#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 3.17 3.05 3.03 0.00 -1.26 -4.96 105.19 108.21 2bze n GLY -20 Ca 0.00 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.72 2bze n GLY -20 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bze n SER -19 N 1.05 4.47 -0.01 1.61 7.64 -1.26 -4.19 113.62 122.94 2bze n SER -19 Ca 0.00 -2.92 0.00 0.00 1.01 0.00 0.00 58.87 56.97 2bze n SER -19 Cb 0.00 -1.65 0.00 0.00 -1.01 0.00 0.00 64.21 61.56 2bze n SER -19 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2bze n SER -18 N 6.34 1.18 -4.43 6.43 7.64 -1.26 -4.97 113.62 124.55 2bze n SER -18 Ca 0.48 -1.64 -0.44 0.00 1.01 0.00 0.00 58.87 58.28 2bze n SER -18 Cb 0.41 -0.02 -0.05 0.00 -1.01 0.00 0.00 64.21 63.54 2bze n SER -18 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2bze s HIS -17 N -0.65 2.89 0.07 1.43 0.09 -1.26 -5.02 115.29 112.84 2bze s HIS -17 Ca 0.01 -0.63 -0.26 0.00 -0.00 0.00 0.00 55.06 54.18 2bze s HIS -17 Cb 0.01 -3.99 -0.06 0.00 -0.00 0.00 0.00 32.58 28.54 2bze s HIS -17 CO 0.00 -1.35 0.83 -1.01 -0.00 0.00 0.00 174.74 173.21 2bze s HIS -16 N 3.23 3.76 0.16 1.40 4.02 -1.26 -5.01 115.29 121.59 2bze s HIS -16 Ca 0.18 1.58 -0.25 0.00 1.02 0.00 0.00 55.06 57.59 2bze s HIS -16 Cb -0.19 -2.89 0.06 0.00 -1.02 0.00 0.00 32.58 28.54 2bze s HIS -16 CO 0.10 0.26 0.97 -3.38 1.02 0.00 0.00 174.74 173.71 2bze s HIS -15 N -0.06 -0.11 -0.19 1.40 0.00 -1.26 -5.14 115.29 109.94 2bze s HIS -15 Ca 0.41 -0.21 0.01 0.00 -3.00 0.00 0.00 55.06 52.27 2bze s HIS -15 Cb -0.21 0.65 0.03 0.00 -4.00 0.00 0.00 32.58 29.05 2bze s HIS -15 CO 0.25 -0.85 -0.13 -3.38 -1.00 0.00 0.00 174.74 169.63 2bze s HIS -14 N -3.18 2.45 0.23 0.38 -0.00 -1.26 -4.96 115.29 108.95 2bze s HIS -14 Ca 0.13 -1.54 0.09 0.00 -0.00 0.00 0.00 55.06 53.74 2bze s HIS -14 Cb -0.01 -1.69 0.19 0.00 -0.00 0.00 0.00 32.58 31.07 2bze s HIS -14 CO 0.03 -0.74 1.52 1.25 -0.00 0.00 0.00 174.74 176.79 2bze h HIS -13 N 7.98 0.01 -3.94 0.38 -0.00 -2.02 -3.44 115.15 114.12 2bze h HIS -13 Ca -0.33 -0.00 -0.26 0.00 -0.00 0.00 0.00 60.37 59.78 2bze h HIS -13 Cb 1.11 -0.00 -0.23 0.00 -0.00 0.00 0.00 27.41 28.29 2bze h HIS -13 CO 0.50 0.73 -0.73 -1.01 -0.00 0.00 0.00 177.93 177.42 2bze s HIS -12 N -3.36 0.49 -0.75 5.26 0.09 -1.26 -5.08 115.29 110.68 2bze s HIS -12 Ca -0.01 -0.38 -0.25 0.00 -0.00 0.00 0.00 55.06 54.43 2bze s HIS -12 Cb 0.12 -0.30 0.05 0.00 -0.00 0.00 0.00 32.58 32.44 2bze s HIS -12 CO 0.78 -0.08 1.19 -1.12 -0.00 0.00 0.00 174.74 175.51 2bze s SER -11 N -1.12 6.22 0.56 1.40 0.01 -1.26 -4.99 113.70 114.52 2bze s SER -11 Ca -0.08 -0.80 0.08 0.00 1.31 0.00 0.00 55.95 56.47 2bze s SER -11 Cb -0.07 -2.51 0.07 0.00 0.21 0.00 0.00 66.02 63.71 2bze s SER -11 CO -0.00 -1.65 0.66 -0.44 0.41 0.00 0.00 173.24 172.22 2bze s SER -10 N 3.85 4.98 0.59 2.44 0.01 -1.26 -4.92 113.70 119.39 2bze s SER -10 Ca 0.32 -0.95 0.00 0.00 1.31 0.00 0.00 55.95 56.63 2bze s SER -10 Cb -0.10 0.28 0.00 0.00 0.21 0.00 0.00 66.02 66.41 2bze s SER -10 CO 0.10 -1.23 0.00 0.61 0.41 0.00 0.00 173.24 173.12 2bze n GLY -9 N -2.07 0.55 3.23 3.44 0.00 -1.26 -4.58 105.19 104.49 2bze n GLY -9 Ca 0.10 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 2bze n GLY -9 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bze s LEU -8 N 0.00 2.52 -0.15 0.99 1.43 -1.26 -5.07 118.68 117.14 2bze s LEU -8 Ca 0.00 -0.51 -0.29 0.00 -1.03 0.00 0.00 54.13 52.30 2bze s LEU -8 Cb 0.00 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 2bze s LEU -8 CO 0.00 0.00 1.62 -0.69 0.23 0.00 0.00 176.35 177.52 2bze s VAL -7 N 1.30 3.67 0.73 -1.59 1.01 -1.26 -4.98 120.40 119.28 2bze s VAL -7 Ca 0.04 0.78 -0.11 0.00 0.00 0.00 0.00 61.98 62.69 2bze s VAL -7 Cb -0.14 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.66 2bze s VAL -7 CO -0.07 -0.18 1.08 -2.16 0.00 0.00 0.00 175.10 173.77 2bze s PRO -6 N 4.39 2.63 0.44 2.72 0.04 -1.26 -4.94 135.00 139.01 2bze s PRO -6 Ca 0.72 0.71 0.12 0.00 0.04 0.00 0.00 61.00 62.59 2bze s PRO -6 Cb -0.28 -1.97 1.01 0.00 0.04 0.00 0.00 34.50 33.29 2bze s PRO -6 CO 0.28 -1.26 2.01 0.00 0.04 0.00 0.00 177.00 178.08 2bze h ARG -5 N -0.82 0.40 0.00 4.56 3.08 -1.93 -0.41 114.38 119.25 2bze h ARG -5 Ca -0.45 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.57 2bze h ARG -5 Cb 1.24 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.20 2bze h ARG -5 CO 0.60 0.26 0.00 0.41 -1.07 0.00 0.00 179.97 180.17 2bze n GLY -4 N -1.51 -1.01 1.07 0.04 0.00 -1.26 -1.79 105.19 100.73 2bze n GLY -4 Ca 0.07 -0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.07 2bze n GLY -4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2bze n SER -3 N -1.17 3.19 -4.22 1.61 2.88 -0.16 -4.79 113.62 110.95 2bze n SER -3 Ca 0.15 -1.95 -0.21 0.00 -1.33 0.00 0.00 58.87 55.52 2bze n SER -3 Cb 0.16 -0.25 -0.12 0.00 -0.75 0.00 0.00 64.21 63.24 2bze n SER -3 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2bze s HIS -2 N -1.49 1.50 0.25 0.66 3.76 -0.74 -5.00 115.29 114.23 2bze s HIS -2 Ca 0.38 -0.43 0.07 0.00 -0.15 0.00 0.00 55.06 54.94 2bze s HIS -2 Cb 0.22 -0.84 -0.04 0.00 1.11 0.00 0.00 32.58 33.03 2bze s HIS -2 CO 0.31 0.12 