SER -18 N -1.02 0.40 -1.24 7.02 2.88 -1.26 -5.05 113.62 115.35 2bze n SER -18 Ca -0.06 -1.00 0.08 0.00 -1.33 0.00 0.00 58.87 56.56 2bze n SER -18 Cb 0.66 0.00 0.31 0.00 -0.75 0.00 0.00 64.21 64.43 2bze n SER -18 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2bze n HIS -17 N 0.00 1.33 -4.02 0.66 -0.00 -1.26 -4.96 115.22 106.97 2bze n HIS -17 Ca 0.00 -0.81 -0.27 0.00 0.46 0.00 0.00 57.72 57.09 2bze n HIS -17 Cb 0.00 -0.37 -0.05 0.00 -0.12 0.00 0.00 29.99 29.45 2bze n HIS -17 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2bze s HIS -16 N -2.74 3.29 -0.13 1.57 3.76 -1.26 -5.08 115.29 114.70 2bze s HIS -16 Ca 0.46 0.07 -0.21 0.00 -0.15 0.00 0.00 55.06 55.23 2bze s HIS -16 Cb 0.36 -1.60 -0.03 0.00 1.11 0.00 0.00 32.58 32.42 2bze s HIS -16 CO 0.12 0.53 0.61 -1.58 -0.85 0.00 0.00 174.74 173.56 2bze s HIS -15 N -1.65 3.48 -0.12 1.40 2.46 -1.26 -4.35 115.29 115.23 2bze s HIS -15 Ca 0.32 1.02 -0.03 0.00 0.47 0.00 0.00 55.06 56.84 2bze s HIS -15 Cb -0.11 -2.73 0.00 0.00 -0.13 0.00 0.00 32.58 29.61 2bze s HIS -15 CO 0.25 0.00 0.11 0.72 -2.47 0.00 0.00 174.74 173.36 2bze n HIS -14 N 4.26 -1.23 -1.86 3.88 -0.00 -1.26 -5.03 115.22 113.99 2bze n HIS -14 Ca -0.03 0.52 0.00 0.00 -0.00 0.00 0.00 57.72 58.21 2bze n HIS -14 Cb 0.51 -2.35 0.00 0.00 -0.00 0.00 0.00 29.99 28.15 2bze n HIS -14 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2bze n HIS -13 N -0.14 0.00 -0.20 4.41 1.44 -1.26 -4.95 115.22 114.53 2bze n HIS -13 Ca 0.02 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.66 2bze n HIS -13 Cb 0.08 0.01 0.03 0.00 0.12 0.00 0.00 29.99 30.23 2bze n HIS -13 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2bze h HIS -12 N 0.00 0.78 -5.52 -1.40 -0.00 -1.95 -3.46 115.15 103.61 2bze h HIS -12 Ca 0.00 -0.02 -0.41 0.00 -0.00 0.00 0.00 60.37 59.93 2bze h HIS -12 Cb 1.27 -0.25 0.08 0.00 -0.00 0.00 0.00 27.41 28.52 2bze h HIS -12 CO 0.03 0.58 -0.67 0.45 -0.00 0.00 0.00 177.93 178.31 2bze n SER -11 N -4.59 -6.01 0.00 2.45 2.88 -1.26 -4.03 113.62 103.06 2bze n SER -11 Ca 0.03 -0.50 0.00 0.00 -1.33 0.00 0.00 58.87 57.07 2bze n SER -11 Cb 0.09 -4.78 0.00 0.00 -0.75 0.00 0.00 64.21 58.78 2bze n SER -11 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2bze n SER -10 N -2.83 0.00 0.00 -3.46 3.41 -1.26 -4.88 113.62 104.60 2bze n SER -10 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 2bze n SER -10 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2bze n SER -10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bze n GLY -9 N 0.00 1.74 3.02 5.00 0.00 -1.26 -4.81 105.19 108.89 2bze n GLY -9 Ca 0.00 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 2bze n GLY -9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bze n LEU -8 N 0.00 -6.06 -4.52 0.99 4.32 -1.26 -5.02 117.00 105.44 2bze n LEU -8 Ca 0.00 0.57 -0.34 0.00 -0.02 0.00 0.00 56.01 56.23 2bze n LEU -8 Cb 0.00 -2.71 -0.12 0.00 -1.62 0.00 0.00 43.42 38.98 2bze n LEU -8 CO 0.00 -1.89 -0.36 0.54 -1.22 0.00 0.00 177.39 174.47 2bze s VAL -7 N -1.87 3.87 -0.23 4.08 0.11 -1.26 -5.05 120.40 120.05 2bze s VAL -7 Ca 0.19 -0.38 -0.29 0.00 -2.93 0.00 0.00 61.98 58.57 2bze s VAL -7 Cb -0.04 -2.67 -0.05 0.00 -1.53 0.00 0.00 36.38 32.09 2bze s VAL -7 CO 0.69 0.52 2.22 -0.81 -3.33 0.00 0.00 175.10 174.39 2bze n PRO -6 N 3.27 1.91 -0.01 1.54 -0.04 -1.26 -4.78 135.00 135.63 2bze n PRO -6 Ca -0.18 0.52 0.10 0.00 -0.04 0.00 0.00 63.50 63.91 2bze n PRO -6 Cb 0.53 -3.19 -0.15 0.00 -0.04 0.00 0.00 33.50 30.64 2bze n PRO -6 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2bze n ARG -5 N 8.72 0.53 -1.60 0.54 1.74 -1.26 -4.59 116.66 120.74 2bze n ARG -5 Ca 0.31 -0.14 -0.40 0.00 -0.77 0.00 0.00 57.85 56.85 2bze n ARG -5 Cb 0.43 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.37 2bze n ARG -5 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bze n GLY -4 N 1.36 4.65 0.09 -0.13 0.00 -1.26 -4.50 105.19 105.40 2bze n GLY -4 Ca -0.02 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 44.15 2bze n GLY -4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2bze h SER -3 N 4.88 0.18 -0.07 1.61 0.87 -1.99 -3.33 113.55 115.69 2bze h SER -3 Ca 0.80 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 61.09 2bze h SER -3 Cb 0.30 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 2bze h SER -3 CO 1.67 1.22 0.00 1.57 -0.53 0.00 0.00 176.83 180.76 2bze n HIS -2 N -3.30 0.07 -1.34 2.24 -0.00 -1.26 -5.07 115.22 106.55 2bze n HIS -2 Ca -0.13 -0.03 0.18 0.00 -0.00 0.00 0.00 57.72 57.73 2bze n HIS -2 Cb 1.02 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.96 2bze n HIS -2 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2bze n MET -1 N 1.12 -2.72 -1.92 1.57 2.81 -1.25 -4.37 117.12 112.35 2bze n MET -1 Ca 0.16 1.84 -0.43 0.00 -1.81 0.00 0.00 57.70 57.46 2bze n MET -1 Cb 0.55 -3.32 -0.03 0.00 -0.71 0.00 0.00 33.22 29.71 2bze n MET -1 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2bze s VAL 345 N -2.34 3.41 0.00 2.03 -7.23 -0.12 -4.68 120.40 111.47 2bze s VAL 345 Ca 0.00 0.44 0.00 0.00 -1.81 0.00 0.00 61.98 60.61 2bze s VAL 345 Cb 0.00 -3.47 0.00 0.00 0.56 0.00 0.00 36.38 33.47 2bze s VAL 345 CO 0.00 -0.25 0.75 -1.20 -0.31 0.00 0.00 175.10 174.10 2bze n SER 346 N 9.66 1.45 -3.98 4.85 7.64 -1.26 -4.94 113.62 127.03 2bze n SER 346 Ca 0.23 -1.55 -0.24 0.00 1.01 0.00 0.00 58.87 58.32 2bze n SER 346 Cb 0.45 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.49 2bze n SER 346 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2bze s LEU 347 N -0.55 1.51 0.63 -3.43 1.02 -1.26 -4.99 118.68 111.62 2bze s LEU 347 Ca 0.00 -0.27 0.36 0.00 0.02 0.00 0.00 54.13 54.24 2bze s LEU 347 Cb 0.00 -0.76 2.00 0.00 0.02 0.00 0.00 46.19 47.45 2bze s LEU 347 CO 0.00 -0.01 2.21 -0.65 0.02 0.00 0.00 176.35 177.92 2bze h PRO 348 N 7.20 0.00 -0.23 1.29 0.11 -1.92 -1.94 132.00 136.51 2bze h PRO 348 Ca -0.32 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.67 2bze h PRO 348 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2bze h PRO 348 CO 0.46 0.00 -0.36 1.05 -0.21 0.00 0.00 178.00 178.94 2bze h GLU 349 N 0.00 0.50 -0.03 1.05 4.11 -1.94 0.29 114.58 118.57 2bze h GLU 349 Ca 0.02 -0.23 -0.16 0.00 0.07 0.00 0.00 59.36 59.05 2bze h GLU 349 Cb 0.23 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2bze h GLU 349 CO -0.00 0.79 -0.72 0.93 0.07 0.00 0.00 179.01 180.08 2bze h GLU 350 N 0.42 0.18 0.00 1.06 4.39 -1.79 -2.03 114.58 116.81 2bze h GLU 350 Ca 0.04 -0.15 -0.02 0.00 0.34 0.00 0.00 59.36 59.57 2bze h GLU 350 Cb 0.83 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.51 2bze h GLU 350 CO 0.07 0.82 -0.10 1.25 -1.16 0.00 0.00 179.01 179.89 2bze h LEU 351 N 0.12 0.00 -0.02 1.33 5.85 -1.22 -2.85 115.31 118.52 2bze h LEU 351 Ca -0.02 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.47 2bze h LEU 351 Cb 1.28 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 2bze h LEU 351 CO 0.11 0.10 -1.07 0.78 -0.34 0.00 0.00 178.44 178.02 2bze h ASN 352 N 0.00 0.25 0.60 1.25 2.35 0.19 0.54 115.58 120.75 2bze h ASN 352 Ca -0.00 -0.25 -0.14 0.00 -0.55 0.00 0.00 56.30 55.36 2bze h ASN 352 Cb 0.87 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 2bze h ASN 352 CO 0.01 1.15 -0.64 0.08 -1.65 0.00 0.00 177.43 176.39 2bze h ARG 353 N 0.06 0.04 -0.01 0.81 0.11 -1.29 -2.69 114.38 111.41 2bze h ARG 353 Ca -0.07 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 59.98 2bze h ARG 353 Cb 1.78 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.87 2bze h ARG 353 CO 0.16 0.67 -0.19 1.33 0.10 0.00 0.00 179.97 182.03 2bze n VAL 354 N -3.79 0.00 -2.38 0.08 0.24 -1.09 -4.68 118.33 106.72 2bze n VAL 354 Ca -0.01 -0.16 -0.41 0.00 -2.04 0.00 0.00 64.34 61.72 2bze n VAL 354 Cb 0.64 0.42 -0.04 0.00 -1.47 0.00 0.00 33.84 33.39 2bze n VAL 354 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2bze s ARG 355 N -2.38 4.51 0.07 7.34 3.52 0.17 -1.82 118.95 130.37 2bze s ARG 355 Ca 0.28 1.88 0.07 0.00 -0.13 0.00 0.00 55.73 57.83 2bze s ARG 355 Cb 0.20 -3.22 -0.04 0.00 -1.56 0.00 0.00 34.95 30.33 2bze s ARG 355 CO 0.47 -0.03 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.29 2bze s LEU 356 N -0.57 2.86 0.29 -0.88 1.43 -0.01 -4.95 118.68 116.86 2bze s LEU 356 Ca 0.51 -0.39 0.06 0.00 -1.03 0.00 0.00 54.13 53.28 2bze s LEU 356 Cb -0.33 -1.68 -0.02 0.00 0.03 0.00 0.00 46.19 44.19 2bze s LEU 356 CO 0.38 0.22 0.34 -0.94 0.23 0.00 0.00 176.35 176.59 2bze s SER 357 N -1.81 5.82 0.46 2.29 1.04 -1.26 -3.75 113.70 116.49 2bze s SER 357 Ca 0.18 -0.20 0.31 0.00 0.48 0.00 0.00 55.95 56.72 2bze s SER 357 Cb -0.11 -1.38 1.43 0.00 0.10 0.00 0.00 66.02 66.06 2bze s SER 357 CO 0.09 -0.23 1.94 0.08 0.98 0.00 0.00 173.24 176.10 2bze h ARG 358 N 1.17 0.00 -0.37 4.02 0.11 -1.74 -1.33 114.38 116.25 2bze h ARG 358 Ca -0.48 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 59.53 2bze h ARG 358 Cb 1.24 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.31 2bze h ARG 358 CO 0.58 0.00 -0.09 1.25 0.10 0.00 0.00 179.97 181.81 2bze h HIS 359 N 0.00 0.67 -0.07 4.08 2.76 -1.92 0.15 115.15 120.83 2bze h HIS 359 Ca 0.00 -0.10 -0.21 0.00 -2.20 0.00 0.00 60.37 57.86 2bze h HIS 359 Cb 0.31 -0.18 0.01 0.00 1.55 0.00 0.00 27.41 29.11 2bze h HIS 359 CO 0.00 0.70 -0.78 0.87 -1.30 0.00 0.00 177.93 177.42 2bze h LYS 360 N 0.58 0.64 -0.72 5.26 1.57 -1.65 -2.47 116.57 119.78 2bze h LYS 360 Ca 0.11 -0.60 -0.06 0.00 -1.87 0.00 0.00 60.65 58.23 2bze h LYS 360 Cb 0.50 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 2bze h LYS 360 CO 0.03 1.21 0.22 -0.07 -0.57 0.00 0.00 179.45 180.27 2bze h LEU 361 N 0.29 1.06 -1.44 2.94 3.38 -1.24 -0.70 115.31 119.60 2bze h LEU 361 Ca -0.08 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.69 2bze h LEU 361 Cb 1.43 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 2bze h LEU 361 CO 0.16 0.99 0.39 -0.08 0.09 0.00 0.00 178.44 179.99 2bze h GLU 362 N 1.07 0.75 0.00 1.13 4.81 -0.62 0.16 114.58 121.88 2bze h GLU 362 Ca 0.23 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2bze h GLU 362 Cb 0.31 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2bze h GLU 362 CO -0.01 0.50 -0.49 0.07 -0.73 0.00 0.00 179.01 178.35 2bze h ARG 363 N 0.77 0.00 -0.00 