#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 2.05 3.33 -5.12 0.00 -1.26 -5.05 105.19 99.14 2bze n GLY -20 Ca 0.00 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.04 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 -1.62 3.77 0.22 1.61 7.64 -1.26 -4.56 113.62 119.41 2bze n SER -19 Ca 0.00 -2.80 0.12 0.00 1.01 0.00 0.00 58.87 57.21 2bze n SER -19 Cb 0.58 -1.61 0.20 0.00 -1.01 0.00 0.00 64.21 62.37 2bze n SER -19 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2bze h SER -18 N 7.92 0.00 -3.33 6.43 0.02 -2.07 -3.41 113.55 119.11 2bze h SER -18 Ca 0.40 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.74 2bze h SER -18 Cb 0.81 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 63.01 2bze h SER -18 CO 1.57 0.00 -0.85 -1.38 -1.14 0.00 0.00 176.83 175.03 2bze s HIS -17 N -3.23 2.12 0.00 3.45 -0.00 -1.26 -5.10 115.29 111.27 2bze s HIS -17 Ca 0.07 -0.90 0.00 0.00 -0.00 0.00 0.00 55.06 54.23 2bze s HIS -17 Cb 0.05 -1.47 0.00 0.00 -0.00 0.00 0.00 32.58 31.16 2bze s HIS -17 CO 0.66 -0.41 0.00 0.72 -0.00 0.00 0.00 174.74 175.71 2bze n HIS -16 N 3.82 0.00 -3.94 0.38 8.25 -1.26 -4.96 115.22 117.51 2bze n HIS -16 Ca -0.20 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 56.95 2bze n HIS -16 Cb 0.52 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.49 2bze n HIS -16 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2bze s HIS -15 N 0.58 3.35 -0.17 4.41 0.09 -1.26 -5.01 115.29 117.27 2bze s HIS -15 Ca 0.00 -3.08 0.01 0.00 -0.00 0.00 0.00 55.06 51.98 2bze s HIS -15 Cb 0.00 -2.89 0.01 0.00 -0.00 0.00 0.00 32.58 29.70 2bze s HIS -15 CO 0.00 -0.80 -0.18 -3.38 -0.00 0.00 0.00 174.74 170.38 2bze s HIS -14 N 0.04 2.78 -0.42 1.40 -0.00 -1.26 -4.91 115.29 112.92 2bze s HIS -14 Ca 0.15 -1.41 0.20 0.00 -0.00 0.00 0.00 55.06 54.01 2bze s HIS -14 Cb -0.24 -1.92 -0.27 0.00 -0.00 0.00 0.00 32.58 30.16 2bze s HIS -14 CO -0.02 -0.69 0.61 0.72 -0.00 0.00 0.00 174.74 175.36 2bze n HIS -13 N 4.45 0.00 0.00 0.38 8.25 -1.26 -4.81 115.22 122.22 2bze n HIS -13 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 2bze n HIS -13 Cb 0.51 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.36 2bze n HIS -13 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2bze n HIS -12 N -1.87 -0.07 -2.19 4.41 -0.00 -1.26 -5.11 115.22 109.13 2bze n HIS -12 Ca -0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.40 2bze n HIS -12 Cb 0.43 0.02 -0.01 0.00 -0.00 0.00 0.00 29.99 30.42 2bze n HIS -12 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2bze s SER -11 N -1.76 6.33 -0.48 4.39 1.04 -1.26 -5.00 113.70 116.95 2bze s SER -11 Ca 0.00 1.59 -0.23 0.00 0.48 0.00 0.00 55.95 57.80 2bze s SER -11 Cb 0.00 -2.51 0.03 0.00 0.10 0.00 0.00 66.02 63.65 2bze s SER -11 CO 0.00 -0.79 0.79 -0.44 0.98 0.00 0.00 173.24 173.78 2bze s SER -10 N -3.26 6.36 0.00 7.02 0.01 -1.26 -4.76 113.70 117.82 2bze s SER -10 Ca 0.59 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.55 2bze s SER -10 Cb -0.11 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 63.74 2bze s SER -10 CO 0.38 -0.98 0.00 0.61 0.41 0.00 0.00 173.24 173.66 2bze n GLY -9 N 5.05 1.97 3.74 3.44 0.00 -1.26 -4.82 105.19 113.30 2bze n GLY -9 Ca 0.01 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 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 4.28 -0.31 0.99 1.02 -1.26 -4.62 118.68 118.78 2bze s LEU -8 Ca 0.00 0.71 -0.15 0.00 0.02 0.00 0.00 54.13 54.70 2bze s LEU -8 Cb 0.00 -2.55 -0.02 0.00 0.02 0.00 0.00 46.19 43.63 2bze s LEU -8 CO 0.00 0.07 0.37 -0.69 0.02 0.00 0.00 176.35 176.12 2bze s VAL -7 N 0.39 5.16 0.05 -1.59 1.01 -1.26 -4.91 120.40 119.26 2bze s VAL -7 Ca 0.22 0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.50 2bze s VAL -7 Cb -0.14 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.49 2bze s VAL -7 CO 0.08 0.03 0.07 -0.81 0.00 0.00 0.00 175.10 174.47 2bze n PRO -6 N 5.38 0.04 -1.95 2.72 -0.04 -1.26 -5.09 135.00 134.79 2bze n PRO -6 Ca -0.09 -0.13 -0.18 0.00 -0.04 0.00 0.00 63.50 63.07 2bze n PRO -6 Cb 0.50 -0.07 0.10 0.00 -0.04 0.00 0.00 33.50 33.99 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 -1.15 -0.11 -0.70 0.54 1.74 -1.26 -4.88 116.66 110.84 2bze n ARG -5 Ca 0.01 -1.94 0.00 0.00 -0.77 0.00 0.00 57.85 55.15 2bze n ARG -5 Cb 0.03 -0.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 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 -0.83 0.17 0.10 -0.13 0.00 -1.26 -4.74 105.19 98.50 2bze n GLY -4 Ca 0.12 -0.44 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 2bze n GLY -4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2bze h SER -3 N 0.00 0.00 -1.37 1.61 0.02 -2.00 -3.46 113.55 108.35 2bze h SER -3 Ca 0.00 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.49 2bze h SER -3 Cb 0.22 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.80 2bze h SER -3 CO 0.00 0.72 -0.12 -1.00 -1.14 0.00 0.00 176.83 175.29 2bze s HIS -2 N -2.83 2.08 0.28 3.45 3.76 -1.26 -5.09 115.29 115.68 2bze s HIS -2 Ca 0.00 -0.48 0.07 0.00 -0.15 0.00 0.00 55.06 54.51 2bze s HIS -2 Cb 0.09 -2.42 -0.06 0.00 1.11 0.00 0.00 32.58 31.30 2bze s HIS -2 CO 0.79 -0.93 -0.08 1.41 -0.85 0.00 0.00 174.74 175.08 2bze s MET -1 N -4.62 1.58 0.23 1.40 1.75 -1.26 -3.67 119.30 114.70 2bze s MET -1 Ca 0.59 -1.79 -0.31 0.00 -1.25 0.00 0.00 55.69 52.93 2bze s MET -1 Cb -0.08 -1.27 -0.12 0.00 2.84 0.00 0.00 34.83 36.21 2bze s MET -1 CO 0.37 0.08 1.66 0.08 -0.65 0.00 0.00 175.02 176.57 2bze s VAL 345 N -2.92 2.12 0.00 10.11 1.01 0.37 -4.71 120.40 126.38 2bze s VAL 345 Ca 0.29 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.36 2bze s VAL 345 Cb 0.03 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.35 2bze s VAL 345 CO 0.12 0.01 0.00 -1.54 0.00 0.00 0.00 175.10 173.69 2bze n SER 346 N 3.46 0.00 -4.36 3.32 3.41 -1.26 -4.92 113.62 113.26 2bze n SER 346 Ca 0.13 -0.45 -0.31 0.00 -0.26 0.00 0.00 58.87 57.98 2bze n SER 346 Cb 0.36 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.16 2bze n SER 346 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2bze s LEU 347 N 0.00 2.23 0.64 1.04 1.43 -1.26 -4.99 118.68 117.77 2bze s LEU 347 Ca 0.00 -0.45 0.39 0.00 -1.03 0.00 0.00 54.13 53.04 2bze s LEU 347 Cb 0.00 -1.38 2.19 0.00 0.03 0.00 0.00 46.19 47.03 2bze s LEU 347 CO 0.00 0.31 2.33 -0.65 0.23 0.00 0.00 176.35 178.56 2bze h PRO 348 N 5.24 0.00 -0.17 1.29 0.11 -1.92 -2.51 132.00 134.04 2bze h PRO 348 Ca -0.45 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.48 2bze h PRO 348 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2bze h PRO 348 CO 0.47 0.00 -0.66 0.93 -0.21 0.00 0.00 178.00 178.53 2bze h GLU 349 N 0.00 0.63 -0.42 1.05 4.39 -1.94 0.33 114.58 118.62 2bze h GLU 349 Ca -0.00 -0.46 -0.13 0.00 0.34 0.00 0.00 59.36 59.11 2bze h GLU 349 Cb 0.01 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2bze h GLU 349 CO 0.00 1.08 -0.26 0.93 -1.16 0.00 0.00 179.01 179.59 2bze h GLU 350 N 0.46 0.92 0.00 2.33 5.08 -1.88 -1.39 114.58 120.10 2bze h GLU 350 Ca -0.02 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2bze h GLU 350 Cb 1.24 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2bze h GLU 350 CO 0.13 1.09 0.00 1.25 -1.00 0.00 0.00 179.01 180.47 2bze h LEU 351 N 0.75 0.00 -0.08 1.33 5.85 -1.33 -2.90 115.31 118.93 2bze h LEU 351 Ca 0.09 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.57 2bze h LEU 351 Cb 0.84 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 2bze h LEU 351 CO 0.07 0.00 -1.04 0.78 -0.34 0.00 0.00 178.44 177.91 2bze h ASN 352 N 0.00 0.33 0.25 1.25 2.35 0.62 0.13 115.58 120.51 2bze h ASN 352 Ca 0.00 -0.31 -0.18 0.00 -0.55 0.00 0.00 56.30 55.26 2bze h ASN 352 Cb 0.71 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 2bze h ASN 352 CO 0.00 1.17 -0.69 0.08 -1.65 0.00 0.00 177.43 176.34 2bze h ARG 353 N 0.10 0.40 -0.01 0.81 0.11 -1.18 -2.85 114.38 111.76 2bze h ARG 353 Ca -0.08 -0.31 0.00 0.00 0.10 0.00 0.00 59.98 59.69 2bze h ARG 353 Cb 1.72 0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.86 2bze h ARG 353 CO 0.16 0.94 -0.12 1.33 0.10 0.00 0.00 179.97 182.39 2bze n VAL 354 N -3.85 0.00 -2.31 0.08 0.24 -1.11 -4.74 118.33 106.63 2bze n VAL 354 Ca -0.04 -0.12 -0.42 0.00 -2.04 0.00 0.00 64.34 61.72 2bze n VAL 354 Cb 0.68 0.14 -0.03 0.00 -1.47 0.00 0.00 33.84 33.17 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 -2.33 4.36 -0.12 7.34 3.00 0.43 -2.27 118.95 129.35 2bze s ARG 355 Ca 0.31 1.88 -0.04 0.00 -1.00 0.00 0.00 55.73 56.89 2bze s ARG 355 Cb 0.20 -3.40 -0.04 0.00 0.00 0.00 0.00 34.95 31.72 2bze s ARG 355 CO 0.45 -0.40 0.03 -0.51 0.00 0.00 0.00 175.30 174.87 2bze s LEU 356 N 1.51 3.71 0.25 -0.88 1.43 0.44 -4.94 118.68 120.19 2bze s LEU 356 Ca 0.61 0.14 0.03 0.00 -1.03 0.00 0.00 54.13 53.88 2bze s LEU 356 Cb -0.31 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 2bze s LEU 356 CO 0.28 0.31 0.41 -0.94 0.23 0.00 0.00 176.35 176.64 2bze s SER 357 N -0.44 6.33 0.61 2.29 1.04 -1.26 -3.29 113.70 118.97 2bze s SER 357 Ca 0.09 0.23 0.33 0.00 0.48 0.00 0.00 55.95 57.08 2bze s SER 357 Cb -0.12 -1.93 1.96 0.00 0.10 0.00 0.00 66.02 66.03 2bze s SER 357 CO 0.02 -0.12 2.28 0.08 0.98 0.00 0.00 173.24 176.48 2bze h ARG 358 N 1.28 0.00 -0.02 4.02 0.11 -1.77 -0.23 114.38 117.76 2bze h ARG 358 Ca -0.50 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 59.50 2bze h ARG 358 Cb 1.22 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.29 2bze h ARG 358 CO 0.63 0.01 -0.37 0.45 0.10 0.00 0.00 179.97 180.79 2bze h HIS 359 N 0.00 0.04 0.15 4.08 3.86 -1.93 0.19 115.15 121.54 2bze h HIS 359 Ca -0.00 -0.01 -0.31 0.00 -1.16 0.00 0.00 60.37 58.89 2bze h HIS 359 Cb 0.02 -0.01 0.03 0.00 1.06 0.00 0.00 27.41 28.51 2bze h HIS 359 CO 0.00 0.40 -1.31 0.87 0.86 0.00 0.00 177.93 178.75 2bze h LYS 360 N 0.03 0.58 -0.44 2.45 1.57 -1.44 -2.35 116.57 116.98 2bze h LYS 360 Ca 0.00 -0.84 -0.06 0.00 -1.87 0.00 0.00 60.65 57.89 2bze h LYS 360 Cb 0.66 0.29 -0.02 0.00 0.08 0.00 0.00 32.23 33.24 2bze h LYS 360 CO 0.05 1.39 0.03 -0.07 -0.57 0.00 0.00 179.45 180.28 2bze h LEU 361 N 0.23 0.65 -0.40 2.94 3.38 -1.12 -1.88 115.31 119.12 2bze h LEU 361 Ca -0.20 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 2bze h LEU 361 Cb 1.98 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.54 2bze h