0.21 -1.64 -0.85 0.00 0.00 174.74 172.89 2bze s MET -1 N -1.72 2.97 -0.07 1.40 1.00 -1.26 -1.14 119.30 120.48 2bze s MET -1 Ca 0.03 -1.03 -0.30 0.00 0.00 0.00 0.00 55.69 54.39 2bze s MET -1 Cb -0.10 -2.59 -0.04 0.00 0.00 0.00 0.00 34.83 32.10 2bze s MET -1 CO 0.03 0.40 1.50 0.54 0.00 0.00 0.00 175.02 177.49 2bze s VAL 345 N -2.12 3.78 0.00 -6.03 0.11 -0.17 -4.69 120.40 111.28 2bze s VAL 345 Ca 0.33 1.00 0.00 0.00 -2.93 0.00 0.00 61.98 60.38 2bze s VAL 345 Cb -0.08 -3.64 0.00 0.00 -1.53 0.00 0.00 36.38 31.13 2bze s VAL 345 CO 0.25 -0.07 0.20 -1.20 -3.33 0.00 0.00 175.10 170.95 2bze n SER 346 N 6.60 0.39 -4.24 3.54 7.64 -1.26 -4.87 113.62 121.43 2bze n SER 346 Ca 0.15 -0.74 -0.27 0.00 1.01 0.00 0.00 58.87 59.03 2bze n SER 346 Cb 0.43 0.24 -0.15 0.00 -1.01 0.00 0.00 64.21 63.73 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 -0.49 2.08 0.55 -3.43 1.02 -1.26 -5.01 118.68 112.14 2bze s LEU 347 Ca 0.00 -0.43 0.26 0.00 0.02 0.00 0.00 54.13 53.98 2bze s LEU 347 Cb 0.00 -1.07 1.46 0.00 0.02 0.00 0.00 46.19 46.59 2bze s LEU 347 CO 0.00 0.24 2.01 -0.65 0.02 0.00 0.00 176.35 177.97 2bze h PRO 348 N 5.39 0.00 -0.60 1.29 0.11 -1.93 -1.92 132.00 134.34 2bze h PRO 348 Ca -0.41 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.64 2bze h PRO 348 Cb 1.14 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2bze h PRO 348 CO 0.47 0.00 0.12 1.05 -0.21 0.00 0.00 178.00 179.43 2bze h GLU 349 N 0.00 0.95 -0.17 1.05 4.11 -1.95 0.38 114.58 118.95 2bze h GLU 349 Ca 0.20 -0.22 -0.22 0.00 0.07 0.00 0.00 59.36 59.19 2bze h GLU 349 Cb 0.87 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.00 2bze h GLU 349 CO -0.00 0.87 -0.74 0.93 0.07 0.00 0.00 179.01 180.13 2bze h GLU 350 N 0.91 0.81 0.00 1.06 5.08 -1.78 -1.36 114.58 119.30 2bze h GLU 350 Ca 0.19 -0.64 -0.07 0.00 -1.00 0.00 0.00 59.36 57.84 2bze h GLU 350 Cb 0.36 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2bze h GLU 350 CO 0.00 1.25 -0.32 1.25 -1.00 0.00 0.00 179.01 180.19 2bze h LEU 351 N 0.56 0.00 -0.12 1.33 5.85 -1.23 -2.86 115.31 118.85 2bze h LEU 351 Ca -0.04 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 2bze h LEU 351 Cb 1.37 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.39 2bze h LEU 351 CO 0.16 0.32 -0.28 0.78 -0.34 0.00 0.00 178.44 179.07 2bze h ASN 352 N 0.00 0.00 0.50 1.25 2.35 0.05 0.14 115.58 119.87 2bze h ASN 352 Ca -0.00 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.53 2bze h ASN 352 Cb 1.12 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.48 2bze h ASN 352 CO 0.04 0.28 -0.95 0.08 -1.65 0.00 0.00 177.43 175.23 2bze h ARG 353 N 0.00 0.29 -0.01 0.81 0.11 -1.07 -2.96 114.38 111.55 2bze h ARG 353 Ca -0.00 -0.33 0.00 0.00 0.10 0.00 0.00 59.98 59.74 2bze h ARG 353 Cb 1.18 0.10 0.00 0.00 1.11 0.00 0.00 29.97 32.36 2bze h ARG 353 CO 0.04 1.05 -0.02 1.33 0.10 0.00 0.00 179.97 182.46 2bze n VAL 354 N -3.67 0.00 -2.23 0.08 0.24 -1.10 -4.75 118.33 106.91 2bze n VAL 354 Ca -0.05 -0.15 -0.40 0.00 -2.04 0.00 0.00 64.34 61.70 2bze n VAL 354 Cb 0.85 0.13 -0.02 0.00 -1.47 0.00 0.00 33.84 33.32 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 -2.07 4.29 0.17 7.34 6.06 0.02 -2.59 118.95 132.18 2bze s ARG 355 Ca 0.39 2.03 0.10 0.00 -2.50 0.00 0.00 55.73 55.75 2bze s ARG 355 Cb 0.21 -2.96 -0.04 0.00 0.06 0.00 0.00 34.95 32.22 2bze s ARG 355 CO 0.37 -0.17 -0.21 -0.51 -2.50 0.00 0.00 175.30 172.27 2bze s LEU 356 N -1.97 2.42 0.35 -0.88 1.43 -0.07 -4.92 118.68 115.03 2bze s LEU 356 Ca 0.51 -0.84 0.08 0.00 -1.03 0.00 0.00 54.13 52.85 2bze s LEU 356 Cb -0.36 -1.00 -0.07 0.00 0.03 0.00 0.00 46.19 44.80 2bze s LEU 356 CO 0.46 0.05 -0.06 -0.44 0.23 0.00 0.00 176.35 176.60 2bze s SER 357 N -2.57 3.56 0.45 2.29 0.01 -1.26 -4.00 113.70 112.19 2bze s SER 357 Ca 0.17 -1.25 0.22 0.00 1.31 0.00 0.00 55.95 56.40 2bze s SER 357 Cb -0.07 -0.32 1.09 0.00 0.21 0.00 0.00 66.02 66.92 2bze s SER 357 CO 0.08 -0.30 1.93 0.08 0.41 0.00 0.00 173.24 175.44 2bze h ARG 358 N 2.00 0.00 -0.24 12.44 0.11 -1.79 -0.59 114.38 126.32 2bze h ARG 358 Ca -0.42 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.62 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 0.72 0.23 -0.01 1.25 0.10 0.00 0.00 179.97 182.27 2bze h HIS 359 N 0.00 0.36 0.23 4.08 2.76 -1.93 0.20 115.15 120.85 2bze h HIS 359 Ca -0.00 -0.02 -0.33 0.00 -2.20 0.00 0.00 60.37 57.82 2bze h HIS 359 Cb 0.54 -0.11 0.03 0.00 1.55 0.00 0.00 27.41 29.42 2bze h HIS 359 CO 0.00 0.37 -1.44 0.87 -1.30 0.00 0.00 177.93 176.43 2bze h LYS 360 N 0.34 0.49 -0.66 5.26 1.57 -1.54 -2.61 116.57 119.42 2bze h LYS 360 Ca 0.08 -0.84 -0.06 0.00 -1.87 0.00 0.00 60.65 57.95 2bze h LYS 360 Cb 0.24 0.31 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2bze h LYS 360 CO 0.01 1.40 0.16 -0.07 -0.57 0.00 0.00 179.45 180.38 2bze h LEU 361 N 0.13 0.99 -0.52 2.94 3.38 -0.92 -1.06 115.31 120.25 2bze h LEU 361 Ca -0.24 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2bze h LEU 361 Cb 2.14 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 2bze h LEU 361 CO 0.26 0.95 0.33 -0.08 0.09 0.00 0.00 178.44 179.99 2bze h GLU 362 N 1.00 0.69 0.00 1.13 4.22 -0.63 