1.92 -0.00 -0.88 -3.25 114.38 112.94 2bze h ARG 363 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.20 2bze h ARG 363 Cb -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.92 2bze h ARG 363 CO -0.05 0.00 -0.65 0.91 -0.00 0.00 0.00 179.97 180.18 2bze n TRP 364 N -2.76 0.00 -0.29 4.08 8.01 -0.34 -4.27 117.44 121.87 2bze n TRP 364 Ca 0.02 0.00 -0.05 0.00 -1.31 0.00 0.00 57.50 56.16 2bze n TRP 364 Cb 0.52 -0.12 0.07 0.00 -2.01 0.00 0.00 31.31 29.77 2bze n TRP 364 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2bze n HIS 366 N -4.43 0.18 -1.11 0.00 1.44 -1.26 -4.92 115.22 105.12 2bze n HIS 366 Ca 0.07 0.05 -0.30 0.00 -2.01 0.00 0.00 57.72 55.53 2bze n HIS 366 Cb 0.09 -0.35 0.25 0.00 0.12 0.00 0.00 29.99 30.11 2bze n HIS 366 CO 0.00 0.00 0.00 -1.64 -2.81 0.00 0.00 176.34 171.89 2bze s MET 367 N -3.13 -1.55 0.00 -1.40 1.00 -0.88 -5.06 119.30 108.29 2bze s MET 367 Ca 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 55.69 55.51 2bze s MET 367 Cb 0.15 -1.57 0.00 0.00 0.00 0.00 0.00 34.83 33.41 2bze s MET 367 CO 0.78 -3.89 0.00 -2.30 0.00 0.00 0.00 175.02 169.61 2bze n PRO 368 N -4.86 -0.54 -1.98 2.03 -0.02 -1.26 -4.78 135.00 123.59 2bze n PRO 368 Ca 0.16 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.24 2bze n PRO 368 Cb 0.60 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.05 2bze n PRO 368 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2bze s PHE 369 N -0.57 1.64 -0.69 6.00 -0.71 -1.26 -4.71 117.98 117.69 2bze s PHE 369 Ca 0.00 0.83 0.24 0.00 -1.04 0.00 0.00 56.93 56.96 2bze s PHE 369 Cb 0.00 -4.05 0.40 0.00 -1.21 0.00 0.00 43.02 38.16 2bze s PHE 369 CO 0.00 -2.48 1.36 1.97 -1.34 0.00 0.00 175.22 174.72 2bze n PHE 370 N 12.44 0.50 -0.31 3.49 -1.74 -1.26 -4.20 117.46 126.37 2bze n PHE 370 Ca 0.23 0.15 0.13 0.00 -0.56 0.00 0.00 57.45 57.39 2bze n PHE 370 Cb 0.51 -0.62 0.31 0.00 1.52 0.00 0.00 39.48 41.20 2bze n PHE 370 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2bze h ALA 371 N 2.57 1.46 -0.55 1.98 0.00 -1.96 0.99 119.26 123.76 2bze h ALA 371 Ca 0.00 0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2bze h ALA 371 Cb 0.71 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2bze h ALA 371 CO 0.00 -0.30 0.03 -0.22 0.00 0.00 0.00 179.25 178.77 2bze h LYS 372 N 0.46 0.95 -0.26 0.00 1.63 -1.94 0.36 116.57 117.76 2bze h LYS 372 Ca 0.56 -0.28 -0.14 0.00 -0.85 0.00 0.00 60.65 59.94 2bze h LYS 372 Cb 1.03 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.55 2bze h LYS 372 CO -0.50 0.94 -0.40 1.15 -3.45 0.00 0.00 179.45 177.19 2bze h THR 373 N 0.83 1.30 0.00 1.00 2.02 -1.35 -3.10 112.91 113.61 2bze h THR 373 Ca 0.16 -1.57 -0.12 0.00 0.77 0.00 0.00 66.41 65.65 2bze h THR 373 Cb 0.49 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 2bze h THR 373 CO 0.02 0.50 -0.81 -0.37 0.37 0.00 0.00 175.52 175.23 2bze h VAL 374 N 0.50 0.74 -2.30 3.16 -1.51 -0.67 -3.42 116.25 112.74 2bze h VAL 374 Ca 0.04 -2.13 -0.55 0.00 -1.23 0.00 0.00 66.70 62.83 2bze h VAL 374 Cb 0.91 2.28 0.02 0.00 -2.13 0.00 0.00 31.29 32.38 2bze h VAL 374 CO 0.08 0.42 1.17 0.41 -1.23 0.00 0.00 177.57 178.42 2bze n THR 375 N -3.10 0.63 0.00 7.19 -1.04 0.10 -0.97 114.28 117.08 2bze n THR 375 Ca -0.02 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 2bze n THR 375 Cb 0.77 -2.16 0.00 0.00 -1.82 0.00 0.00 70.33 67.12 2bze n THR 375 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2bze n GLY 376 N 4.43 3.08 3.93 3.41 0.00 -0.29 -4.98 105.19 114.77 2bze n GLY 376 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.42 1.75 0.13 0.00 0.08166.09 -0.31 117.98 282.30 2bze s PHE 378 Ca 0.63 -0.46 0.06 0.00 0.12 0.00 0.00 56.93 57.28 2bze s PHE 378 Cb -0.10 -0.90 -0.04 0.00 -0.57 0.00 0.00 43.02 41.41 2bze s PHE 378 CO 0.47 0.27 -0.14 0.14 -0.10 0.00 0.00 175.22 175.85 2bze s VAL 379 N -1.79 1.37 -0.69 -0.44 -7.23 0.42 -0.83 120.40 111.22 2bze s VAL 379 Ca 0.12 -1.74 -0.24 0.00 -1.81 0.00 0.00 61.98 58.31 2bze s VAL 379 Cb -0.07 -1.57 0.06 0.00 0.56 0.00 0.00 36.38 35.36 2bze s VAL 379 CO 0.05 -0.42 1.06 -0.60 -0.31 0.00 0.00 175.10 174.89 2bze s ARG 380 N -2.71 3.14 -0.05 4.82 6.06 -1.25 -2.16 118.95 126.80 2bze s ARG 380 Ca 0.10 -0.68 -0.03 0.00 -2.50 0.00 0.00 55.73 52.62 2bze s ARG 380 Cb -0.05 -4.23 -0.04 0.00 0.06 0.00 0.00 34.95 30.70 2bze s ARG 380 CO 0.03 -1.91 0.13 -1.50 -2.50 0.00 0.00 175.30 169.55 2bze s ILE 381 N 4.53 5.18 -0.16 4.11 1.10 -1.01 0.28 121.20 135.23 2bze s ILE 381 Ca 0.26 -0.12 0.00 0.00 -0.51 0.00 0.00 60.65 60.28 2bze s ILE 381 Cb -0.14 -3.34 0.03 0.00 0.15 0.00 0.00 42.46 39.16 2bze s ILE 381 CO 0.11 0.44 -0.09 -0.83 -2.11 0.00 0.00 174.94 172.46 2bze s GLY 382 N -1.53 1.06 -1.24 1.50 0.00 -1.15 -0.19 107.32 105.77 2bze s GLY 382 Ca 0.21 -0.91 -0.14 0.00 0.00 0.00 0.00 44.72 43.88 2bze s GLY 382 CO 0.12 0.75 1.53 0.29 0.00 0.00 0.00 173.10 175.79 2bze n ILE 383 N 4.81 4.18 -0.48 0.90 -5.35 0.65 -4.79 119.36 119.28 2bze n ILE 383 Ca -0.14 -4.56 0.06 0.00 -0.27 0.00 0.00 62.75 57.84 2bze n ILE 383 Cb 0.48 -2.44 -0.03 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 