LEU 361 CO 0.25 0.70 0.21 -0.08 0.09 0.00 0.00 178.44 179.61 2bze h GLU 362 N 0.66 0.56 0.00 1.13 4.81 -0.54 0.13 114.58 121.33 2bze h GLU 362 Ca 0.14 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2bze h GLU 362 Cb 0.36 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2bze h GLU 362 CO 0.01 0.46 0.00 2.89 -0.73 0.00 0.00 179.01 181.64 2bze n ARG 363 N -4.73 0.22 0.00 1.92 1.85 -0.89 -2.54 116.66 112.49 2bze n ARG 363 Ca 0.00 0.20 0.10 0.00 -1.00 0.00 0.00 57.85 57.15 2bze n ARG 363 Cb 0.09 -1.76 -0.03 0.00 -1.05 0.00 0.00 32.46 29.70 2bze n ARG 363 CO 0.00 0.00 0.00 0.91 -0.01 0.00 0.00 177.63 178.53 2bze n TRP 364 N -2.15 0.00 -0.10 2.89 8.01 -0.75 -4.52 117.44 120.83 2bze n TRP 364 Ca 0.05 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.22 2bze n TRP 364 Cb 0.40 0.00 0.21 0.00 -2.01 0.00 0.00 31.31 29.91 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 0.74 0.00 -4.27 0.00 2.07 -1.79 -3.46 115.15 108.43 2bze h HIS 366 Ca 0.16 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.17 2bze h HIS 366 Cb 0.31 0.00 0.12 0.00 2.57 0.00 0.00 27.41 30.40 2bze h HIS 366 CO 0.02 0.00 0.34 -1.64 -3.07 0.00 0.00 177.93 173.58 2bze s MET 367 N -3.23 2.51 0.00 5.12 1.00 -0.72 -5.07 119.30 118.91 2bze s MET 367 Ca 0.06 1.24 0.00 0.00 0.00 0.00 0.00 55.69 56.98 2bze s MET 367 Cb 0.06 -1.92 0.00 0.00 0.00 0.00 0.00 34.83 32.97 2bze s MET 367 CO 0.69 -1.45 0.00 -2.30 0.00 0.00 0.00 175.02 171.95 2bze n PRO 368 N -3.07 2.34 -0.01 2.03 -0.02 -1.26 -4.63 135.00 130.38 2bze n PRO 368 Ca 0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2bze n PRO 368 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.01 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 -0.55 0.00 0.31 6.00 -1.74 -1.26 -4.40 117.46 115.83 2bze n PHE 369 Ca 0.00 -0.04 0.13 0.00 -0.56 0.00 0.00 57.45 56.98 2bze n PHE 369 Cb 0.00 -0.38 0.60 0.00 1.52 0.00 0.00 39.48 41.21 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 5.80 0.00 -1.01 2.97 -0.00 -1.89 -2.27 116.94 120.54 2bze h PHE 370 Ca 0.00 0.00 0.24 0.00 -0.00 0.00 0.00 57.97 58.21 2bze h PHE 370 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 35.95 35.86 2bze h PHE 370 CO 0.96 0.00 0.65 0.00 -0.00 0.00 0.00 178.31 179.91 2bze h ALA 371 N 2.14 2.12 -0.33 12.09 0.00 -1.95 0.73 119.26 134.05 2bze h ALA 371 Ca 0.00 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2bze h ALA 371 Cb 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2bze h ALA 371 CO 0.00 -0.51 -0.21 -0.22 0.00 0.00 0.00 179.25 178.32 2bze h LYS 372 N 0.46 0.72 -0.44 0.00 1.63 -1.78 -0.27 116.57 116.89 2bze h LYS 372 Ca 0.58 -0.34 -0.07 0.00 -0.85 0.00 0.00 60.65 59.96 2bze h LYS 372 Cb 1.35 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.95 2bze h LYS 372 CO -0.30 0.95 -0.04 1.15 -3.45 0.00 0.00 179.45 177.76 2bze h THR 373 N 0.49 1.24 0.00 1.00 2.02 -1.29 -2.69 112.91 113.69 2bze h THR 373 Ca 0.07 -1.02 -0.16 0.00 0.77 0.00 0.00 66.41 66.07 2bze h THR 373 Cb 0.76 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2bze h THR 373 CO 0.06 0.35 -0.82 -0.37 0.37 0.00 0.00 175.52 175.11 2bze h VAL 374 N 0.68 1.12 -2.39 3.16 -1.51 -0.81 -3.42 116.25 113.08 2bze h VAL 374 Ca 0.13 -2.64 -0.54 0.00 -1.23 0.00 0.00 66.70 62.43 2bze h VAL 374 Cb 0.47 2.53 0.03 0.00 -2.13 0.00 0.00 31.29 32.19 2bze h VAL 374 CO 0.02 0.64 1.18 0.41 -1.23 0.00 0.00 177.57 178.60 2bze n THR 375 N -3.23 0.62 0.00 7.19 -1.04 -0.12 -1.13 114.28 116.56 2bze n THR 375 Ca -0.01 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2bze n THR 375 Cb 0.83 -2.23 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 1.18 3.95 3.41 0.00 0.80 -4.97 105.19 114.00 2bze n GLY 376 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.70 2.50 0.14 0.00 0.08108.95 -0.62 117.98 226.32 2bze s PHE 378 Ca 0.52 -0.29 0.11 0.00 0.12 0.00 0.00 56.93 57.38 2bze s PHE 378 Cb -0.10 -1.40 -0.04 0.00 -0.57 0.00 0.00 43.02 40.91 2bze s PHE 378 CO 0.40 0.29 -0.25 0.54 -0.10 0.00 0.00 175.22 176.09 2bze s VAL 379 N -0.99 2.37 -0.64 -0.44 0.11 0.45 -0.42 120.40 120.83 2bze s VAL 379 Ca 0.15 -1.77 -0.21 0.00 -2.93 0.00 0.00 61.98 57.22 2bze s VAL 379 Cb -0.10 -2.07 0.08 0.00 -1.53 0.00 0.00 36.38 32.76 2bze s VAL 379 CO 0.06 0.06 0.88 -0.60 -3.33 0.00 0.00 175.10 172.17 2bze s ARG 380 N -2.18 3.10 -0.08 1.54 6.06 -1.21 -2.24 118.95 123.95 2bze s ARG 380 Ca 0.16 -1.01 0.01 0.00 -2.50 0.00 0.00 55.73 52.39 2bze s ARG 380 Cb -0.10 -4.25 -0.03 0.00 0.06 0.00 0.00 34.95 30.63 2bze s ARG 380 CO 0.07 -1.73 -0.11 -1.50 -2.50 0.00 0.00 175.30 169.54 2bze s ILE 381 N 3.60 3.35 -0.20 4.11 1.10 -1.03 -0.18 121.20 131.94 2bze s ILE 381 Ca 0.19 -0.60 -0.06 0.00 -0.51 0.00 0.00 60.65 59.67 2bze s ILE 381 Cb -0.19 -2.36 -0.03 0.00 0.15 0.00 0.00 42.46 40.03 2bze s ILE 381 CO 0.09 0.57 0.02 -0.83 -2.11 0.00 0.00 174.94 172.68 2bze s GLY 382 N -0.47 1.76 -0.40 1.50 0.00 -1.12 -0.53 107.32 108.06 2bze s GLY 382 Ca 0.06 -0.95 0.01 0.00 0.00 0.00 0.00 44.72 43.85 2bze s GLY 382 CO 0.02 0.22 0.25 -0.26 0.00 0.00 0.00 173.10 173.32 2bze s ILE 383 N 0.91 0.75 0.00 0.90 -4.36 0.47 -4.88 121.20 115.00 2bze