0.15 114.58 121.15 2bze h GLU 362 Ca 0.21 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.60 2bze h GLU 362 Cb 0.35 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2bze h GLU 362 CO 0.00 0.48 0.00 2.89 -2.18 0.00 0.00 179.01 180.20 2bze n ARG 363 N -4.70 0.27 0.00 1.92 -4.01 -0.91 -2.18 116.66 107.06 2bze n ARG 363 Ca 0.03 0.02 0.08 0.00 -1.04 0.00 0.00 57.85 56.93 2bze n ARG 363 Cb 0.04 -1.50 -0.04 0.00 -3.04 0.00 0.00 32.46 27.92 2bze n ARG 363 CO 0.00 0.00 0.00 0.91 -3.04 0.00 0.00 177.63 175.50 2bze n TRP 364 N -1.36 0.00 0.17 2.89 8.01 -0.45 -4.47 117.44 122.23 2bze n TRP 364 Ca 0.11 0.00 0.04 0.00 -1.31 0.00 0.00 57.50 56.35 2bze n TRP 364 Cb 0.26 0.00 0.23 0.00 -2.01 0.00 0.00 31.31 29.80 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 -3.96 0.00 2.07 -1.79 -3.46 115.15 108.01 2bze h HIS 366 Ca -0.00 0.00 -0.45 0.00 -2.85 0.00 0.00 60.37 57.07 2bze h HIS 366 Cb 1.07 0.00 0.15 0.00 2.57 0.00 0.00 27.41 31.20 2bze h HIS 366 CO 0.00 0.00 0.23 -1.64 -3.07 0.00 0.00 177.93 173.45 2bze s MET 367 N -3.22 0.42 0.00 5.12 1.00 -0.85 -5.07 119.30 116.70 2bze s MET 367 Ca 0.05 0.29 0.00 0.00 0.00 0.00 0.00 55.69 56.03 2bze s MET 367 Cb 0.11 -1.76 0.00 0.00 0.00 0.00 0.00 34.83 33.18 2bze s MET 367 CO 0.72 -2.69 0.00 -2.30 0.00 0.00 0.00 175.02 170.75 2bze n PRO 368 N -4.10 0.11 -0.69 2.03 -0.02 -1.26 -4.71 135.00 126.36 2bze n PRO 368 Ca 0.07 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.16 2bze n PRO 368 Cb 0.58 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.95 2bze n PRO 368 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2bze n PHE 369 N -1.81 0.16 0.32 6.00 -1.74 -1.26 -4.63 117.46 114.50 2bze n PHE 369 Ca 0.00 -0.44 0.14 0.00 -0.56 0.00 0.00 57.45 56.59 2bze n PHE 369 Cb 0.00 -1.07 0.63 0.00 1.52 0.00 0.00 39.48 40.56 2bze n PHE 369 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 2bze h PHE 370 N 10.28 0.00 -0.10 2.97 -0.00 -1.84 -2.78 116.94 125.47 2bze h PHE 370 Ca 0.21 0.00 0.03 0.00 -0.00 0.00 0.00 57.97 58.21 2bze h PHE 370 Cb 0.75 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.70 2bze h PHE 370 CO 1.00 0.00 0.11 0.00 -0.00 0.00 0.00 178.31 179.42 2bze h ALA 371 N 2.12 1.69 -0.01 12.09 0.00 -1.94 0.10 119.26 133.31 2bze h ALA 371 Ca 0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2bze h ALA 371 Cb 0.31 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2bze h ALA 371 CO 0.00 -0.15 -0.60 -0.22 0.00 0.00 0.00 179.25 178.28 2bze h LYS 372 N 0.00 0.43 -0.51 0.00 1.63 -1.87 -2.65 116.57 113.60 2bze h LYS 372 Ca 0.05 -0.44 -0.08 0.00 -0.85 0.00 0.00 60.65 59.32 2bze h LYS 372 Cb 0.26 0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.99 2bze h LYS 372 CO -0.00 1.10 0.00 1.15 -3.45 0.00 0.00 179.45 178.25 2bze h THR 373 N -0.07 1.25 0.00 1.00 2.02 -1.30 -2.52 112.91 113.28 2bze h THR 373 Ca -0.07 -1.04 -0.12 0.00 0.77 0.00 0.00 66.41 65.95 2bze h THR 373 Cb 1.30 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 68.55 2bze h THR 373 CO 0.12 0.37 -0.58 -0.37 0.37 0.00 0.00 175.52 175.43 2bze h VAL 374 N 0.79 1.13 -2.42 3.16 -1.51 -0.94 -3.41 116.25 113.05 2bze h VAL 374 Ca 0.15 -2.22 -0.56 0.00 -1.23 0.00 0.00 66.70 62.84 2bze h VAL 374 Cb 0.48 2.30 -0.00 0.00 -2.13 0.00 0.00 31.29 31.94 2bze h VAL 374 CO 0.02 0.57 1.26 -0.89 -1.23 0.00 0.00 177.57 177.30 2bze s THR 375 N -3.22 3.29 0.00 7.19 2.01 -0.95 -0.64 115.64 123.31 2bze s THR 375 Ca 0.01 0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.34 2bze s THR 375 Cb 0.10 -3.28 0.00 0.00 0.01 0.00 0.00 72.50 69.33 2bze s THR 375 CO 0.74 -0.11 0.00 0.61 -0.69 0.00 0.00 174.62 175.17 2bze n GLY 376 N 4.89 1.31 3.94 4.40 0.00 -0.68 -4.98 105.19 114.07 2bze n GLY 376 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.59 2.27 0.10 0.00 0.08141.54 -0.55 117.98 258.82 2bze s PHE 378 Ca 0.47 -0.36 0.03 0.00 0.12 0.00 0.00 56.93 57.18 2bze s PHE 378 Cb -0.10 -1.12 -0.04 0.00 -0.57 0.00 0.00 43.02 41.19 2bze s PHE 378 CO 0.40 0.50 -0.08 0.54 -0.10 0.00 0.00 175.22 176.47 2bze s VAL 379 N -1.74 0.83 -0.51 -0.44 0.11 0.46 -0.89 120.40 118.23 2bze s VAL 379 Ca 0.21 -1.78 -0.21 0.00 -2.93 0.00 0.00 61.98 57.27 2bze s VAL 379 Cb -0.08 -1.50 0.04 0.00 -1.53 0.00 0.00 36.38 33.32 2bze s VAL 379 CO 0.10 -0.70 0.74 -0.60 -3.33 0.00 0.00 175.10 171.31 2bze s ARG 380 N -3.26 3.23 -0.05 1.54 6.06 -1.26 -2.07 118.95 123.14 2bze s ARG 380 Ca 0.08 -0.55 0.07 0.00 -2.50 0.00 0.00 55.73 52.83 2bze s ARG 380 Cb 0.01 -4.05 -0.01 0.00 0.06 0.00 0.00 34.95 30.95 2bze s ARG 380 CO -0.02 -1.27 -0.25 -1.50 -2.50 0.00 0.00 175.30 169.76 2bze s ILE 381 N 3.14 2.07 -0.25 4.11 1.10 -1.07 -0.94 121.20 129.36 2bze s ILE 381 Ca 0.22 -1.07 -0.04 0.00 -0.51 0.00 0.00 60.65 59.25 2bze s ILE 381 Cb -0.16 -1.74 0.00 0.00 0.15 0.00 0.00 42.46 40.72 2bze s ILE 381 CO 0.16 0.57 -0.00 -0.83 -2.11 0.00 0.00 174.94 172.73 2bze s GLY 382 N -0.28 1.68 -1.27 1.50 0.00 -1.25 -0.17 107.32 107.53 2bze s GLY 382 Ca -0.00 -1.33 -0.16 0.00 0.00 0.00 0.00 44.72 43.23 2bze s GLY 382 CO 0.02 0.53 1.64 0.29 0.00 0.00 0.00 173.10 175.58 2bze n ILE 383 N 4.79 4.06 -3.61 0.90 -5.35 0.66 -4.76 119.36 116.05 2bze n ILE 383 Ca -0.16 -4.32 0.00 0.00 -0.27 0.00 0.00 62.75 57.99 2bze n ILE 383 Cb 0.49 -2.41 0.00 0.00 -1.74 0.00 0.00 39.64 35.98 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 4.74 2.68 2.47 3.28 0.00 -1.26 -3.67 105.19 113.43 2bze n GLY 384 Ca 0.44 -0.32 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 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 0.63 2.51 -0.32 1.61 6.94 -1.26 -2.26 115.26 123.10 2bze n ASN 385 Ca 0.00 -3.25 0.03 0.00 -0.02 0.00 0.00 54.58 51.34 2bze n ASN 385 Cb 0.00 -0.62 0.22 0.00 -2.36 0.00 0.00 39.78 37.02 2bze n ASN 385 CO 0.00 0.00 0.00 -0.74 -1.03 0.00 0.00 177.26 175.49 2bze h HIS 386 N 3.49 1.09 0.00 -2.53 2.76 -1.74 -3.25 115.15 114.97 2bze h HIS 386 Ca 0.13 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 2bze h HIS 386 Cb 0.74 -0.36 0.00 0.00 1.55 0.00 0.00 27.41 29.33 2bze h HIS 386 CO 0.62 0.58 0.00 -1.71 -1.30 0.00 0.00 177.93 176.12 2bze n ASN 387 N -4.48 0.00 0.00 3.26 2.85 -1.26 -5.02 115.26 110.61 2bze n ASN 387 Ca 0.14 0.33 0.00 0.00 -0.11 0.00 0.00 54.58 54.94 2bze n ASN 387 Cb 0.17 -0.48 0.00 0.00 1.24 0.00 0.00 39.78 40.71 2bze n ASN 387 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2bze n SER 388 N -2.10 0.00 -4.90 1.20 2.88 -1.23 -5.11 113.62 104.36 2bze n SER 388 Ca 0.00 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.26 2bze n SER 388 Cb 0.00 0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.49 2bze n SER 388 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2bze s LYS 389 N -1.46 3.59 0.01 -1.46 0.00 -1.26 -4.79 119.74 114.37 2bze s LYS 389 Ca 0.00 0.26 -0.30 0.00 0.00 0.00 0.00 55.97 55.94 2bze s LYS 389 Cb 0.00 -2.37 -0.08 0.00 0.00 0.00 0.00 37.83 35.37 2bze s LYS 389 CO 0.00 -0.18 1.91 -2.14 0.00 0.00 0.00 175.35 174.95 2bze s PRO 390 N -4.56 4.12 -0.69 1.78 0.02 -1.25 -4.25 135.00 130.17 2bze s PRO 390 Ca 0.48 2.51 -0.25 0.00 0.02 0.00 0.00 61.00 63.77 2bze s PRO 390 Cb -0.10 -4.13 0.05 0.00 0.02 0.00 0.00 34.50 30.33 2bze s PRO 390 CO 0.42 -0.96 1.11 0.08 -0.33 0.00 0.00 177.00 177.32 2bze s VAL 391 N 4.48 4.04 0.06 3.83 1.01 -0.96 -4.86 120.40 128.00 2bze s VAL 391 Ca 0.86 0.02 -0.25 0.00 0.00 0.00 0.00 61.98 62.61 2bze s VAL 391 Cb -0.41 -4.79 -0.06 0.00 0.00 0.00 0.00 36.38 31.12 2bze s VAL 391 CO 0.39 -1.64 0.75 -0.31 0.00 0.00 0.00 175.10 174.29 2bze s TYR 392 N 4.85 3.76 0.13 5.22 2.02 -1.26 -0.25 117.35 131.83 2bze s TYR 392 Ca 0.28 1.48 0.04 0.00 -0.37 0.00 0.00 57.07 58.50 2bze s TYR 392 Cb -0.13 -2.79 -0.04 0.00 -0.40 0.00 0.00 41.96 38.60 2bze s TYR 392 CO 0.13 0.33 -0.09 1.03 -1.57 0.00 0.00 175.55 175.38 2bze s ARG 393 N -0.29 0.99 -0.44 -0.62 0.52 0.76 -4.96 118.95 114.92 2bze s ARG 393 Ca 0.37 -1.41 -0.25 0.00 -0.52 0.00 0.00 55.73 53.92 2bze s ARG 393 Cb -0.21 -0.49 0.02 0.00 0.52 0.00 0.00 34.95 34.80 2bze s ARG 393 CO 0.23 0.05 0.90 0.08 0.02 0.00 0.00 175.30 176.58 2bze s VAL 394 N -3.41 4.52 -0.06 3.52 1.01 -1.26 -2.59 120.40 122.14 2bze s VAL 394 Ca 0.15 0.79 0.04 0.00 0.00 0.00 0.00 61.98 62.97 2bze s VAL 394 Cb 0.03 -4.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 2bze s VAL 394 CO -0.01 -0.75 -0.18 0.00 0.00 0.00 0.00 175.10 174.16 2bze s ALA 395 N 3.62 2.49 0.05 5.51 0.00 -0.88 -4.32 121.76 128.24 2bze s ALA 395 Ca 0.36 -1.00 -0.28 0.00 0.00 0.00 0.00 51.96 51.04 2bze s ALA 395 Cb -0.11 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 22.09 2bze s ALA 395 CO 0.24 0.49 0.87 -2.00 0.00 0.00 0.00 175.76 175.37 2bze s GLU 396 N -0.49 4.58 -0.27 0.00 2.12 0.16 -0.40 118.70 124.39 2bze s GLU 396 Ca 0.06 1.26 -0.27 0.00 0.36 0.00 0.00 54.97 56.38 2bze s GLU 396 Cb -0.12 -3.40 0.01 0.00 0.26 0.00 0.00 34.13 30.89 2bze s GLU 396 CO 0.01 0.17 0.96 0.42 -0.54 0.00 0.00 175.26 176.29 2bze s ILE 397 N 0.25 4.68 -0.64 -3.70 1.01 0.29 -0.54 121.20 122.55 2bze s ILE 397 Ca 0.44 1.70 0.02 0.00 0.00 0.00 0.00 60.65 62.81 2bze s ILE 397 Cb -0.21 -4.27 0.16 0.00 0.01 0.00 0.00 42.46 38.14 2bze s ILE 397 CO 0.26 -0.26 0.42 0.42 0.00 0.00 0.00 174.94 175.78 2bze s THR 398 N 3.22 3.14 0.28 2.92 -4.23 0.87 -1.68 115.64 120.16 2bze s THR 398 Ca 0.40 -3.56 0.00 0.00 -1.18 0.00 0.00 61.69 57.36 2bze s THR 398 Cb -0.14 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 70.62 2bze s THR 398 CO 0.10 -0.90 0.00 0.61 -0.54 0.00 0.00 174.62 173.89 2bze n GLY 399 N 2.80 -1.91 3.03 3.99 0.00 -1.26 -2.34 105.19 109.50 2bze n GLY 399 Ca 0.11 -1.24 -0.29 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.15 1.49 0.18 1.61 1.01 -1.26 -1.49 120.40 119.78 2bze s VAL 400 Ca 0.00 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.42 2bze s VAL 400 Cb 0.00 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2bze s VAL 400 CO 0.00 0.44 0.18 0.68 0.00 0.00 0.00 175.10 176.40 2bze s VAL 401 N 1.24 4.65 -0.13 2.92 -7.23 0.18 -4.93 120.40 117.09 2bze s VAL 401 Ca -0.01 -1.07 -0.07 0.00 -1.81 0.00 0.00 61.98 59.02 2bze s VAL 401 Cb -0.14 -3.41 -0.04 0.00 0.56 0.00 0.00 36.38 33.35 2bze s VAL 401 CO -0.06 -0.16 0.12 -1.61 -0.31 0.00 0.00 175.10 173.09 2bze s GLU 402 N -3.29 3.53 0.00 4.82 2.02 -1.26 -0.16 118.70 124.35 2bze s GLU 402 Ca 0.32 -0.17 0.00 0.00 0.02 0.00 0.00 54.97 55.14 2bze s GLU 402 Cb -0.10 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 30.94 2bze s GLU 402 CO 0.25 0.68 0.00 0.25 0.02 0.00 0.00 175.26 176.46 2bze n THR 403 N 2.28 0.00 0.03 3.63 -2.24 0.77 -4.89 114.28 113.87 2bze n THR 403 Ca -0.19 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.63 2bze n THR 403 Cb 0.54 -0.69 0.08 0.00 -2.10 0.00 0.00 70.33 68.16 2bze n THR 403 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bze n ALA 404 N -3.00 2.25 -4.04 6.98 0.00 -1.26 -4.71 120.51 116.73 2bze n ALA 404 Ca 0.00 -0.91 -0.31 0.00 0.00 0.00 0.00 53.44 52.22 2bze n ALA 404 Cb 0.00 -0.28 -0.15 0.00 0.00 0.00 0.00 19.45 19.02 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 -0.87 1.82 0.26 0.00 2.36 -1.26 -5.03 119.74 117.02 2bze s LYS 405 Ca 0.13 -1.64 -0.30 0.00 -2.55 0.00 0.00 55.97 51.62 2bze s LYS 405 Cb 0.08 -3.06 -0.09 0.00 -1.05 0.00 0.00 37.83 33.70 2bze s LYS 405 CO 0.10 -0.77 1.11 0.08 1.55 0.00 0.00 175.35 177.42 2bze s VAL 406 N 0.99 3.51 0.36 4.02 1.01 -1.26 -4.36 120.40 124.67 2bze s VAL 406 Ca 0.02 1.48 0.08 0.00 0.00 0.00 0.00 61.98 63.56 2bze s VAL 406 Cb -0.19 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 2bze s VAL 406 CO -0.07 0.34 0.13 -0.72 0.00 0.00 0.00 175.10 174.78 2bze s TYR 407 N -0.99 2.66 -0.51 5.22 -0.85 -0.66 -4.90 117.35 117.32 2bze s TYR 407 Ca 0.46 -0.43 -0.17 0.00 -0.52 0.00 0.00 57.07 56.41 2bze s TYR 407 Cb -0.32 -1.69 0.09 0.00 0.38 0.00 0.00 41.96 40.42 2bze s TYR 407 CO 0.40 0.32 0.49 -1.14 -1.52 0.00 0.00 175.55 174.10 2bze s GLN 408 N -3.84 3.01 0.38 -3.49 -0.44 -1.26 -4.12 119.66 109.90 2bze s GLN 408 Ca 0.38 -1.35 0.08 0.00 -2.50 0.00 0.00 55.36 51.97 2bze s GLN 408 Cb -0.01 -4.18 -0.07 0.00 -1.64 0.00 0.00 33.01 27.11 2bze s GLN 408 CO 0.22 -1.18 -0.03 -1.17 0.50 0.00 0.00 175.29 173.64 2bze s LEU 409 N 1.90 2.79 0.08 3.68 2.96 -1.26 -4.96 118.68 123.87 2bze s LEU 409 Ca 0.06 -1.31 -0.32 0.00 -0.22 0.00 0.00 54.13 52.35 2bze s LEU 409 Cb -0.25 -0.91 -0.17 0.00 0.50 0.00 0.00 46.19 45.36 2bze s LEU 409 CO 0.07 -0.37 0.77 0.61 -1.32 0.00 0.00 176.35 176.11 2bze n GLY 410 N -0.89 -0.85 3.55 7.98 0.00 -1.26 -3.77 105.19 109.95 2bze n GLY 410 Ca -0.05 0.54 -0.17 0.00 0.00 0.00 0.00 46.02 46.33 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 1.59 -0.18 3.07 -0.02 0.00 -1.26 -4.81 105.19 103.57 2bze n GLY 411 Ca 0.18 0.32 -0.10 0.00 0.00 0.00 0.00 46.02 46.41 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 12.11 0.38 -0.35 2.61 -1.32 -1.25 -5.12 115.64 122.71 2bze s THR 412 Ca 1.01 -1.38 0.01 0.00 -1.21 0.00 0.00 61.69 60.12 2bze s THR 412 Cb -0.28 -0.94 0.11 0.00 -1.51 0.00 0.00 72.50 69.88 2bze s THR 412 CO 0.19 -0.66 0.13 -0.13 -2.21 0.00 0.00 174.62 171.93 2bze s ARG 413 N -2.55 0.98 0.01 7.08 3.00 -1.26 -4.11 118.95 122.10 2bze s ARG 413 Ca -0.03 -1.44 0.01 0.00 0.00 0.00 0.00 55.73 54.27 2bze s ARG 413 Cb -0.03 -2.26 -0.01 0.00 0.00 0.00 0.00 34.95 32.65 2bze s ARG 413 CO -0.03 -1.03 -0.05 -0.08 0.00 0.00 0.00 175.30 174.11 2bze s THR 414 N 1.17 0.34 -1.03 0.02 -1.32 -1.26 -4.97 115.64 108.59 2bze s THR 414 Ca 0.12 -0.45 -0.08 0.00 -1.21 0.00 0.00 61.69 60.08 2bze s THR 414 Cb -0.19 -0.34 0.26 0.00 -1.51 0.00 0.00 72.50 70.71 2bze s THR 414 CO -0.16 -0.08 0.99 0.54 -2.21 0.00 0.00 174.62 173.71 2bze s ASN 415 N -0.56 6.94 0.31 8.08 4.22 -1.26 -1.66 114.94 131.00 2bze s ASN 415 Ca -0.03 -3.53 -0.09 0.00 -2.14 0.00 0.00 52.86 47.08 2bze s ASN 415 Cb -0.04 -2.14 0.01 0.00 1.28 0.00 0.00 41.25 40.36 2bze s ASN 415 CO -0.00 -0.29 0.51 -1.59 -2.04 0.00 0.00 177.10 173.69 2bze s LYS 416 N -1.13 1.79 0.11 3.55 -2.85 -1.26 -0.16 119.74 119.79 2bze s LYS 416 Ca 0.29 -1.50 -0.21 0.00 -1.00 0.00 0.00 55.97 53.54 2bze s LYS 416 Cb -0.10 0.48 0.05 0.00 -2.06 0.00 0.00 37.83 36.21 2bze s LYS 416 CO -0.09 -0.76 0.52 0.20 0.10 0.00 0.00 175.35 175.32 2bze s GLY 417 N -3.12 -0.46 0.15 0.59 0.00 0.77 -4.09 107.32 101.15 2bze s GLY 417 Ca 0.25 0.41 0.02 0.00 0.00 0.00 0.00 44.72 45.40 2bze s GLY 417 CO 0.14 0.11 0.28 1.08 0.00 0.00 0.00 173.10 174.70 2bze s LEU 418 N -2.45 4.32 -0.61 0.66 1.02 0.20 0.49 118.68 122.31 2bze s LEU 418 Ca -0.01 0.16 -0.20 0.00 0.02 0.00 0.00 54.13 54.10 2bze s LEU 418 Cb -0.00 -2.89 0.09 0.00 0.02 0.00 0.00 46.19 43.41 2bze s LEU 418 CO -0.08 0.06 0.79 -1.58 0.02 0.00 0.00 176.35 175.55 2bze s GLN 419 N -3.20 3.07 -0.00 1.70 0.74 -0.56 -0.96 119.66 120.45 2bze s GLN 419 Ca 0.34 -1.13 -0.19 0.00 0.05 0.00 0.00 55.36 54.43 2bze s GLN 419 Cb -0.11 -4.24 -0.06 0.00 1.10 0.00 0.00 33.01 29.70 2bze s GLN 419 CO 0.28 -1.62 0.54 -0.51 -0.55 0.00 0.00 175.29 173.43 2bze s LEU 420 N 3.15 4.43 -0.05 3.68 1.43 0.13 -0.09 118.68 131.36 2bze s LEU 420 Ca 0.15 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.35 2bze s LEU 420 Cb -0.21 -2.82 0.03 0.00 0.03 0.00 0.00 46.19 43.21 2bze s LEU 420 CO 0.08 0.16 -0.02 -0.60 0.23 0.00 0.00 176.35 176.21 2bze s ARG 421 N -0.42 0.60 -0.56 1.70 3.52 0.30 -0.96 118.95 123.13 2bze s ARG 421 Ca 0.28 0.02 -0.02 0.00 -0.13 0.00 0.00 