4.30 -2.75 2.75 3.28 0.00 -1.26 -4.27 105.19 107.24 2bze n GLY 384 Ca 0.40 -1.32 -0.28 0.00 0.00 0.00 0.00 46.02 44.81 2bze n GLY 384 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bze n ASN 385 N -2.84 4.41 0.11 1.61 6.94 -1.26 -2.28 115.26 121.95 2bze n ASN 385 Ca -0.03 -3.60 0.05 0.00 -0.02 0.00 0.00 54.58 50.98 2bze n ASN 385 Cb 0.23 -0.64 0.01 0.00 -2.36 0.00 0.00 39.78 37.02 2bze n ASN 385 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 2bze h HIS 386 N 3.50 0.00 -2.48 -2.53 2.07 -1.85 -3.45 115.15 110.40 2bze h HIS 386 Ca 0.17 0.00 -0.46 0.00 -2.85 0.00 0.00 60.37 57.24 2bze h HIS 386 Cb 0.55 0.00 0.07 0.00 2.57 0.00 0.00 27.41 30.61 2bze h HIS 386 CO 0.82 0.35 0.09 1.21 -3.07 0.00 0.00 177.93 177.33 2bze s ASN 387 N -5.99 4.62 0.50 3.10 3.84 -1.26 -4.97 114.94 114.78 2bze s ASN 387 Ca 0.01 -0.16 0.19 0.00 0.21 0.00 0.00 52.86 53.11 2bze s ASN 387 Cb 0.08 -0.38 1.26 0.00 -0.55 0.00 0.00 41.25 41.66 2bze s ASN 387 CO 0.76 -1.66 2.09 0.28 -2.79 0.00 0.00 177.10 175.78 2bze h SER 388 N -0.40 0.00 -4.26 -4.21 0.02 -1.99 -3.41 113.55 99.30 2bze h SER 388 Ca -0.39 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.03 2bze h SER 388 Cb 1.28 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.60 2bze h SER 388 CO 0.46 0.09 -0.82 -1.59 -1.14 0.00 0.00 176.83 173.83 2bze s LYS 389 N -4.72 1.08 0.58 3.45 -2.85 -1.26 -5.12 119.74 110.90 2bze s LYS 389 Ca -0.04 -1.07 -0.21 0.00 -1.00 0.00 0.00 55.97 53.65 2bze s LYS 389 Cb 0.16 -1.27 -0.04 0.00 -2.06 0.00 0.00 37.83 34.63 2bze s LYS 389 CO 0.65 0.30 1.35 -2.14 0.10 0.00 0.00 175.35 175.61 2bze s PRO 390 N -1.74 2.93 -1.01 1.78 0.02 -1.26 -4.68 135.00 131.04 2bze s PRO 390 Ca 0.05 2.21 -0.20 0.00 0.02 0.00 0.00 61.00 63.08 2bze s PRO 390 Cb -0.10 -2.12 0.10 0.00 0.02 0.00 0.00 34.50 32.40 2bze s PRO 390 CO 0.03 -1.35 1.30 0.08 -0.33 0.00 0.00 177.00 176.74 2bze s VAL 391 N -1.32 4.43 0.15 3.83 1.01 -0.97 -4.89 120.40 122.64 2bze s VAL 391 Ca 0.75 -1.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.04 2bze s VAL 391 Cb -0.40 -4.91 -0.07 0.00 0.00 0.00 0.00 36.38 31.00 2bze s VAL 391 CO 0.46 -1.70 0.95 -0.31 0.00 0.00 0.00 175.10 174.50 2bze s TYR 392 N 3.50 3.86 0.25 5.22 2.02 -1.26 -0.25 117.35 130.70 2bze s TYR 392 Ca 0.40 1.83 0.02 0.00 -0.37 0.00 0.00 57.07 58.95 2bze s TYR 392 Cb -0.02 -3.03 -0.04 0.00 -0.40 0.00 0.00 41.96 38.47 2bze s TYR 392 CO -0.08 0.28 0.20 1.03 -1.57 0.00 0.00 175.55 175.41 2bze s ARG 393 N -0.32 1.43 -0.40 -0.62 0.52 0.73 -4.96 118.95 115.34 2bze s ARG 393 Ca 0.45 -1.78 -0.18 0.00 -0.52 0.00 0.00 55.73 53.71 2bze s ARG 393 Cb -0.24 0.30 0.01 0.00 0.52 0.00 0.00 34.95 35.54 2bze s ARG 393 CO 0.30 -0.50 0.48 0.08 0.02 0.00 0.00 175.30 175.68 2bze s VAL 394 N -3.86 5.04 -0.24 3.52 1.01 -1.26 -2.42 120.40 122.19 2bze s VAL 394 Ca 0.39 -0.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.26 2bze s VAL 394 Cb 0.05 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 2bze s VAL 394 CO 0.18 -0.36 0.03 0.00 0.00 0.00 0.00 175.10 174.95 2bze s ALA 395 N 2.30 3.03 0.11 5.51 0.00 -0.92 -4.24 121.76 127.55 2bze s ALA 395 Ca 0.15 -1.16 -0.29 0.00 0.00 0.00 0.00 51.96 50.67 2bze s ALA 395 Cb -0.16 -1.94 -0.06 0.00 0.00 0.00 0.00 23.12 20.96 2bze s ALA 395 CO 0.14 -0.49 0.91 -2.00 0.00 0.00 0.00 175.76 174.33 2bze s GLU 396 N 1.56 4.67 -0.36 0.00 2.12 0.10 -0.43 118.70 126.35 2bze s GLU 396 Ca 0.06 1.37 -0.26 0.00 0.36 0.00 0.00 54.97 56.50 2bze s GLU 396 Cb -0.15 -3.36 0.01 0.00 0.26 0.00 0.00 34.13 30.90 2bze s GLU 396 CO 0.01 0.28 0.94 0.42 -0.54 0.00 0.00 175.26 176.36 2bze s ILE 397 N -0.19 4.58 -0.82 -3.70 1.01 0.58 -1.29 121.20 121.37 2bze s ILE 397 Ca 0.44 1.25 -0.03 0.00 0.00 0.00 0.00 60.65 62.32 2bze s ILE 397 Cb -0.23 -4.34 0.21 0.00 0.01 0.00 0.00 42.46 38.11 2bze s ILE 397 CO 0.29 -0.52 0.69 0.42 0.00 0.00 0.00 174.94 175.82 2bze s THR 398 N 3.48 4.29 0.00 2.92 -4.23 0.81 -1.14 115.64 121.78 2bze s THR 398 Ca 0.39 -3.54 0.00 0.00 -1.18 0.00 0.00 61.69 57.36 2bze s THR 398 Cb -0.12 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 70.03 2bze s THR 398 CO 0.18 -1.03 0.00 0.61 -0.54 0.00 0.00 174.62 173.84 2bze n GLY 399 N 2.74 -0.74 3.10 3.99 0.00 -1.26 -2.43 105.19 110.59 2bze n GLY 399 Ca 0.17 -1.03 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 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 0.00 1.71 0.42 1.61 1.01 -1.26 -2.03 120.40 121.85 2bze s VAL 400 Ca 0.00 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.29 2bze s VAL 400 Cb 0.00 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2bze s VAL 400 CO 0.00 0.48 0.27 0.68 0.00 0.00 0.00 175.10 176.53 2bze s VAL 401 N 0.94 2.45 0.12 2.92 -7.23 0.22 -4.91 120.40 114.91 2bze s VAL 401 Ca -0.06 -1.54 0.08 0.00 -1.81 0.00 0.00 61.98 58.64 2bze s VAL 401 Cb -0.15 -2.99 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 2bze s VAL 401 CO -0.02 0.00 -0.10 -1.61 -0.31 0.00 0.00 175.10 173.06 2bze s GLU 402 N -4.01 2.09 0.37 4.82 2.02 -1.26 -0.35 118.70 122.38 2bze s GLU 402 Ca 0.44 -1.09 0.08 0.00 0.02 0.00 