s ILE 383 Ca 0.02 -2.24 0.00 0.00 -0.26 0.00 0.00 60.65 58.17 2bze s ILE 383 Cb -0.14 -1.53 0.00 0.00 1.25 0.00 0.00 42.46 42.03 2bze s ILE 383 CO 0.02 -0.98 0.00 0.61 0.24 0.00 0.00 174.94 174.83 2bze n GLY 384 N 3.64 -1.40 2.93 6.27 0.00 -1.26 -4.50 105.19 110.86 2bze n GLY 384 Ca 0.13 -1.27 -0.19 0.00 0.00 0.00 0.00 46.02 44.69 2bze n GLY 384 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bze s ASN 385 N -4.00 0.86 0.00 1.61 2.47 -1.26 -0.12 114.94 114.49 2bze s ASN 385 Ca 0.00 -0.12 0.00 0.00 0.42 0.00 0.00 52.86 53.16 2bze s ASN 385 Cb 0.00 -0.30 0.00 0.00 -1.45 0.00 0.00 41.25 39.50 2bze s ASN 385 CO 0.00 0.00 0.71 1.41 -3.72 0.00 0.00 177.10 175.51 2bze n HIS 386 N 3.58 0.00 0.00 0.43 8.25 -1.26 -4.96 115.22 121.26 2bze n HIS 386 Ca -0.21 -0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.01 2bze n HIS 386 Cb 0.53 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.62 2bze n HIS 386 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2bze n ASN 387 N -0.24 0.00 0.00 0.41 2.85 -1.26 -5.04 115.26 111.98 2bze n ASN 387 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2bze n ASN 387 Cb 0.17 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.19 2bze n ASN 387 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2bze n SER 388 N 0.00 0.09 -4.24 1.20 7.64 -1.26 -5.07 113.62 111.97 2bze n SER 388 Ca 0.00 -0.82 -0.22 0.00 1.01 0.00 0.00 58.87 58.84 2bze n SER 388 Cb 0.00 0.02 -0.12 0.00 -1.01 0.00 0.00 64.21 63.10 2bze n SER 388 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 2bze s LYS 389 N -0.02 1.01 0.17 1.43 -2.85 -1.26 -5.10 119.74 113.13 2bze s LYS 389 Ca 0.00 -1.09 -0.33 0.00 -1.00 0.00 0.00 55.97 53.55 2bze s LYS 389 Cb 0.00 -1.17 -0.13 0.00 -2.06 0.00 0.00 37.83 34.47 2bze s LYS 389 CO 0.00 0.27 1.65 -2.30 0.10 0.00 0.00 175.35 175.07 2bze n PRO 390 N 1.14 2.42 -3.24 1.78 -0.02 -1.26 -4.24 135.00 131.57 2bze n PRO 390 Ca -0.20 0.87 -0.41 0.00 -2.02 0.00 0.00 63.50 61.74 2bze n PRO 390 Cb 0.54 -2.68 -0.08 0.00 -0.02 0.00 0.00 33.50 31.26 2bze n PRO 390 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bze s VAL 391 N 1.12 5.03 -0.04 -1.45 1.01 0.82 -4.96 120.40 121.94 2bze s VAL 391 Ca 0.78 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 63.23 2bze s VAL 391 Cb -0.61 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 31.81 2bze s VAL 391 CO 0.36 -0.13 0.12 -0.31 0.00 0.00 0.00 175.10 175.14 2bze s TYR 392 N 2.38 3.42 0.21 5.22 2.02 -1.26 -0.39 117.35 128.94 2bze s TYR 392 Ca 0.19 0.32 -0.00 0.00 -0.37 0.00 0.00 57.07 57.21 2bze s TYR 392 Cb -0.15 -1.81 -0.04 0.00 -0.40 0.00 0.00 41.96 39.55 2bze s TYR 392 CO 0.12 0.61 0.12 1.03 -1.57 0.00 0.00 175.55 175.86 2bze s ARG 393 N -1.59 1.24 -0.05 -0.62 0.52 0.31 -4.84 118.95 113.92 2bze s ARG 393 Ca 0.22 -1.66 -0.22 0.00 -0.52 0.00 0.00 55.73 53.55 2bze s ARG 393 Cb -0.12 0.13 -0.04 0.00 0.52 0.00 0.00 34.95 35.44 2bze s ARG 393 CO 0.13 -0.36 0.66 0.08 0.02 0.00 0.00 175.30 175.82 2bze s VAL 394 N -4.05 5.00 -0.07 3.52 1.01 -1.26 -2.47 120.40 122.08 2bze s VAL 394 Ca 0.38 1.36 0.02 0.00 0.00 0.00 0.00 61.98 63.74 2bze s VAL 394 Cb 0.07 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.47 2bze s VAL 394 CO 0.12 0.31 -0.11 0.00 0.00 0.00 0.00 175.10 175.42 2bze s ALA 395 N 0.46 1.23 0.11 5.51 0.00 -0.95 -4.53 121.76 123.59 2bze s ALA 395 Ca 0.35 -0.41 -0.30 0.00 0.00 0.00 0.00 51.96 51.59 2bze s ALA 395 Cb -0.18 -0.62 -0.06 0.00 0.00 0.00 0.00 23.12 22.27 2bze s ALA 395 CO 0.17 0.01 1.02 -2.00 0.00 0.00 0.00 175.76 174.97 2bze s GLU 396 N 0.87 4.63 -0.15 0.00 2.12 0.60 -0.41 118.70 126.35 2bze s GLU 396 Ca -0.11 1.55 -0.25 0.00 0.36 0.00 0.00 54.97 56.51 2bze s GLU 396 Cb -0.15 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 30.86 2bze s GLU 396 CO 0.01 0.09 0.83 0.42 -0.54 0.00 0.00 175.26 176.08 2bze s ILE 397 N 0.19 4.89 -0.53 -3.70 1.01 0.21 -0.40 121.20 122.86 2bze s ILE 397 Ca 0.49 1.65 0.04 0.00 0.00 0.00 0.00 60.65 62.83 2bze s ILE 397 Cb -0.25 -4.14 0.14 0.00 0.01 0.00 0.00 42.46 38.22 2bze s ILE 397 CO 0.31 0.05 0.31 0.42 0.00 0.00 0.00 174.94 176.03 2bze s THR 398 N 1.99 2.20 0.08 2.92 -4.23 0.11 -0.14 115.64 118.57 2bze s THR 398 Ca 0.39 -3.28 0.00 0.00 -1.18 0.00 0.00 61.69 57.62 2bze s THR 398 Cb -0.17 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.16 2bze s THR 398 CO 0.14 -0.90 0.00 0.61 -0.54 0.00 0.00 174.62 173.93 2bze n GLY 399 N 2.96 -1.71 3.11 3.99 0.00 -1.26 -2.38 105.19 109.91 2bze n GLY 399 Ca 0.11 -1.24 -0.27 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.72 1.48 0.07 1.61 1.01 -1.26 -1.85 120.40 120.74 2bze s VAL 400 Ca 0.00 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.37 2bze s VAL 400 Cb 0.00 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 2bze s VAL 400 CO 0.00 0.43 -0.25 0.68 0.00 0.00 0.00 175.10 175.96 2bze s VAL 401 N 0.35 2.31 0.08 2.92 -7.23 -0.19 -4.91 120.40 113.72 2bze s VAL 401 Ca -0.12 -1.47 -0.11 0.00 -1.81 0.00 0.00 61.98 58.48 2bze s VAL 401 Cb -0.15 -1.95 -0.06 0.00 0.56 0.00 0.00 36.38 34.78 2bze s VAL 401 CO 0.04 0.27 0.41 -1.83 -0.31 0.00 0.00 175.10 173.69 