55.73 55.88 2bze s ARG 421 Cb -0.18 -0.78 0.15 0.00 -1.56 0.00 0.00 34.95 32.58 2bze s ARG 421 CO 0.16 -0.17 0.36 -1.58 -0.81 0.00 0.00 175.30 173.26 2bze s HIS 422 N 1.29 3.44 0.00 5.12 5.65 -0.89 0.38 115.29 130.27 2bze s HIS 422 Ca -0.06 -2.70 0.00 0.00 0.25 0.00 0.00 55.06 52.56 2bze s HIS 422 Cb -0.13 -3.17 0.00 0.00 -1.18 0.00 0.00 32.58 28.10 2bze s HIS 422 CO -0.02 -0.86 0.00 0.41 -0.65 0.00 0.00 174.74 173.62 2bze n GLY 423 N 3.71 2.34 3.18 1.59 0.00 -1.26 -2.93 105.19 111.81 2bze n GLY 423 Ca 0.05 -0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 2bze n GLY 423 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bze s ASN 424 N -4.00 6.33 -0.25 1.61 4.22 -1.26 -4.86 114.94 116.74 2bze s ASN 424 Ca 0.00 -3.57 -0.04 0.00 -2.14 0.00 0.00 52.86 47.11 2bze s ASN 424 Cb 0.00 -2.00 0.09 0.00 1.28 0.00 0.00 41.25 40.62 2bze s ASN 424 CO 0.00 -0.25 0.15 -0.62 -2.04 0.00 0.00 177.10 174.34 2bze s ASP 425 N 0.43 2.82 -0.39 3.54 -1.08 -1.15 -5.05 116.67 115.79 2bze s ASP 425 Ca 0.27 -0.96 -0.05 0.00 -0.52 0.00 0.00 52.55 51.29 2bze s ASP 425 Cb -0.09 -0.15 0.08 0.00 -1.46 0.00 0.00 42.92 41.30 2bze s ASP 425 CO -0.10 -0.40 0.18 -1.58 0.52 0.00 0.00 175.17 173.78 2bze s GLN 426 N 2.16 2.33 0.22 4.34 0.74 -1.26 -2.09 119.66 126.10 2bze s GLN 426 Ca 0.07 -1.55 0.04 0.00 0.05 0.00 0.00 55.36 53.97 2bze s GLN 426 Cb -0.16 -3.56 -0.05 0.00 1.10 0.00 0.00 33.01 30.34 2bze s GLN 426 CO -0.27 -0.92 -0.02 1.03 -0.55 0.00 0.00 175.29 174.55 2bze s ARG 427 N 1.27 1.30 -0.21 1.67 0.52 -0.13 -5.00 118.95 118.37 2bze s ARG 427 Ca 0.03 -1.64 -0.02 0.00 -0.52 0.00 0.00 55.73 53.59 2bze s ARG 427 Cb -0.22 -0.64 0.01 0.00 0.52 0.00 0.00 34.95 34.62 2bze s ARG 427 CO -0.01 -0.06 -0.10 0.54 0.02 0.00 0.00 175.30 175.69 2bze s VAL 428 N -3.38 2.79 -0.09 3.52 0.11 -1.26 0.22 120.40 122.31 2bze s VAL 428 Ca 0.26 -0.79 0.02 0.00 -2.93 0.00 0.00 61.98 58.54 2bze s VAL 428 Cb 0.05 -2.29 -0.02 0.00 -1.53 0.00 0.00 36.38 32.59 2bze s VAL 428 CO 0.07 0.40 -0.15 -0.36 -3.33 0.00 0.00 175.10 171.73 2bze s PHE 429 N 1.37 2.72 0.61 1.54 0.08 -0.13 -4.90 117.98 119.27 2bze s PHE 429 Ca 0.04 -0.44 -0.14 0.00 0.12 0.00 0.00 56.93 56.50 2bze s PHE 429 Cb -0.15 -1.72 -0.03 0.00 -0.57 0.00 0.00 43.02 40.55 2bze s PHE 429 CO -0.07 -0.04 1.04 1.03 -0.10 0.00 0.00 175.22 177.09 2bze s ARG 430 N -0.18 3.35 0.59 0.44 3.00 -1.26 -0.63 118.95 124.27 2bze s ARG 430 Ca -0.00 1.08 0.30 0.00 0.00 0.00 0.00 55.73 57.10 2bze s ARG 430 Cb -0.13 -2.04 1.83 0.00 0.00 0.00 0.00 34.95 34.60 2bze s ARG 430 CO 0.03 -0.77 2.25 -0.07 0.00 0.00 0.00 175.30 176.74 2bze h LEU 431 N 0.20 0.00 -1.39 2.53 3.38 -1.96 -1.66 115.31 116.42 2bze h LEU 431 Ca -0.46 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 2bze h LEU 431 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2bze h LEU 431 CO 0.58 0.00 -0.18 1.05 0.09 0.00 0.00 178.44 179.98 2bze h GLU 432 N 0.00 0.00 -0.01 1.13 4.11 -1.92 -2.73 114.58 115.16 2bze h GLU 432 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.44 2bze h GLU 432 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2bze h GLU 432 CO -0.00 0.18 -0.29 1.19 0.07 0.00 0.00 179.01 180.15 2bze n PHE 433 N -3.43 0.00 -2.70 2.06 3.72 -0.62 -4.88 117.46 111.61 2bze n PHE 433 Ca -0.00 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.99 2bze n PHE 433 Cb 0.36 -0.16 -0.05 0.00 -0.94 0.00 0.00 39.48 38.69 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 -2.61 4.09 0.73 -4.37 1.01 -1.03 -3.83 120.40 114.39 2bze s VAL 434 Ca 0.22 1.99 -0.04 0.00 0.00 0.00 0.00 61.98 64.15 2bze s VAL 434 Cb 0.19 -4.27 0.11 0.00 0.00 0.00 0.00 36.38 32.41 2bze s VAL 434 CO 0.55 0.43 1.02 -0.44 0.00 0.00 0.00 175.10 176.66 2bze s SER 435 N -0.82 4.39 -0.09 3.32 0.01 -0.12 -4.57 113.70 115.82 2bze s SER 435 Ca 0.43 -0.01 0.13 0.00 1.31 0.00 0.00 55.95 57.82 2bze s SER 435 Cb -0.26 -0.46 0.22 0.00 0.21 0.00 0.00 66.02 65.73 2bze s SER 435 CO 0.33 -1.84 1.11 0.59 0.41 0.00 0.00 173.24 173.84 2bze n ASN 436 N -2.94 1.54 -4.54 2.44 3.02 -1.26 -3.11 115.26 110.40 2bze n ASN 436 Ca 0.12 -2.80 -0.32 0.00 -0.03 0.00 0.00 54.58 51.55 2bze n ASN 436 Cb 0.60 -0.37 -0.11 0.00 -0.61 0.00 0.00 39.78 39.29 2bze n ASN 436 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bze s GLN 437 N -1.94 2.50 0.76 3.52 -2.07 -1.26 -4.97 119.66 116.21 2bze s GLN 437 Ca 0.23 -0.73 -0.13 0.00 -1.82 0.00 0.00 55.36 52.92 2bze s GLN 437 Cb 0.21 -2.44 0.18 0.00 -1.09 0.00 0.00 33.01 29.88 2bze s GLN 437 CO 0.00 0.61 0.84 0.39 -1.32 0.00 0.00 175.29 175.81 2bze n GLU 438 N 1.84 -1.70 -4.07 9.60 1.02 -1.26 -4.68 120.64 121.39 2bze n GLU 438 Ca -0.16 -1.31 -0.22 0.00 -0.02 0.00 0.00 57.16 55.44 2bze n GLU 438 Cb 0.52 -1.04 -0.06 0.00 -0.02 0.00 0.00 31.44 30.85 2bze n GLU 438 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2bze s PHE 439 N -2.69 2.80 0.49 -0.32 0.08 -1.26 -5.04 117.98 112.03 2bze s PHE 439 Ca 0.51 -0.31 0.03 0.00 0.12 0.00 0.00 56.93 57.28 2bze s PHE 439 Cb -0.03 -1.58 -0.02 0.00 -0.57 0.00 0.00 43.02 40.82 2bze s PHE 439 CO 0.37 0.37 0.04 0.95 -0.10 0.00 0.00 175.22 176.85 2bze s THR 440 N -2.35 1.38 0.27 0.64 -4.23 -1.26 -4.91 115.64 105.18 2bze s THR 440 Ca 0.37 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2bze s THR 440 Cb -0.04 -2.34 0.07 0.00 1.34 0.00 0.00 72.50 71.53 2bze s THR 440 CO 0.23 0.00 1.72 1.05 -0.54 0.00 0.00 174.62 177.08 2bze h GLU 441 N 1.38 0.61 -0.47 3.99 4.11 -1.98 0.89 114.58 123.12 2bze h GLU 441 Ca -0.43 -0.21 -0.09 0.00 0.07 0.00 0.00 59.36 58.70 2bze h GLU 441 Cb 1.30 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 2bze h GLU 441 CO 0.74 0.76 -0.04 1.03 0.07 0.00 0.00 179.01 181.57 2bze h SER 442 N 0.55 0.85 -0.41 3.06 0.87 -1.99 0.14 113.55 116.61 2bze h SER 442 Ca 0.09 -0.33 -0.11 0.00 -1.23 0.00 0.00 61.79 60.21 2bze h SER 442 Cb 0.62 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 2bze h SER 442 CO 0.04 0.97 -0.17 -0.33 -0.53 0.00 0.00 176.83 176.82 2bze h GLU 443 N 0.70 0.84 -0.08 2.24 4.39 -1.92 -2.67 114.58 118.09 2bze h GLU 443 Ca 0.13 -0.35 0.02 0.00 0.34 0.00 0.00 59.36 59.49 2bze h GLU 443 Cb 0.56 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.16 2bze h GLU 443 CO 0.03 0.99 -0.03 0.35 -1.16 0.00 0.00 179.01 179.19 2bze h PHE 444 N 0.66 -0.06 -0.20 4.33 3.04 -0.50 -2.53 116.94 121.67 2bze h PHE 444 Ca 0.10 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.03 2bze h PHE 444 Cb 0.72 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.26 2bze h PHE 444 CO 0.05 -0.05 -0.00 0.00 -2.02 0.00 0.00 178.31 176.30 2bze h MET 445 N -0.01 0.29 -0.39 1.11 -0.00 -0.67 0.10 114.93 115.36 2bze h MET 445 Ca 0.04 -0.04 -0.09 0.00 -0.00 0.00 0.00 59.70 59.60 2bze h MET 445 Cb 0.08 -0.05 -0.02 0.00 -0.00 0.00 0.00 31.60 31.61 2bze h MET 445 CO -0.09 0.32 -0.14 0.87 -0.00 0.00 0.00 176.91 177.87 2bze h LYS 446 N 0.29 0.70 -0.21 -0.10 1.57 -1.22 -1.64 116.57 115.96 2bze h LYS 446 Ca 0.07 -0.24 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 2bze h LYS 446 Cb 0.20 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 2bze h LYS 446 CO 0.00 0.82 -0.25 2.35 -0.57 0.00 0.00 179.45 181.79 2bze h TRP 447 N 0.64 0.66 -0.51 -1.35 7.01 -0.76 -2.14 115.95 119.49 2bze h TRP 447 Ca 0.11 -0.21 0.10 0.00 2.11 0.00 0.00 58.89 61.00 2bze h TRP 447 Cb 0.60 -0.13 -0.09 0.00 -2.10 0.00 0.00 29.16 27.43 2bze h TRP 447 CO 0.03 0.91 -0.10 -0.22 -2.79 0.00 0.00 178.44 176.27 2bze h LYS 448 N 0.22 0.02 0.00 2.65 1.63 -0.65 0.47 116.57 120.91 2bze h LYS 448 Ca 0.03 -0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.79 2bze h LYS 448 Cb 0.82 -0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.44 2bze h LYS 448 CO 0.06 0.01 -0.15 1.05 -3.45 0.00 0.00 179.45 176.97 2bze h GLU 449 N 0.02 0.00 -0.15 1.90 4.11 -1.25 0.84 114.58 120.05 2bze h GLU 449 Ca 0.25 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.50 2bze h GLU 449 Cb 0.38 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.64 2bze h GLU 449 CO -0.51 0.15 -0.62 0.00 0.07 0.00 0.00 179.01 178.11 2bze h ALA 450 N 1.85 0.28 -0.24 1.06 0.00 -0.31 0.18 119.26 122.09 2bze h ALA 450 Ca -0.00 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.31 2bze h ALA 450 Cb 0.67 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2bze h ALA 450 CO 0.02 0.54 -0.05 0.52 0.00 0.00 0.00 179.25 180.28 2bze h MET 451 N 0.38 0.46 -0.53 0.00 2.86 -0.64 -1.07 114.93 116.38 2bze h MET 451 Ca -0.03 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.39 2bze h MET 451 Cb 1.25 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.86 2bze h MET 451 CO 0.13 0.68 0.19 0.35 1.06 0.00 0.00 176.91 179.32 2bze h PHE 452 N 0.21 0.84 0.00 -0.22 3.04 -0.79 0.20 116.94 120.21 2bze h PHE 452 Ca 0.06 -0.08 -0.01 0.00 3.98 0.00 0.00 57.97 61.92 2bze h PHE 452 Cb 0.51 -0.25 -0.00 0.00 2.56 0.00 0.00 35.95 38.77 2bze h PHE 452 CO 0.05 0.71 -0.05 1.03 -2.02 0.00 0.00 178.31 178.02 2bze h SER 453 N 0.73 0.00 1.22 0.41 0.87 -0.59 -2.06 113.55 114.13 2bze h SER 453 Ca 0.17 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.66 2bze h SER 453 Cb 0.25 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2bze h SER 453 CO -0.01 0.05 -0.82 0.00 -0.53 0.00 0.00 176.83 175.53 2bze h ALA 454 N 1.95 0.68 0.00 6.23 0.00 -0.07 -3.47 119.26 124.57 2bze h ALA 454 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2bze h ALA 454 Cb 0.59 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2bze h ALA 454 CO 0.01 0.43 0.00 0.41 0.00 0.00 0.00 179.25 180.10 2bze n GLY 455 N 1.24 0.74 3.83 0.00 0.00 0.07 -4.89 105.19 106.18 2bze n GLY 455 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.45 4.15 0.11 1.61 -1.94 0.48 -4.98 119.30 118.29 2bze s MET 456 Ca 0.00 0.75 -0.30 0.00 -1.71 0.00 0.00 55.69 54.43 2bze s MET 456 Cb 0.00 -2.82 -0.06 0.00 2.01 0.00 0.00 34.83 33.97 2bze s MET 456 CO 0.00 0.37 0.99 -1.14 -0.01 0.00 0.00 175.02 175.24 2bze s GLN 457 N -2.14 4.66 0.59 2.03 0.74 -1.26 -4.08 119.66 120.19 2bze s GLN 457 Ca 0.44 1.50 -0.19 0.00 0.05 0.00 0.00 55.36 57.16 2bze s GLN 457 Cb -0.15 -3.37 -0.04 0.00 1.10 0.00 0.00 33.01 30.55 2bze s GLN 457 CO 0.20 0.14 1.18 -0.51 -0.55 0.00 0.00 175.29 175.75 2bze s LEU 458 N 0.11 3.66 0.69 3.68 2.01 -1.26 -5.00 118.68 122.58 2bze