0.00 54.97 54.42 2bze s GLU 402 Cb 0.01 -2.26 -0.04 0.00 0.10 0.00 0.00 34.13 31.94 2bze s GLU 402 CO 0.25 0.49 0.18 0.95 0.02 0.00 0.00 175.26 177.14 2bze s THR 403 N -1.33 2.80 -0.32 3.63 -4.23 0.81 -4.82 115.64 112.18 2bze s THR 403 Ca 0.22 -1.66 0.10 0.00 -1.18 0.00 0.00 61.69 59.17 2bze s THR 403 Cb -0.10 -2.98 0.75 0.00 1.34 0.00 0.00 72.50 71.50 2bze s THR 403 CO 0.14 -0.12 1.80 0.00 -0.54 0.00 0.00 174.62 175.91 2bze n ALA 404 N -1.21 4.56 -3.56 3.99 0.00 -1.26 -4.68 120.51 118.34 2bze n ALA 404 Ca -0.02 -2.36 -0.10 0.00 0.00 0.00 0.00 53.44 50.97 2bze n ALA 404 Cb 0.62 -1.23 -0.10 0.00 0.00 0.00 0.00 19.45 18.74 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 -3.00 0.30 -0.06 0.00 2.36 -1.26 -5.12 119.74 112.96 2bze s LYS 405 Ca 0.55 0.81 -0.30 0.00 -2.55 0.00 0.00 55.97 54.49 2bze s LYS 405 Cb 0.44 -0.02 -0.04 0.00 -1.05 0.00 0.00 37.83 37.17 2bze s LYS 405 CO 0.13 -0.39 1.28 0.08 1.55 0.00 0.00 175.35 178.01 2bze s VAL 406 N 2.55 4.08 0.41 4.02 1.01 -1.26 -4.38 120.40 126.84 2bze s VAL 406 Ca 0.03 1.41 0.08 0.00 0.00 0.00 0.00 61.98 63.50 2bze s VAL 406 Cb -0.13 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 2bze s VAL 406 CO -0.13 -0.03 0.44 -0.72 0.00 0.00 0.00 175.10 174.66 2bze s TYR 407 N 2.56 2.75 -0.35 5.22 -0.85 -0.21 -4.86 117.35 121.61 2bze s TYR 407 Ca 0.58 -0.45 -0.17 0.00 -0.52 0.00 0.00 57.07 56.51 2bze s TYR 407 Cb -0.26 -2.22 -0.01 0.00 0.38 0.00 0.00 41.96 39.84 2bze s TYR 407 CO 0.22 -0.20 0.45 -1.14 -1.52 0.00 0.00 175.55 173.35 2bze s GLN 408 N -4.20 3.60 0.26 -3.49 -0.44 -1.26 -3.53 119.66 110.60 2bze s GLN 408 Ca 0.50 -0.27 0.02 0.00 -2.50 0.00 0.00 55.36 53.12 2bze s GLN 408 Cb -0.05 -3.80 -0.05 0.00 -1.64 0.00 0.00 33.01 27.46 2bze s GLN 408 CO 0.29 -0.59 0.06 -1.17 0.50 0.00 0.00 175.29 174.39 2bze s LEU 409 N 2.23 1.91 0.04 3.68 2.96 -1.24 -4.94 118.68 123.32 2bze s LEU 409 Ca 0.16 -1.33 -0.35 0.00 -0.22 0.00 0.00 54.13 52.38 2bze s LEU 409 Cb -0.16 -0.13 -0.18 0.00 0.50 0.00 0.00 46.19 46.22 2bze s LEU 409 CO 0.12 -0.64 0.90 0.61 -1.32 0.00 0.00 176.35 176.02 2bze n GLY 410 N -0.48 -0.57 3.55 7.98 0.00 -1.26 -3.51 105.19 110.90 2bze n GLY 410 Ca -0.02 0.63 -0.15 0.00 0.00 0.00 0.00 46.02 46.48 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 1.52 -0.22 3.03 -0.02 0.00 -1.26 -4.81 105.19 103.43 2bze n GLY 411 Ca 0.18 0.26 -0.11 0.00 0.00 0.00 0.00 46.02 46.35 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 12.08 0.36 -0.26 2.61 -1.32 -1.23 -5.13 115.64 122.75 2bze s THR 412 Ca 1.00 -1.03 0.01 0.00 -1.21 0.00 0.00 61.69 60.47 2bze s THR 412 Cb -0.27 -0.49 0.07 0.00 -1.51 0.00 0.00 72.50 70.30 2bze s THR 412 CO 0.17 -0.44 -0.04 -0.13 -2.21 0.00 0.00 174.62 171.97 2bze s ARG 413 N -1.59 1.66 -0.01 7.08 3.00 -1.26 -3.60 118.95 124.23 2bze s ARG 413 Ca -0.12 -1.17 0.01 0.00 0.00 0.00 0.00 55.73 54.45 2bze s ARG 413 Cb -0.10 -2.68 -0.00 0.00 0.00 0.00 0.00 34.95 32.17 2bze s ARG 413 CO -0.00 -0.66 -0.04 -0.08 0.00 0.00 0.00 175.30 174.51 2bze s THR 414 N 1.30 0.35 -0.87 0.02 -1.32 -1.23 -4.92 115.64 108.97 2bze s THR 414 Ca -0.03 -0.18 -0.01 0.00 -1.21 0.00 0.00 61.69 60.26 2bze s THR 414 Cb -0.19 -0.31 0.35 0.00 -1.51 0.00 0.00 72.50 70.84 2bze s THR 414 CO -0.07 0.11 1.90 -0.46 -2.21 0.00 0.00 174.62 173.88 2bze n ASN 415 N 3.05 7.27 -4.06 8.08 6.94 -1.26 -1.05 115.26 134.23 2bze n ASN 415 Ca -0.14 -3.79 -0.09 0.00 -0.02 0.00 0.00 54.58 50.54 2bze n ASN 415 Cb 0.58 -1.05 -0.09 0.00 -2.36 0.00 0.00 39.78 36.86 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 -4.11 0.88 0.13 -3.83 0.00 -1.26 -0.13 119.74 111.42 2bze s LYS 416 Ca 0.48 -1.28 -0.10 0.00 0.00 0.00 0.00 55.97 55.07 2bze s LYS 416 Cb 0.37 0.27 0.00 0.00 0.00 0.00 0.00 37.83 38.47 2bze s LYS 416 CO -0.32 -0.26 0.26 0.20 0.00 0.00 0.00 175.35 175.24 2bze s GLY 417 N -2.98 0.19 0.34 0.59 0.00 0.53 -4.55 107.32 101.44 2bze s GLY 417 Ca 0.16 -0.64 -0.10 0.00 0.00 0.00 0.00 44.72 44.15 2bze s GLY 417 CO -0.03 -0.74 0.68 1.08 0.00 0.00 0.00 173.10 174.10 2bze s LEU 418 N -2.89 3.96 -0.52 0.66 2.01 -1.03 0.70 118.68 121.58 2bze s LEU 418 Ca 0.09 1.02 -0.24 0.00 0.01 0.00 0.00 54.13 55.01 2bze s LEU 418 Cb 0.04 -3.86 0.04 0.00 0.01 0.00 0.00 46.19 42.42 2bze s LEU 418 CO -0.07 -0.28 0.88 -1.58 1.01 0.00 0.00 176.35 176.31 2bze s GLN 419 N -3.53 3.35 -0.05 1.70 2.00 -0.86 -2.39 119.66 119.88 2bze s GLN 419 Ca 0.49 -0.24 -0.15 0.00 -2.00 0.00 0.00 55.36 53.46 2bze s GLN 419 Cb -0.10 -4.02 -0.05 0.00 0.80 0.00 0.00 33.01 29.63 2bze s GLN 419 CO 0.28 -1.36 0.40 -0.51 -0.50 0.00 0.00 175.29 173.60 2bze s LEU 420 N 3.68 4.40 -0.05 3.68 1.43 0.73 -0.13 118.68 132.42 2bze s LEU 420 Ca 0.30 0.86 0.01 0.00 -1.03 0.00 0.00 54.13 54.26 2bze s LEU 420 Cb -0.13 -2.57 0.02 0.00 0.03 0.00 0.00 46.19 43.55 2bze s LEU 420 CO 0.20 0.23 -0.03 -0.60 0.23 0.00 0.00 176.35 176.38 2bze s ARG 421 N -0.52 0.73 -0.46 1.70 3.52 -0.41 -1.08 118.95 122.43 2bze s ARG 421 Ca 0.23 -0.05 -0.02 0.00 -0.13 0.00 0.00 55.73 55.76 2bze s ARG 421 Cb -0.16 -0.82 0.12 0.00 -1.56 0.00 0.00 34.95 32.53 2bze s ARG 421 CO 