2bze s GLU 402 N -1.55 3.79 0.48 4.82 -1.05 -1.26 0.71 118.70 124.64 2bze s GLU 402 Ca 0.13 0.22 0.06 0.00 -0.15 0.00 0.00 54.97 55.23 2bze s GLU 402 Cb -0.10 -3.01 -0.01 0.00 -0.44 0.00 0.00 34.13 30.58 2bze s GLU 402 CO 0.04 0.56 0.28 0.95 0.95 0.00 0.00 175.26 178.04 2bze s THR 403 N -1.38 1.95 -1.52 1.83 -4.23 0.16 -4.86 115.64 107.59 2bze s THR 403 Ca 0.33 -1.60 0.26 0.00 -1.18 0.00 0.00 61.69 59.49 2bze s THR 403 Cb -0.14 -2.55 0.17 0.00 1.34 0.00 0.00 72.50 71.32 2bze s THR 403 CO 0.18 0.00 1.49 0.00 -0.54 0.00 0.00 174.62 175.75 2bze n ALA 404 N -1.49 3.27 -3.85 3.99 0.00 -1.26 -4.69 120.51 116.47 2bze n ALA 404 Ca -0.03 -0.40 -0.34 0.00 0.00 0.00 0.00 53.44 52.67 2bze n ALA 404 Cb 0.64 -1.11 -0.15 0.00 0.00 0.00 0.00 19.45 18.84 2bze n ALA 404 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2bze s LYS 405 N -2.66 2.88 -0.37 0.00 -0.14 -1.26 -5.03 119.74 113.15 2bze s LYS 405 Ca 0.20 -0.94 -0.29 0.00 -1.36 0.00 0.00 55.97 53.58 2bze s LYS 405 Cb 0.19 -2.86 0.02 0.00 -1.68 0.00 0.00 37.83 33.50 2bze s LYS 405 CO 0.58 -0.34 1.14 0.08 -0.76 0.00 0.00 175.35 176.06 2bze s VAL 406 N 1.31 4.33 0.00 3.17 1.01 -1.26 -4.15 120.40 124.81 2bze s VAL 406 Ca 0.01 1.47 0.00 0.00 0.00 0.00 0.00 61.98 63.46 2bze s VAL 406 Cb -0.16 -4.43 0.00 0.00 0.00 0.00 0.00 36.38 31.79 2bze s VAL 406 CO -0.07 -0.67 0.00 0.00 0.00 0.00 0.00 175.10 174.37 2bze n TYR 407 N 7.38 -1.44 -3.86 5.22 4.11 0.34 -4.82 117.16 124.08 2bze n TYR 407 Ca 0.13 0.00 -0.36 0.00 -0.00 0.00 0.00 57.90 57.67 2bze n TYR 407 Cb 0.48 0.00 -0.13 0.00 -0.00 0.00 0.00 39.34 39.68 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 0.32 2.79 0.23 -3.48 -0.44 -1.26 -3.80 119.66 114.01 2bze s GLN 408 Ca 0.00 -1.03 0.02 0.00 -2.50 0.00 0.00 55.36 51.84 2bze s GLN 408 Cb 0.00 -3.20 -0.05 0.00 -1.64 0.00 0.00 33.01 28.12 2bze s GLN 408 CO 0.00 -0.50 0.06 -1.17 0.50 0.00 0.00 175.29 174.18 2bze s LEU 409 N 1.37 1.83 -0.10 3.68 2.96 -1.24 -4.58 118.68 122.59 2bze s LEU 409 Ca -0.01 -1.30 -0.41 0.00 -0.22 0.00 0.00 54.13 52.19 2bze s LEU 409 Cb -0.18 -0.02 -0.20 0.00 0.50 0.00 0.00 46.19 46.30 2bze s LEU 409 CO -0.01 -0.66 1.17 0.61 -1.32 0.00 0.00 176.35 176.14 2bze n GLY 410 N -0.38 -0.18 3.54 7.98 0.00 -1.26 -3.39 105.19 111.50 2bze n GLY 410 Ca -0.02 0.80 -0.17 0.00 0.00 0.00 0.00 46.02 46.63 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 2.00 -0.21 3.00 -0.02 0.00 -1.26 -4.82 105.19 103.88 2bze n GLY 411 Ca 0.22 0.29 -0.13 0.00 0.00 0.00 0.00 46.02 46.40 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 11.37 0.37 -0.23 2.61 -1.32 -1.22 -5.14 115.64 122.08 2bze s THR 412 Ca 1.03 -0.74 0.02 0.00 -1.21 0.00 0.00 61.69 60.80 2bze s THR 412 Cb -0.31 -0.42 0.05 0.00 -1.51 0.00 0.00 72.50 70.30 2bze s THR 412 CO 0.21 -0.25 -0.14 -0.13 -2.21 0.00 0.00 174.62 172.10 2bze s ARG 413 N -1.05 2.45 0.00 7.08 3.00 -1.26 -3.69 118.95 125.48 2bze s ARG 413 Ca -0.07 -1.18 0.01 0.00 0.00 0.00 0.00 55.73 54.49 2bze s ARG 413 Cb -0.07 -2.78 -0.01 0.00 0.00 0.00 0.00 34.95 32.09 2bze s ARG 413 CO -0.00 -0.46 -0.04 -0.08 0.00 0.00 0.00 175.30 174.72 2bze s THR 414 N 1.17 0.32 -0.80 0.02 -1.32 -1.25 -4.93 115.64 108.86 2bze s THR 414 Ca -0.05 -0.30 -0.00 0.00 -1.21 0.00 0.00 61.69 60.13 2bze s THR 414 Cb -0.18 -0.30 0.36 0.00 -1.51 0.00 0.00 72.50 70.87 2bze s THR 414 CO -0.07 0.01 1.78 -0.46 -2.21 0.00 0.00 174.62 173.67 2bze n ASN 415 N 2.75 6.87 -3.90 8.08 6.94 -1.26 -0.50 115.26 134.24 2bze n ASN 415 Ca -0.14 -3.79 -0.11 0.00 -0.02 0.00 0.00 54.58 50.52 2bze n ASN 415 Cb 0.58 -0.96 -0.13 0.00 -2.36 0.00 0.00 39.78 36.92 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 -4.00 0.13 0.29 -3.83 0.00 -1.26 0.36 119.74 111.42 2bze s LYS 416 Ca 0.49 -0.19 0.00 0.00 0.00 0.00 0.00 55.97 56.27 2bze s LYS 416 Cb 0.38 0.05 -0.00 0.00 0.00 0.00 0.00 37.83 38.26 2bze s LYS 416 CO -0.32 -0.02 0.00 0.41 0.00 0.00 0.00 175.35 175.43 2bze n GLY 417 N 2.56 3.83 3.43 0.59 0.00 0.22 -4.57 105.19 111.24 2bze n GLY 417 Ca -0.16 -2.29 -0.27 0.00 0.00 0.00 0.00 46.02 43.30 2bze n GLY 417 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bze s LEU 418 N 0.00 2.46 -0.59 0.99 1.43 -0.93 -1.02 118.68 121.02 2bze s LEU 418 Ca 0.00 -0.85 -0.21 0.00 -1.03 0.00 0.00 54.13 52.04 2bze s LEU 418 Cb 0.00 -1.20 0.07 0.00 0.03 0.00 0.00 46.19 45.10 2bze s LEU 418 CO 0.00 0.12 0.80 -1.58 0.23 0.00 0.00 176.35 175.93 2bze s GLN 419 N -2.68 3.12 0.25 1.70 2.00 -0.77 -2.25 119.66 121.03 2bze s GLN 419 Ca 0.21 -0.93 -0.09 0.00 -2.00 0.00 0.00 55.36 52.56 2bze s GLN 419 Cb -0.08 -4.19 -0.07 0.00 0.80 0.00 0.00 33.01 29.48 2bze s GLN 419 CO 0.10 -1.55 0.55 -0.51 -0.50 0.00 0.00 175.29 173.38 2bze s LEU 420 N 3.28 4.13 -0.03 3.68 1.43 0.88 0.07 118.68 132.13 2bze s LEU 420 Ca 0.18 0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 54.15 2bze s LEU 420 Cb -0.19 -3.65 0.03 0.00 0.03 0.00 0.00 46.19 42.41 2bze s LEU 420 CO 0.10 -0.11 0.06 -0.60 0.23 0.00 0.00 176.35 176.03 2bze s ARG 421 N -3.00 -0.04 -0.87 1.70 3.52 0.46 -0.75 118.95 119.97 2bze s ARG 421 Ca 0.47 0.28 -0.08 0.00 -0.13 0.00 0.00 55.73 56.27 2bze s ARG 