s LEU 458 Ca 0.48 2.30 -0.12 0.00 0.01 0.00 0.00 54.13 56.80 2bze s LEU 458 Cb -0.24 -4.59 0.01 0.00 0.01 0.00 0.00 46.19 41.38 2bze s LEU 458 CO 0.30 -1.51 1.07 -2.16 1.01 0.00 0.00 176.35 175.07 2bze s PRO 459 N -3.38 2.82 0.30 1.29 0.05 -1.26 -4.85 135.00 129.96 2bze s PRO 459 Ca 0.75 1.11 0.04 0.00 0.05 0.00 0.00 61.00 62.95 2bze s PRO 459 Cb -0.28 -1.97 -0.02 0.00 0.05 0.00 0.00 34.50 32.28 2bze s PRO 459 CO 0.32 -1.20 0.45 0.95 0.05 0.00 0.00 177.00 177.57 2bze s THR 460 N -2.82 4.92 0.37 1.26 -4.23 -1.26 -1.00 115.64 112.89 2bze s THR 460 Ca 0.61 -0.83 0.17 0.00 -1.18 0.00 0.00 61.69 60.46 2bze s THR 460 Cb -0.16 -3.75 0.16 0.00 1.34 0.00 0.00 72.50 70.09 2bze s THR 460 CO 0.50 -0.36 1.90 -0.07 -0.54 0.00 0.00 174.62 176.06 2bze h LEU 461 N 0.96 0.00 -1.14 4.79 3.38 -0.99 -1.32 115.31 120.99 2bze h LEU 461 Ca -0.50 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 2bze h LEU 461 Cb 1.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2bze h LEU 461 CO 0.59 0.28 -0.18 -0.78 0.09 0.00 0.00 178.44 178.45 2bze h ASP 462 N 0.00 0.38 -0.02 -0.43 3.58 -1.81 -0.08 116.42 118.04 2bze h ASP 462 Ca -0.00 -0.10 -0.12 0.00 0.42 0.00 0.00 57.03 57.22 2bze h ASP 462 Cb 0.56 -0.10 0.01 0.00 1.72 0.00 0.00 39.33 41.51 2bze h ASP 462 CO 0.04 0.57 -0.46 -0.33 -2.88 0.00 0.00 179.24 176.18 2bze h GLU 463 N 0.35 0.35 -0.62 0.28 5.08 -1.63 -2.56 114.58 115.83 2bze h GLU 463 Ca 0.06 -0.35 0.04 0.00 -1.00 0.00 0.00 59.36 58.12 2bze h GLU 463 Cb 0.52 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 2bze h GLU 463 CO 0.03 1.02 0.36 0.82 -1.00 0.00 0.00 179.01 180.25 2bze h ILE 464 N -0.20 1.02 -0.64 3.13 1.08 -1.04 0.44 117.51 121.30 2bze h ILE 464 Ca -0.05 -0.24 -0.05 0.00 -0.39 0.00 0.00 64.86 64.13 2bze h ILE 464 Cb 1.17 0.27 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 2bze h ILE 464 CO 0.09 0.13 0.22 -1.13 -0.69 0.00 0.00 178.15 176.76 2bze h ASN 465 N 0.69 0.89 0.79 1.72 -0.73 -1.03 0.17 115.58 118.08 2bze h ASN 465 Ca 0.26 -0.14 -0.18 0.00 1.87 0.00 0.00 56.30 58.11 2bze h ASN 465 Cb 0.09 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.43 2bze h ASN 465 CO -0.14 0.82 -0.85 0.11 -0.37 0.00 0.00 177.43 177.00 2bze h LYS 466 N 0.93 0.04 -0.11 6.67 1.57 -0.88 -1.58 116.57 123.22 2bze h LYS 466 Ca 0.21 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 2bze h LYS 466 Cb 0.24 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 2bze h LYS 466 CO -0.01 0.86 -0.14 0.87 -0.57 0.00 0.00 179.45 180.47 2bze h LYS 467 N 0.02 0.29 -0.63 3.15 1.79 0.47 0.40 116.57 122.06 2bze h LYS 467 Ca -0.02 -0.16 0.02 0.00 -2.18 0.00 0.00 60.65 58.31 2bze h LYS 467 Cb 1.49 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 32.12 2bze h LYS 467 CO 0.11 0.72 0.41 1.05 -1.08 0.00 0.00 179.45 180.67 2bze h GLU 468 N -0.12 0.77 -0.77 3.15 4.11 -0.70 0.18 114.58 121.19 2bze h GLU 468 Ca 0.01 -0.05 -0.04 0.00 0.07 0.00 0.00 59.36 59.36 2bze h GLU 468 Cb 0.68 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2bze h GLU 468 CO 0.03 0.51 0.33 1.25 0.07 0.00 0.00 179.01 181.20 2bze h LEU 469 N 0.79 1.05 -0.58 3.06 7.12 -1.13 -0.50 115.31 125.12 2bze h LEU 469 Ca 0.24 -0.16 -0.15 0.00 0.13 0.00 0.00 57.88 57.94 2bze h LEU 469 Cb -0.00 -0.27 -0.01 0.00 -0.53 0.00 0.00 40.66 39.85 2bze h LEU 469 CO -0.06 0.92 -0.54 -1.28 -0.13 0.00 0.00 178.44 177.34 2bze h SER 470 N 1.11 0.51 -0.06 1.25 0.87 0.10 -1.46 113.55 115.87 2bze h SER 470 Ca 0.26 -0.27 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 2bze h SER 470 Cb 0.18 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.99 2bze h SER 470 CO -0.03 0.96 -0.03 0.40 -0.53 0.00 0.00 176.83 177.60 2bze h ILE 471 N 0.36 1.33 -0.25 2.23 2.04 -0.42 -1.44 117.51 121.36 2bze h ILE 471 Ca 0.01 -1.06 -0.07 0.00 1.00 0.00 0.00 64.86 64.73 2bze h ILE 471 Cb 1.07 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 39.06 2bze h ILE 471 CO 0.10 0.29 -0.17 0.07 0.00 0.00 0.00 178.15 178.44 2bze h LYS 472 N -0.27 0.43 -0.01 2.37 2.10 -0.95 -0.15 116.57 120.09 2bze h LYS 472 Ca 0.01 -0.13 -0.21 0.00 -2.00 0.00 0.00 60.65 58.32 2bze h LYS 472 Cb 0.48 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.76 2bze h LYS 472 CO 0.01 0.59 -0.89 1.05 -2.00 0.00 0.00 179.45 178.21 2bze h GLU 473 N 0.39 0.31 -0.11 0.07 4.11 -1.25 -2.15 114.58 115.95 2bze h GLU 473 Ca 0.07 -0.33 -0.22 0.00 0.07 0.00 0.00 59.36 58.95 2bze h GLU 473 Cb 0.53 0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.88 2bze h GLU 473 CO 0.03 1.02 -0.80 0.00 0.07 0.00 0.00 179.01 179.33 2bze h ALA 474 N 0.87 0.36 0.00 1.06 0.00 -0.80 -3.04 119.26 117.71 2bze h ALA 474 Ca -0.06 -0.62 -0.11 0.00 0.00 0.00 0.00 54.91 54.12 2bze h ALA 474 Cb 1.51 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 2bze h ALA 474 CO 0.15 0.71 -0.54 1.37 0.00 0.00 0.00 179.25 180.93 2bze h LEU 475 N 0.46 0.00 0.00 0.00 8.10 -1.10 -3.50 115.31 119.26 2bze h LEU 475 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.93 2bze h LEU 475 Cb 1.43 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.65 2bze h LEU 475 CO 0.16 0.54 0.00 -3.20 -4.11 0.00 0.00 178.44 171.83