0.11 -0.13 0.25 -1.58 -0.81 0.00 0.00 175.30 173.14 2bze s HIS 422 N 1.11 3.54 0.00 5.12 5.65 -0.96 -0.72 115.29 129.03 2bze s HIS 422 Ca -0.08 -2.59 0.00 0.00 0.25 0.00 0.00 55.06 52.64 2bze s HIS 422 Cb -0.14 -3.17 0.00 0.00 -1.18 0.00 0.00 32.58 28.09 2bze s HIS 422 CO -0.01 -0.93 0.00 0.41 -0.65 0.00 0.00 174.74 173.56 2bze n GLY 423 N 4.22 3.31 3.02 1.59 0.00 -1.26 -2.67 105.19 113.39 2bze n GLY 423 Ca 0.01 -0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 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 5.32 -0.16 1.61 0.01 -1.26 -4.87 114.94 111.59 2bze s ASN 424 Ca 0.00 -3.56 -0.05 0.00 -0.71 0.00 0.00 52.86 48.55 2bze s ASN 424 Cb 0.00 -1.78 0.06 0.00 0.41 0.00 0.00 41.25 39.93 2bze s ASN 424 CO 0.00 -0.18 0.08 -0.62 -1.51 0.00 0.00 177.10 174.87 2bze s ASP 425 N -0.46 2.28 -0.35 -1.22 3.68 -1.09 -5.04 116.67 114.47 2bze s ASP 425 Ca 0.24 -0.57 -0.09 0.00 2.13 0.00 0.00 52.55 54.27 2bze s ASP 425 Cb -0.10 -0.26 0.03 0.00 -1.45 0.00 0.00 42.92 41.14 2bze s ASP 425 CO -0.11 -0.34 0.15 -1.58 0.13 0.00 0.00 175.17 173.42 2bze s GLN 426 N 2.12 2.78 0.13 4.34 0.74 -1.26 -2.26 119.66 126.24 2bze s GLN 426 Ca 0.02 -1.09 0.00 0.00 0.05 0.00 0.00 55.36 54.34 2bze s GLN 426 Cb -0.16 -3.58 -0.04 0.00 1.10 0.00 0.00 33.01 30.33 2bze s GLN 426 CO -0.08 -0.65 0.01 1.03 -0.55 0.00 0.00 175.29 175.04 2bze s ARG 427 N 1.49 0.94 -0.22 1.67 0.52 -0.24 -5.01 118.95 118.08 2bze s ARG 427 Ca 0.01 -1.43 -0.07 0.00 -0.52 0.00 0.00 55.73 53.71 2bze s ARG 427 Cb -0.19 -0.01 -0.03 0.00 0.52 0.00 0.00 34.95 35.23 2bze s ARG 427 CO 0.05 -0.16 0.07 0.08 0.02 0.00 0.00 175.30 175.35 2bze s VAL 428 N -3.83 4.47 -0.04 3.52 1.01 -1.26 -0.19 120.40 124.08 2bze s VAL 428 Ca 0.20 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 62.11 2bze s VAL 428 Cb 0.07 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.37 2bze s VAL 428 CO 0.00 0.38 -0.23 -0.36 0.00 0.00 0.00 175.10 174.89 2bze s PHE 429 N 1.18 2.22 0.56 5.22 0.08 -1.01 -4.93 117.98 121.30 2bze s PHE 429 Ca 0.04 -0.59 -0.10 0.00 0.12 0.00 0.00 56.93 56.41 2bze s PHE 429 Cb -0.14 -1.45 -0.04 0.00 -0.57 0.00 0.00 43.02 40.81 2bze s PHE 429 CO 0.03 -0.15 0.95 1.03 -0.10 0.00 0.00 175.22 176.98 2bze s ARG 430 N -0.25 3.63 0.57 0.44 0.52 -1.26 -2.45 118.95 120.15 2bze s ARG 430 Ca 0.00 0.62 0.26 0.00 -0.52 0.00 0.00 55.73 56.09 2bze s ARG 430 Cb -0.12 -2.18 1.66 0.00 0.52 0.00 0.00 34.95 34.83 2bze s ARG 430 CO 0.02 -0.42 2.21 -0.07 0.02 0.00 0.00 175.30 177.06 2bze h LEU 431 N 0.04 0.00 -1.57 2.53 3.38 -1.98 -1.56 115.31 116.14 2bze h LEU 431 Ca -0.45 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 2bze h LEU 431 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2bze h LEU 431 CO 0.62 0.00 -0.23 1.05 0.09 0.00 0.00 178.44 179.97 2bze h GLU 432 N 0.00 0.00 -0.01 1.13 4.11 -1.92 -2.75 114.58 115.14 2bze h GLU 432 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.45 2bze h GLU 432 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2bze h GLU 432 CO -0.00 0.23 -0.26 1.19 0.07 0.00 0.00 179.01 180.24 2bze n PHE 433 N -3.91 0.00 -2.71 2.06 3.72 -0.59 -4.78 117.46 111.26 2bze n PHE 433 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 2bze n PHE 433 Cb 0.31 -0.15 -0.03 0.00 -0.94 0.00 0.00 39.48 38.67 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 -2.56 4.63 0.38 -4.37 1.01 -1.04 -2.96 120.40 115.49 2bze s VAL 434 Ca 0.23 1.74 -0.23 0.00 0.00 0.00 0.00 61.98 63.72 2bze s VAL 434 Cb 0.19 -4.32 -0.10 0.00 0.00 0.00 0.00 36.38 32.14 2bze s VAL 434 CO 0.53 -0.32 0.95 -0.44 0.00 0.00 0.00 175.10 175.82 2bze s SER 435 N 1.48 7.12 0.00 3.32 0.01 0.14 -3.84 113.70 121.94 2bze s SER 435 Ca 0.42 1.75 0.27 0.00 1.31 0.00 0.00 55.95 59.71 2bze s SER 435 Cb -0.14 -2.56 0.98 0.00 0.21 0.00 0.00 66.02 64.51 2bze s SER 435 CO 0.11 -0.22 1.70 0.59 0.41 0.00 0.00 173.24 175.83 2bze n ASN 436 N -0.09 1.61 -4.79 2.44 3.02 -1.26 -4.24 115.26 111.95 2bze n ASN 436 Ca 0.05 -1.55 -0.34 0.00 -0.03 0.00 0.00 54.58 52.71 2bze n ASN 436 Cb 0.52 -0.01 -0.02 0.00 -0.61 0.00 0.00 39.78 39.66 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 -1.98 3.63 0.68 3.52 1.11 -1.26 -4.91 119.66 120.46 2bze s GLN 437 Ca 0.37 1.40 -0.10 0.00 0.01 0.00 0.00 55.36 57.04 2bze s GLN 437 Cb 0.21 -2.07 0.02 0.00 -1.01 0.00 0.00 33.01 30.16 2bze s GLN 437 CO 0.33 -0.58 1.06 -1.21 0.01 0.00 0.00 175.29 174.90 2bze s GLU 438 N -3.35 2.84 0.40 2.91 8.01 -1.26 -4.77 118.70 123.49 2bze s GLU 438 Ca 0.68 0.35 -0.10 0.00 0.01 0.00 0.00 54.97 55.92 2bze s GLU 438 Cb -0.18 -2.07 -0.06 0.00 -4.31 0.00 0.00 34.13 27.51 2bze s GLU 438 CO 0.24 -0.98 0.76 -0.06 0.01 0.00 0.00 175.26 175.22 2bze s PHE 439 N -3.29 3.48 0.31 1.61 0.40 -1.26 -5.09 117.98 114.14 2bze s PHE 439 Ca 0.57 1.01 0.03 0.00 -0.60 0.00 0.00 56.93 57.94 2bze s PHE 439 Cb -0.11 -2.41 -0.04 0.00 0.51 0.00 0.00 43.02 40.97 2bze s PHE 439 CO 0.50 -0.10 0.16 -0.08 0.70 0.00 0.00 175.22 176.40 2bze s THR 440 N -2.38 0.35 0.28 0.64 -1.32 -1.26 -4.86 115.64 107.10 2bze s THR 440 Ca 0.51 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.99 