421 Cb -0.11 -0.33 0.22 0.00 -1.56 0.00 0.00 34.95 33.17 2bze s ARG 421 CO 0.23 -0.23 0.79 -1.01 -0.81 0.00 0.00 175.30 174.28 2bze s HIS 422 N 1.49 3.84 0.00 5.12 3.76 -0.89 -0.29 115.29 128.32 2bze s HIS 422 Ca -0.04 -2.54 0.00 0.00 -0.15 0.00 0.00 55.06 52.33 2bze s HIS 422 Cb -0.13 -3.57 0.00 0.00 1.11 0.00 0.00 32.58 29.99 2bze s HIS 422 CO -0.03 -0.89 0.00 0.41 -0.85 0.00 0.00 174.74 173.37 2bze n GLY 423 N 3.20 1.43 3.01 -2.22 0.00 -1.26 -2.82 105.19 106.53 2bze n GLY 423 Ca 0.17 0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.97 2bze n GLY 423 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bze s ASN 424 N -4.00 5.43 -0.28 1.61 3.84 -1.25 -4.84 114.94 115.46 2bze s ASN 424 Ca 0.00 -3.74 -0.02 0.00 0.21 0.00 0.00 52.86 49.31 2bze s ASN 424 Cb 0.00 -1.78 0.12 0.00 -0.55 0.00 0.00 41.25 39.03 2bze s ASN 424 CO 0.00 -0.15 0.23 -0.62 -2.79 0.00 0.00 177.10 173.77 2bze s ASP 425 N -0.70 2.27 -0.44 -4.21 -1.08 -1.13 -4.98 116.67 106.42 2bze s ASP 425 Ca 0.26 -0.87 -0.13 0.00 -0.52 0.00 0.00 52.55 51.29 2bze s ASP 425 Cb -0.07 0.19 0.07 0.00 -1.46 0.00 0.00 42.92 41.65 2bze s ASP 425 CO -0.14 -0.40 0.32 -1.58 0.52 0.00 0.00 175.17 173.89 2bze s GLN 426 N 2.27 2.82 0.04 4.34 0.74 -1.26 -2.09 119.66 126.52 2bze s GLN 426 Ca 0.09 -1.35 0.00 0.00 0.05 0.00 0.00 55.36 54.16 2bze s GLN 426 Cb -0.15 -3.95 -0.03 0.00 1.10 0.00 0.00 33.01 29.99 2bze s GLN 426 CO -0.31 -0.95 -0.05 0.50 -0.55 0.00 0.00 175.29 173.93 2bze s ARG 427 N 1.55 0.51 -0.21 1.67 3.52 0.07 -4.99 118.95 121.07 2bze s ARG 427 Ca 0.03 -0.90 -0.16 0.00 -0.13 0.00 0.00 55.73 54.57 2bze s ARG 427 Cb -0.23 0.00 -0.04 0.00 -1.56 0.00 0.00 34.95 33.13 2bze s ARG 427 CO 0.05 -0.04 0.40 0.08 -0.81 0.00 0.00 175.30 174.98 2bze s VAL 428 N -2.39 5.19 0.18 7.11 1.01 -1.26 -0.08 120.40 130.16 2bze s VAL 428 Ca -0.05 0.69 0.10 0.00 0.00 0.00 0.00 61.98 62.72 2bze s VAL 428 Cb -0.03 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2bze s VAL 428 CO -0.04 0.23 -0.20 -0.36 0.00 0.00 0.00 175.10 174.74 2bze s PHE 429 N 1.46 2.41 0.17 5.22 0.40 -0.95 -4.94 117.98 121.75 2bze s PHE 429 Ca 0.18 -0.32 -0.02 0.00 -0.60 0.00 0.00 56.93 56.18 2bze s PHE 429 Cb -0.15 -1.21 -0.05 0.00 0.51 0.00 0.00 43.02 42.13 2bze s PHE 429 CO 0.08 0.47 0.37 1.03 0.70 0.00 0.00 175.22 177.88 2bze s ARG 430 N -2.59 3.54 0.59 0.44 3.00 -1.26 -2.20 118.95 120.47 2bze s ARG 430 Ca 0.21 -0.27 0.37 0.00 0.00 0.00 0.00 55.73 56.04 2bze s ARG 430 Cb -0.09 -2.86 1.71 0.00 0.00 0.00 0.00 34.95 33.72 2bze s ARG 430 CO 0.11 0.43 2.11 -0.07 0.00 0.00 0.00 175.30 177.88 2bze h LEU 431 N 2.33 0.00 -1.36 2.53 3.38 -1.96 -2.11 115.31 118.13 2bze h LEU 431 Ca -0.47 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 2bze h LEU 431 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2bze h LEU 431 CO 0.70 0.00 -0.28 1.05 0.09 0.00 0.00 178.44 180.00 2bze h GLU 432 N 0.00 0.00 -0.00 1.13 4.11 -1.94 -2.39 114.58 115.48 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 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2bze h GLU 432 CO 0.00 0.28 -0.28 1.19 0.07 0.00 0.00 179.01 180.27 2bze n PHE 433 N -3.73 0.00 -2.64 2.06 3.72 -0.79 -4.83 117.46 111.25 2bze n PHE 433 Ca -0.01 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.97 2bze n PHE 433 Cb 0.38 -0.22 -0.04 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 -2.71 4.39 0.66 -4.37 1.01 -0.90 -2.78 120.40 115.71 2bze s VAL 434 Ca 0.20 1.89 -0.07 0.00 0.00 0.00 0.00 61.98 64.00 2bze s VAL 434 Cb 0.19 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 32.40 2bze s VAL 434 CO 0.57 0.24 0.98 -0.44 0.00 0.00 0.00 175.10 176.45 2bze s SER 435 N 0.37 5.18 -0.00 3.32 0.01 0.74 -4.56 113.70 118.76 2bze s SER 435 Ca 0.50 0.62 0.00 0.00 1.31 0.00 0.00 55.95 58.39 2bze s SER 435 Cb -0.25 -1.42 0.00 0.00 0.21 0.00 0.00 66.02 64.56 2bze s SER 435 CO 0.30 -1.36 0.98 -0.46 0.41 0.00 0.00 173.24 173.11 2bze n ASN 436 N -2.80 1.91 -4.91 2.44 0.23 -1.26 -2.93 115.26 107.94 2bze n ASN 436 Ca 0.06 -1.96 -0.28 0.00 -0.53 0.00 0.00 54.58 51.88 2bze n ASN 436 Cb 0.59 -0.00 0.08 0.00 -2.08 0.00 0.00 39.78 38.37 2bze n ASN 436 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 2bze s GLN 437 N -0.97 2.07 0.69 -3.83 1.11 -1.26 -4.92 119.66 112.55 2bze s GLN 437 Ca 0.00 -0.04 -0.06 0.00 0.01 0.00 0.00 55.36 55.27 2bze s GLN 437 Cb 0.00 -2.04 0.05 0.00 -1.01 0.00 0.00 33.01 30.01 2bze s GLN 437 CO 0.00 -1.44 1.00 -1.21 0.01 0.00 0.00 175.29 173.64 2bze s GLU 438 N -5.44 2.30 0.32 2.91 0.41 -1.26 -4.90 118.70 113.04 2bze s GLU 438 Ca 0.61 -0.23 -0.07 0.00 -0.41 0.00 0.00 54.97 54.87 2bze s GLU 438 Cb -0.11 -2.19 -0.06 0.00 -1.78 0.00 0.00 34.13 29.99 2bze s GLU 438 CO 0.47 -1.16 0.62 -0.06 -0.49 0.00 0.00 175.26 174.65 2bze s PHE 439 N -3.21 3.47 0.51 1.61 0.08 -1.26 -5.11 117.98 114.07 2bze s PHE 439 Ca 0.59 0.81 0.01 0.00 0.12 0.00 0.00 56.93 58.46 2bze s PHE 439 Cb -0.11 -2.24 -0.01 0.00 -0.57 0.00 0.00 43.02 40.09 2bze s PHE 439 CO 0.45 0.10 0.02 0.95 -0.10 0.00 0.00 175.22 176.63 2bze s THR 440 N -2.14 1.20 0.25 0.64 -4.23 -1.26 -4.87 115.64 105.23 2bze s THR 440 