2bze s THR 440 Cb -0.10 -2.52 0.28 0.00 -1.51 0.00 0.00 72.50 68.65 2bze s THR 440 CO 0.32 0.00 1.86 1.05 -2.21 0.00 0.00 174.62 175.64 2bze h GLU 441 N 2.21 1.01 -0.69 7.08 4.11 -1.98 -0.76 114.58 125.56 2bze h GLU 441 Ca -0.34 -0.06 -0.07 0.00 0.07 0.00 0.00 59.36 58.96 2bze h GLU 441 Cb 1.25 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 30.24 2bze h GLU 441 CO 0.52 0.67 0.16 1.03 0.07 0.00 0.00 179.01 181.46 2bze h SER 442 N 1.04 1.04 -0.22 3.06 0.87 -1.99 -0.18 113.55 117.18 2bze h SER 442 Ca 0.47 -0.22 -0.08 0.00 -1.23 0.00 0.00 61.79 60.73 2bze h SER 442 Cb 0.39 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.07 2bze h SER 442 CO -0.23 1.01 -0.17 -0.33 -0.53 0.00 0.00 176.83 176.58 2bze h GLU 443 N 1.04 0.51 -0.60 2.24 4.39 -1.69 -2.23 114.58 118.24 2bze h GLU 443 Ca 0.22 -0.25 0.02 0.00 0.34 0.00 0.00 59.36 59.69 2bze h GLU 443 Cb 0.38 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 2bze h GLU 443 CO 0.00 0.81 0.37 0.35 -1.16 0.00 0.00 179.01 179.39 2bze h PHE 444 N 0.20 0.70 -0.15 4.33 3.04 -0.85 -1.76 116.94 122.45 2bze h PHE 444 Ca 0.04 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 61.96 2bze h PHE 444 Cb 0.70 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 2bze h PHE 444 CO 0.07 0.41 -0.15 0.52 -2.02 0.00 0.00 178.31 177.14 2bze h MET 445 N 0.74 0.24 -0.13 1.11 2.86 -0.87 0.21 114.93 119.09 2bze h MET 445 Ca 0.23 -0.06 -0.15 0.00 -2.06 0.00 0.00 59.70 57.67 2bze h MET 445 Cb -0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2bze h MET 445 CO -0.09 0.40 -0.55 -0.22 1.06 0.00 0.00 176.91 177.51 2bze h LYS 446 N 0.22 0.37 -0.04 1.72 1.63 -0.78 0.06 116.57 119.75 2bze h LYS 446 Ca 0.04 -0.23 -0.14 0.00 -0.85 0.00 0.00 60.65 59.47 2bze h LYS 446 Cb 0.41 0.03 0.01 0.00 -0.60 0.00 0.00 32.23 32.08 2bze h LYS 446 CO 0.03 0.82 -0.52 2.35 -3.45 0.00 0.00 179.45 178.68 2bze h TRP 447 N 0.29 0.59 -0.56 1.91 7.01 -0.68 -2.56 115.95 121.95 2bze h TRP 447 Ca 0.00 -0.30 0.10 0.00 2.11 0.00 0.00 58.89 60.81 2bze h TRP 447 Cb 1.05 -0.08 -0.08 0.00 -2.10 0.00 0.00 29.16 27.95 2bze h TRP 447 CO 0.03 1.09 0.08 -0.22 -2.79 0.00 0.00 178.44 176.64 2bze h LYS 448 N -0.07 0.21 -0.04 2.65 1.63 -0.45 0.24 116.57 120.74 2bze h LYS 448 Ca -0.05 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.68 2bze h LYS 448 Cb 1.21 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.78 2bze h LYS 448 CO 0.10 0.14 -0.21 1.05 -3.45 0.00 0.00 179.45 177.08 2bze h GLU 449 N 0.21 0.06 -0.04 1.90 4.11 -0.99 0.88 114.58 120.71 2bze h GLU 449 Ca 0.29 -0.02 -0.07 0.00 0.07 0.00 0.00 59.36 59.63 2bze h GLU 449 Cb 0.42 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2bze h GLU 449 CO -0.40 0.27 -0.24 0.00 0.07 0.00 0.00 179.01 178.71 2bze h ALA 450 N 1.73 0.09 -0.53 1.06 0.00 -0.65 -1.57 119.26 119.39 2bze h ALA 450 Ca 0.01 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 2bze h ALA 450 Cb 0.41 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2bze h ALA 450 CO 0.03 0.10 0.08 0.52 0.00 0.00 0.00 179.25 179.98 2bze h MET 451 N -0.31 0.87 -0.54 0.00 2.86 -0.39 0.65 114.93 118.07 2bze h MET 451 Ca -0.02 -0.24 -0.12 0.00 -2.06 0.00 0.00 59.70 57.27 2bze h MET 451 Cb 0.91 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.45 2bze h MET 451 CO 0.05 0.86 -0.13 0.35 1.06 0.00 0.00 176.91 179.10 2bze h PHE 452 N 0.76 1.16 -0.03 -0.22 3.57 -0.86 0.30 116.94 121.62 2bze h PHE 452 Ca 0.16 -0.25 -0.12 0.00 3.53 0.00 0.00 57.97 61.29 2bze h PHE 452 Cb 0.41 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 2bze h PHE 452 CO 0.03 1.08 -0.52 1.03 -2.23 0.00 0.00 178.31 177.70 2bze h SER 453 N 0.91 0.08 1.32 0.41 0.87 -1.06 -2.54 113.55 113.53 2bze h SER 453 Ca 0.14 -0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.57 2bze h SER 453 Cb 0.71 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 2bze h SER 453 CO 0.05 0.59 -0.42 0.00 -0.53 0.00 0.00 176.83 176.52 2bze h ALA 454 N 1.42 0.79 0.00 6.23 0.00 -0.32 -3.47 119.26 123.91 2bze h ALA 454 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2bze h ALA 454 Cb 0.94 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2bze h ALA 454 CO 0.07 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.26 2bze n GLY 455 N 0.89 0.69 3.86 0.00 0.00 0.55 -4.93 105.19 106.25 2bze n GLY 455 Ca 0.01 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.64 3.94 0.05 1.61 -1.94 0.73 -4.98 119.30 118.07 2bze s MET 456 Ca 0.00 0.59 -0.27 0.00 -1.71 0.00 0.00 55.69 54.30 2bze s MET 456 Cb 0.00 -2.45 -0.05 0.00 2.01 0.00 0.00 34.83 34.34 2bze s MET 456 CO 0.00 0.15 0.83 -1.14 -0.01 0.00 0.00 175.02 174.85 2bze s GLN 457 N -3.08 4.55 0.25 2.03 0.74 -1.26 -4.39 119.66 118.50 2bze s GLN 457 Ca 0.53 1.18 -0.15 0.00 0.05 0.00 0.00 55.36 56.97 2bze s GLN 457 Cb -0.10 -3.39 -0.08 0.00 1.10 0.00 0.00 33.01 30.54 2bze s GLN 457 CO 0.20 0.21 0.67 -0.51 -0.55 0.00 0.00 175.29 175.31 2bze s LEU 458 N 0.15 4.20 0.60 3.68 1.02 -1.26 -5.03 118.68 122.04 2bze s LEU 458 Ca 0.42 1.22 -0.17 0.00 0.02 0.00 0.00 54.13 55.62 2bze s LEU 458 Cb -0.21 -3.76 -0.03 0.00 0.02 0.00 0.00 46.19 42.22 2bze s LEU 458 CO 0.25 -0.07 1.12 -2.16 0.02 0.00 0.00 176.35 175.50 2bze s PRO 459 N -2.53 3.06 0.49 1.29 0.04 -1.26 -4.75 135.00 131.34 2bze s PRO 459 Ca 0.47 1.48 -0.00 0.00 0.04 0.00 0.00 61.00 63.00 2bze s PRO 459 Cb -0.13 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.44 2bze s PRO 459 CO 0.19 -1.06 0.72 0.95 0.04 0.00 0.00 177.00 177.85 2bze s THR 460 N -2.09 3.70 -0.50 1.26 -4.23 -1.26 -0.95 115.64 111.58 2bze s THR 460 Ca 0.69 -0.46 0.22 0.00 -1.18 0.00 0.00 61.69 60.97 2bze s THR 460 Cb -0.22 -3.39 0.23 0.00 1.34 0.00 0.00 72.50 70.47 2bze s THR 460 CO 0.35 -0.29 1.68 0.18 -0.54 0.00 0.00 174.62 176.00 2bze n LEU 461 N -2.20 0.60 -0.00 4.79 7.99 -1.26 -1.02 117.00 125.90 2bze n LEU 461 Ca 0.03 0.66 -0.18 0.00 -0.01 0.00 0.00 56.01 56.51 2bze n LEU 461 Cb 0.58 -0.60 -0.08 0.00 -0.11 0.00 0.00 43.42 43.21 2bze n LEU 461 CO 0.48 -0.58 0.21 0.44 -1.51 0.00 0.00 177.39 176.43 2bze h ASP 462 N 0.00 0.91 -0.15 -1.43 5.19 -1.88 -2.03 116.42 117.03 2bze h ASP 462 Ca 0.00 -0.67 -0.08 0.00 -0.62 0.00 0.00 57.03 55.66 2bze h ASP 462 Cb 0.31 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 39.55 2bze h ASP 462 CO 0.00 1.45 -0.23 -0.33 -3.12 0.00 0.00 179.24 177.01 2bze h GLU 463 N 0.45 0.42 -0.55 3.56 4.39 -1.57 -2.49 114.58 118.79 2bze h GLU 463 Ca -0.08 -0.25 0.07 0.00 0.34 0.00 0.00 59.36 59.44 2bze h GLU 463 Cb 1.49 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 30.11 2bze h GLU 463 CO 0.17 0.84 0.23 0.82 -1.16 0.00 0.00 179.01 179.91 2bze h ILE 464 N 0.04 0.85 0.00 3.13 1.08 -1.12 0.18 117.51 121.67 2bze h ILE 464 Ca 0.01 -0.15 -0.06 0.00 -0.39 0.00 0.00 64.86 64.27 2bze h ILE 464 Cb 0.80 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 2bze h ILE 464 CO 0.05 0.08 -0.28 -1.13 -0.69 0.00 0.00 178.15 176.18 2bze h ASN 465 N 0.44 0.00 0.70 1.72 -0.73 -1.26 0.13 115.58 116.58 2bze h ASN 465 Ca 0.26 0.00 -0.26 0.00 1.87 0.00 0.00 56.30 58.17 2bze h ASN 465 Cb 0.26 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.83 2bze h ASN 465 CO -0.24 0.28 -1.28 0.11 -0.37 0.00 0.00 177.43 175.93 2bze h LYS 466 N 0.00 0.14 0.04 6.67 1.57 -0.77 -2.19 116.57 122.02 2bze h LYS 466 Ca -0.00 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2bze h LYS 466 Cb 0.56 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2bze h LYS 466 CO 0.04 1.03 -0.02 0.87 -0.57 0.00 0.00 179.45 180.80 2bze h LYS 467 N 0.04 -0.05 -0.37 3.15 1.79 0.00 -2.10 116.57 119.03 2bze h LYS 467 Ca -0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 2bze h LYS 467 Cb 1.92 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 32.56 2bze h LYS 467 CO 0.15 0.35 0.24 1.05 -1.08 0.00 0.00 179.45 180.16 2bze h GLU 468 N -0.45 0.48 -0.55 3.15 4.11 -0.88 0.22 114.58 120.66 2bze h GLU 468 Ca -0.01 -0.03 0.02 0.00 0.07 0.00 0.00 59.36 59.41 2bze h GLU 468 Cb 0.42 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 2bze h GLU 468 CO 0.01 0.32 0.35 1.25 0.07 0.00 0.00 179.01 181.00 2bze h LEU 469 N 0.50 0.58 -0.58 3.06 7.12 -1.28 0.11 115.31 124.82 2bze h LEU 469 Ca 0.13 -0.00 -0.14 0.00 0.13 0.00 0.00 57.88 58.00 2bze h LEU 469 Cb -0.06 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 39.94 2bze h LEU 469 CO -0.03 0.41 -0.43 0.28 -0.13 0.00 0.00 178.44 178.54 2bze h SER 470 N 0.69 0.70 -0.23 1.25 0.02 -0.39 -2.65 113.55 112.94 2bze h SER 470 Ca 0.22 -0.33 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 2bze h SER 470 Cb -0.02 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 2bze h SER 470 CO -0.08 1.03 0.08 0.40 -1.14 0.00 0.00 176.83 177.12 2bze h ILE 471 N 0.53 1.19 -0.45 3.27 1.08 -0.31 -0.31 117.51 122.51 2bze h ILE 471 Ca 0.04 -0.59 -0.07 0.00 -0.39 0.00 0.00 64.86 63.85 2bze h ILE 471 Cb 0.96 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.83 2bze h ILE 471 CO 0.09 0.19 -0.02 0.07 -0.69 0.00 0.00 178.15 177.79 2bze h LYS 472 N 0.21 0.74 0.00 2.37 2.10 -0.77 0.08 116.57 121.31 2bze h LYS 472 Ca 0.08 -0.20 -0.09 0.00 -2.00 0.00 0.00 60.65 58.43 2bze h LYS 472 Cb 0.22 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 31.45 2bze h LYS 472 CO -0.00 0.77 -0.43 0.93 -2.00 0.00 0.00 179.45 178.72 2bze h GLU 473 N 0.69 0.00 0.13 0.07 4.39 -1.26 -2.17 114.58 116.44 2bze h GLU 473 Ca 0.13 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.54 2bze h GLU 473 Cb 0.46 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2bze h GLU 473 CO 0.02 0.43 -1.38 0.00 -1.16 0.00 0.00 179.01 176.92 2bze h ALA 474 N 1.57 0.15 0.00 3.43 0.00 -0.41 -3.31 119.26 120.69 2bze h ALA 474 Ca -0.00 -0.98 -0.08 0.00 0.00 0.00 0.00 54.91 53.85 2bze h ALA 474 Cb 1.09 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2bze h ALA 474 CO 0.06 1.02 -0.49 1.37 0.00 0.00 0.00 179.25 181.21 2bze h LEU 475 N 0.08 0.00 0.00 0.00 8.10 -1.00 -3.50 115.31 118.98 2bze h LEU 475 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.80 2bze h LEU 475 Cb 2.01 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.23 2bze h LEU 475 CO 0.19 0.37 0.00 -3.20 -4.11 0.00 0.00 178.44 171.69