Ca 0.47 -1.98 -0.06 0.00 -1.18 0.00 0.00 61.69 58.94 2bze s THR 440 Cb -0.11 -2.18 0.26 0.00 1.34 0.00 0.00 72.50 71.81 2bze s THR 440 CO 0.29 0.00 1.93 1.05 -0.54 0.00 0.00 174.62 177.35 2bze h GLU 441 N 1.34 1.31 -0.54 3.99 4.11 -1.99 -1.12 114.58 121.68 2bze h GLU 441 Ca -0.44 -0.08 -0.09 0.00 0.07 0.00 0.00 59.36 58.82 2bze h GLU 441 Cb 1.31 -0.30 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 2bze h GLU 441 CO 0.74 0.87 -0.01 1.03 0.07 0.00 0.00 179.01 181.71 2bze h SER 442 N 1.35 0.95 -0.19 3.06 0.87 -1.99 0.36 113.55 117.96 2bze h SER 442 Ca 0.37 -0.31 -0.04 0.00 -1.23 0.00 0.00 61.79 60.58 2bze h SER 442 Cb -0.14 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.56 2bze h SER 442 CO -0.08 1.03 -0.04 -0.33 -0.53 0.00 0.00 176.83 176.88 2bze h GLU 443 N 0.85 0.37 -0.40 2.24 4.39 -1.82 -1.84 114.58 118.37 2bze h GLU 443 Ca 0.15 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.73 2bze h GLU 443 Cb 0.55 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 2bze h GLU 443 CO 0.03 0.62 0.25 0.35 -1.16 0.00 0.00 179.01 179.10 2bze h PHE 444 N 0.09 0.46 -0.87 4.33 3.04 -1.01 -2.40 116.94 120.60 2bze h PHE 444 Ca 0.05 0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.05 2bze h PHE 444 Cb 0.48 -0.15 -0.05 0.00 2.56 0.00 0.00 35.95 38.79 2bze h PHE 444 CO 0.05 0.28 0.57 0.52 -2.02 0.00 0.00 178.31 177.71 2bze h MET 445 N 0.50 1.04 -0.48 1.11 2.86 -0.75 0.99 114.93 120.20 2bze h MET 445 Ca 0.16 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.68 2bze h MET 445 Cb -0.01 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.39 2bze h MET 445 CO -0.06 0.69 0.09 0.87 1.06 0.00 0.00 176.91 179.56 2bze h LYS 446 N 1.08 0.74 -0.12 1.72 1.57 -0.86 -0.59 116.57 120.11 2bze h LYS 446 Ca 0.35 -0.15 -0.12 0.00 -1.87 0.00 0.00 60.65 58.85 2bze h LYS 446 Cb 0.04 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2bze h LYS 446 CO -0.10 0.69 -0.41 2.35 -0.57 0.00 0.00 179.45 181.41 2bze h TRP 447 N 0.71 0.65 -0.53 -1.35 7.01 -0.86 -1.96 115.95 119.62 2bze h TRP 447 Ca 0.16 -0.26 0.11 0.00 2.11 0.00 0.00 58.89 61.00 2bze h TRP 447 Cb 0.31 -0.11 -0.09 0.00 -2.10 0.00 0.00 29.16 27.17 2bze h TRP 447 CO 0.02 1.02 -0.04 -0.22 -2.79 0.00 0.00 178.44 176.42 2bze h LYS 448 N 0.09 0.08 0.00 2.65 1.63 -0.57 0.17 116.57 120.62 2bze h LYS 448 Ca -0.02 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 2bze h LYS 448 Cb 1.03 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.64 2bze h LYS 448 CO 0.09 0.05 -0.07 1.05 -3.45 0.00 0.00 179.45 177.12 2bze h GLU 449 N 0.08 0.00 0.07 1.90 4.11 -1.05 0.17 114.58 119.86 2bze h GLU 449 Ca 0.27 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.51 2bze h GLU 449 Cb 0.41 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.68 2bze h GLU 449 CO -0.48 0.07 -0.78 0.00 0.07 0.00 0.00 179.01 177.89 2bze h ALA 450 N 1.93 0.00 -0.56 1.06 0.00 -0.24 -0.44 119.26 121.02 2bze h ALA 450 Ca -0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 54.91 54.17 2bze h ALA 450 Cb 0.58 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2bze h ALA 450 CO 0.01 0.42 0.01 0.52 0.00 0.00 0.00 179.25 180.21 2bze h MET 451 N -0.13 0.98 -0.57 0.00 2.86 -0.46 0.47 114.93 118.08 2bze h MET 451 Ca -0.12 -0.31 -0.01 0.00 -2.06 0.00 0.00 59.70 57.21 2bze h MET 451 Cb 1.53 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 33.07 2bze h MET 451 CO 0.15 0.98 0.34 0.35 1.06 0.00 0.00 176.91 179.79 2bze h PHE 452 N 0.87 0.77 -0.64 -0.22 3.57 -0.69 0.36 116.94 120.95 2bze h PHE 452 Ca 0.16 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 2bze h PHE 452 Cb 0.53 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 2bze h PHE 452 CO 0.04 0.54 0.09 1.03 -2.23 0.00 0.00 178.31 177.77 2bze h SER 453 N 0.77 1.01 1.00 0.41 0.87 -0.78 -2.27 113.55 114.57 2bze h SER 453 Ca 0.20 -0.24 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 2bze h SER 453 Cb 0.00 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.69 2bze h SER 453 CO -0.04 1.02 -0.11 0.00 -0.53 0.00 0.00 176.83 177.17 2bze h ALA 454 N 1.10 1.02 0.00 6.23 0.00 -0.20 -3.46 119.26 123.94 2bze h ALA 454 Ca 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2bze h ALA 454 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2bze h ALA 454 CO 0.01 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.81 2bze n GLY 455 N 0.12 0.47 3.83 0.00 0.00 0.28 -4.93 105.19 104.97 2bze n GLY 455 Ca 0.00 -0.65 -0.38 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.22 3.93 0.37 1.61 -1.94 0.10 -4.98 119.30 117.17 2bze s MET 456 Ca 0.00 0.39 -0.24 0.00 -1.71 0.00 0.00 55.69 54.12 2bze s MET 456 Cb 0.00 -3.24 -0.10 0.00 2.01 0.00 0.00 34.83 33.51 2bze s MET 456 CO 0.00 0.66 0.99 -1.14 -0.01 0.00 0.00 175.02 175.51 2bze s GLN 457 N -0.95 4.36 0.68 2.03 0.74 -1.26 -4.21 119.66 121.06 2bze s GLN 457 Ca 0.23 1.37 -0.06 0.00 0.05 0.00 0.00 55.36 56.95 2bze s GLN 457 Cb -0.16 -2.60 0.05 0.00 1.10 0.00 0.00 33.01 31.40 2bze s GLN 457 CO 0.13 0.06 0.99 -0.51 -0.55 0.00 0.00 175.29 175.41 2bze s LEU 458 N -2.46 2.89 0.73 3.68 1.02 -1.26 -5.08 118.68 118.19 2bze s LEU 458 Ca 0.55 0.47 -0.11 0.00 0.02 0.00 0.00 54.13 55.06 2bze s LEU 458 Cb -0.19 -3.15 0.03 0.00 0.02 0.00 0.00 46.19 42.90 2bze s LEU 458 CO 0.24 -1.51 1.11 -2.16 0.02 0.00 0.00 176.35 174.05 2bze s PRO 459 N -5.19 2.59 0.29 1.29 0.04 -1.26 -4.84 135.00 127.91 2bze s PRO 459 Ca 0.59 0.33 0.01 0.00 0.04 0.00 0.00 61.00 61.98 2bze s PRO 459 Cb -0.11 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 2bze s PRO 459 CO 0.44 -1.19 0.46 0.95 0.04 0.00 0.00 177.00 177.71 2bze s THR 460 N -3.41 5.17 0.37 1.26 -4.23 -1.26 -0.48 115.64 113.06 2bze s THR 460 Ca 0.59 -0.59 0.20 0.00 -1.18 0.00 0.00 61.69 60.71 2bze s THR 460 Cb -0.11 -3.84 0.19 0.00 1.34 0.00 0.00 72.50 70.09 2bze s THR 460 CO 0.51 -0.42 1.94 -0.07 -0.54 0.00 0.00 174.62 176.04 2bze h LEU 461 N 1.13 0.00 -0.36 4.79 -0.00 -1.84 -0.61 115.31 118.41 2bze h LEU 461 Ca -0.50 0.00 -0.19 0.00 -0.00 0.00 0.00 57.88 57.19 2bze h LEU 461 Cb 1.22 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.88 2bze h LEU 461 CO 0.63 0.24 -0.66 -0.78 -0.00 0.00 0.00 178.44 177.86 2bze h ASP 462 N 0.00 0.71 1.06 -0.43 3.58 -1.87 -1.77 116.42 117.71 2bze h ASP 462 Ca -0.00 -0.43 -0.15 0.00 0.42 0.00 0.00 57.03 56.87 2bze h ASP 462 Cb 0.51 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 2bze h ASP 462 CO 0.03 1.18 -0.70 1.05 -2.88 0.00 0.00 179.24 177.92 2bze h GLU 463 N 0.45 0.00 -0.85 0.28 4.11 -1.68 -2.00 114.58 114.90 2bze h GLU 463 Ca -0.02 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.43 2bze h GLU 463 Cb 1.25 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.45 2bze h GLU 463 CO 0.13 0.70 0.55 0.82 0.07 0.00 0.00 179.01 181.28 2bze h ILE 464 N 0.00 1.17 -0.10 -1.06 1.08 -0.98 0.18 117.51 117.80 2bze h ILE 464 Ca -0.01 -0.38 -0.07 0.00 -0.39 0.00 0.00 64.86 64.01 2bze h ILE 464 Cb 1.42 -0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 35.14 2bze h ILE 464 CO 0.09 0.20 -0.28 -1.13 -0.69 0.00 0.00 178.15 176.34 2bze h ASN 465 N 1.10 0.17 -0.15 1.72 -0.00 -0.72 0.12 115.58 117.82 2bze h ASN 465 Ca 0.33 -0.05 -0.19 0.00 -0.00 0.00 0.00 56.30 56.38 2bze h ASN 465 Cb -0.05 -0.05 0.00 0.00 -0.00 0.00 0.00 38.32 38.22 2bze h ASN 465 CO -0.09 0.46 -0.63 0.11 -0.00 0.00 0.00 177.43 177.27 2bze h LYS 466 N 0.16 0.77 -0.07 6.67 1.79 -0.60 -2.04 116.57 123.25 2bze h LYS 466 Ca 0.02 -0.53 -0.04 0.00 -2.18 0.00 0.00 60.65 57.92 2bze h LYS 466 Cb 0.58 0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.31 2bze h LYS 466 CO 0.04 1.16 -0.11 0.87 -1.08 0.00 0.00 179.45 180.33 2bze h LYS 467 N 0.56 0.20 -0.37 3.15 1.79 0.09 -1.42 116.57 120.57 2bze h LYS 467 Ca -0.01 -0.12 0.03 0.00 -2.18 0.00 0.00 60.65 58.37 2bze h LYS 467 Cb 1.23 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.87 2bze h LYS 467 CO 0.13 0.68 0.25 1.05 -1.08 0.00 0.00 179.45 180.48 2bze h GLU 468 N -0.26 0.38 -0.81 3.15 4.11 -0.86 0.15 114.58 120.45 2bze h GLU 468 Ca 0.01 -0.02 -0.02 0.00 0.07 0.00 0.00 59.36 59.39 2bze h GLU 468 Cb 0.66 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 2bze h GLU 468 CO 0.03 0.25 0.41 1.25 0.07 0.00 0.00 179.01 181.02 2bze h LEU 469 N 0.40 1.04 -0.48 3.06 7.12 -1.17 0.14 115.31 125.42 2bze h LEU 469 Ca 0.15 -0.12 -0.17 0.00 0.13 0.00 0.00 57.88 57.87 2bze h LEU 469 Cb 0.11 -0.27 -0.01 0.00 -0.53 0.00 0.00 40.66 39.96 2bze h LEU 469 CO -0.03 0.86 -0.73 0.28 -0.13 0.00 0.00 178.44 178.69 2bze h SER 470 N 1.13 0.27 -0.06 1.25 0.02 0.26 -2.10 113.55 114.33 2bze h SER 470 Ca 0.28 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 2bze h SER 470 Cb 0.08 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2bze h SER 470 CO -0.04 0.91 -0.01 0.40 -1.14 0.00 0.00 176.83 176.95 2bze h ILE 471 N 0.15 1.29 -0.24 3.27 2.04 -0.37 -1.99 117.51 121.66 2bze h ILE 471 Ca -0.02 -0.89 -0.08 0.00 1.00 0.00 0.00 64.86 64.86 2bze h ILE 471 Cb 1.30 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.14 2bze h ILE 471 CO 0.11 0.24 -0.21 0.07 0.00 0.00 0.00 178.15 178.36 2bze h LYS 472 N -0.23 0.43 0.00 2.37 2.10 -0.65 -0.75 116.57 119.83 2bze h LYS 472 Ca 0.01 -0.15 -0.06 0.00 -2.00 0.00 0.00 60.65 58.46 2bze h LYS 472 Cb 0.39 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.68 2bze h LYS 472 CO 0.00 0.63 -0.28 1.05 -2.00 0.00 0.00 179.45 178.85 2bze h GLU 473 N 0.39 0.00 0.22 0.07 4.11 -1.36 -1.79 114.58 116.22 2bze h GLU 473 Ca 0.06 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.17 2bze h GLU 473 Cb 0.59 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.88 2bze h GLU 473 CO 0.04 0.28 -1.41 0.00 0.07 0.00 0.00 179.01 177.99 2bze h ALA 474 N 1.72 -0.11 0.00 1.06 0.00 -0.65 -3.30 119.26 117.97 2bze h ALA 474 Ca -0.00 -0.84 -0.10 0.00 0.00 0.00 0.00 54.91 53.97 2bze h ALA 474 Cb 1.01 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2bze h ALA 474 CO 0.04 0.71 -0.47 1.37 0.00 0.00 0.00 179.25 180.90 2bze h LEU 475 N 0.17 0.00 -1.15 0.00 8.10 -1.14 -3.50 115.31 117.79 2bze h LEU 475 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.76 2bze h LEU 475 Cb 2.10 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.32 2bze h LEU 475 CO 0.26 0.47 0.00 -3.20 -4.11 0.00 0.00 178.44 171.86