#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bze n GLY -20 N 0.00 -1.73 3.71 -5.12 0.00 -1.26 -5.13 105.19 95.66 2bze n GLY -20 Ca 0.00 0.87 -0.42 0.00 0.00 0.00 0.00 46.02 46.47 2bze n GLY -20 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bze s SER -19 N 0.00 6.93 0.26 1.61 0.01 -1.26 -5.03 113.70 116.22 2bze s SER -19 Ca 0.00 2.16 0.06 0.00 1.31 0.00 0.00 55.95 59.49 2bze s SER -19 Cb 0.00 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.62 2bze s SER -19 CO 0.00 -0.59 0.29 -0.44 0.41 0.00 0.00 173.24 172.91 2bze s SER -18 N 1.19 5.89 -1.37 2.44 0.01 -1.26 -5.01 113.70 115.58 2bze s SER -18 Ca 0.62 -0.12 -0.12 0.00 1.31 0.00 0.00 55.95 57.64 2bze s SER -18 Cb -0.33 -1.57 0.10 0.00 0.21 0.00 0.00 66.02 64.43 2bze s SER -18 CO 0.29 -0.09 2.04 1.41 0.41 0.00 0.00 173.24 177.30 2bze n HIS -17 N -1.32 3.31 -1.90 2.43 -0.00 -1.26 -3.86 115.22 112.62 2bze n HIS -17 Ca -0.08 -2.89 0.00 0.00 -0.00 0.00 0.00 57.72 54.75 2bze n HIS -17 Cb 0.58 -2.27 0.00 0.00 -0.00 0.00 0.00 29.99 28.30 2bze n HIS -17 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2bze n HIS -16 N 5.11 0.00 -0.83 4.41 8.25 -1.26 -4.86 115.22 126.03 2bze n HIS -16 Ca 0.46 -0.00 0.08 0.00 -0.26 0.00 0.00 57.72 58.00 2bze n HIS -16 Cb 0.38 -0.05 0.33 0.00 1.12 0.00 0.00 29.99 31.77 2bze n HIS -16 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2bze n HIS -15 N -0.00 1.45 0.17 4.41 -0.00 -1.25 -4.00 115.22 115.99 2bze n HIS -15 Ca 0.00 -0.74 0.05 0.00 -0.00 0.00 0.00 57.72 57.02 2bze n HIS -15 Cb 0.68 -0.36 0.21 0.00 -0.00 0.00 0.00 29.99 30.52 2bze n HIS -15 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2bze h HIS -14 N 3.10 0.00 -2.76 4.41 2.76 -1.92 -3.44 115.15 117.30 2bze h HIS -14 Ca 0.00 0.00 -0.50 0.00 -2.20 0.00 0.00 60.37 57.67 2bze h HIS -14 Cb 1.60 0.00 -0.14 0.00 1.55 0.00 0.00 27.41 30.42 2bze h HIS -14 CO 0.76 0.42 -0.58 -3.38 -1.30 0.00 0.00 177.93 173.85 2bze s HIS -13 N -3.31 1.88 0.07 5.26 0.00 -1.26 -5.14 115.29 112.79 2bze s HIS -13 Ca 0.02 -1.07 0.01 0.00 -3.00 0.00 0.00 55.06 51.02 2bze s HIS -13 Cb 0.09 -1.23 -0.04 0.00 -4.00 0.00 0.00 32.58 27.40 2bze s HIS -13 CO 0.71 -0.10 -0.05 -1.01 -1.00 0.00 0.00 174.74 173.28 2bze s HIS -12 N -3.29 0.68 -2.00 0.38 4.02 -1.26 -4.92 115.29 108.90 2bze s HIS -12 Ca 0.32 -0.83 0.07 0.00 1.02 0.00 0.00 55.06 55.64 2bze s HIS -12 Cb 0.07 -0.42 0.21 0.00 -1.02 0.00 0.00 32.58 31.41 2bze s HIS -12 CO 0.15 -0.20 1.17 0.43 1.02 0.00 0.00 174.74 177.31 2bze n SER -11 N 0.49 1.18 -1.09 1.40 7.64 -1.26 -2.92 113.62 119.07 2bze n SER -11 Ca -0.16 -1.99 0.11 0.00 1.01 0.00 0.00 58.87 57.84 2bze n SER -11 Cb 0.59 -0.15 0.26 0.00 -1.01 0.00 0.00 64.21 63.90 2bze n SER -11 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2bze n SER -10 N 0.14 3.22 0.00 6.43 7.64 -1.26 -5.04 113.62 124.76 2bze n SER -10 Ca 0.08 -1.96 0.00 0.00 1.01 0.00 0.00 58.87 58.00 2bze n SER -10 Cb 0.19 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 2bze n SER -10 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bze n GLY -9 N 1.47 2.21 3.68 0.23 0.00 -1.15 -4.65 105.19 106.98 2bze n GLY -9 Ca 0.20 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 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 4.17 -0.13 0.99 1.43 -1.26 -4.26 118.68 119.62 2bze s LEU -8 Ca 0.00 0.52 -0.27 0.00 -1.03 0.00 0.00 54.13 53.35 2bze s LEU -8 Cb 0.00 -2.50 -0.02 0.00 0.03 0.00 0.00 46.19 43.71 2bze s LEU -8 CO 0.00 -0.05 0.89 -0.69 0.23 0.00 0.00 176.35 176.73 2bze s VAL -7 N 1.17 4.86 -0.17 -1.59 1.01 -1.26 -5.00 120.40 119.41 2bze s VAL -7 Ca 0.19 1.79 -0.29 0.00 0.00 0.00 0.00 61.98 63.67 2bze s VAL -7 Cb -0.15 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 2bze s VAL -7 CO 0.08 0.04 1.27 -2.84 0.00 0.00 0.00 175.10 173.65 2bze s PRO -6 N 1.94 4.21 0.15 2.72 0.02 -1.26 -4.88 135.00 137.90 2bze s PRO -6 Ca 0.43 1.65 0.03 0.00 0.02 0.00 0.00 61.00 63.12 2bze s PRO -6 Cb -0.17 -3.78 -0.07 0.00 0.02 0.00 0.00 34.50 30.50 2bze s PRO -6 CO 0.15 -0.73 1.34 0.07 -0.33 0.00 0.00 177.00 177.50 2bze h ARG -5 N 8.29 0.16 0.00 5.54 0.11 -1.98 -3.48 114.38 123.03 2bze h ARG -5 Ca -0.27 -0.20 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2bze h ARG -5 Cb 1.10 0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.25 2bze h ARG -5 CO 0.97 0.99 0.00 0.41 0.10 0.00 0.00 179.97 182.44 2bze n GLY -4 N 1.03 5.21 2.50 0.08 0.00 -1.26 -1.59 105.19 111.16 2bze n GLY -4 Ca -0.04 -0.83 -0.18 0.00 0.00 0.00 0.00 46.02 44.98 2bze n GLY -4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bze n SER -3 N 0.00 -5.18 -3.97 1.61 7.64 -1.26 -4.91 113.62 107.55 2bze n SER -3 Ca 0.00 0.38 -0.10 0.00 1.01 0.00 0.00 58.87 60.16 2bze n SER -3 Cb 0.00 -4.27 -0.07 0.00 -1.01 0.00 0.00 64.21 58.86 2bze n SER -3 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2bze s HIS -2 N -2.70 0.42 0.19 1.43 3.76 -1.26 -5.12 115.29 112.02 2bze s HIS -2 Ca 0.00 -0.78 0.08 0.00 -0.15 0.00 0.00 55.06 54.22 2bze s HIS -2 Cb 0.00 -0.05 -0.04 0.00 1.11 0.00 0.00 32.58 33.60 2bze s HIS -2 CO 0.00 -0.75 -0.17 -1.64 -0.85 0.00 0.00 174.74 171.34 2bze s MET -1 N -3.98 1.33 -0.13 1.40 -1.94 -1.26 -3.32 119.30 111.40 2bze s MET -1 Ca 0.19 -1.52 -0.29 0.00 -1.71 0.00 0.00 55.69 52.36 2bze s MET -1 Cb 0.03 -1.27 -0.06 0.00 2.01 0.00 0.00 34.83 35.54 2bze s MET -1 CO 0.01 0.24 2.03 0.08 -0.01 0.00 0.00 175.02 177.37 2bze s VAL 345 N -2.51 3.13 -0.24 -6.03 1.01 0.88 -4.77 120.40 111.87 2bze s VAL 345 Ca 0.20 0.14 0.02 0.00 0.00 0.00 0.00 61.98 62.34 2bze s VAL 345 Cb -0.03 -3.14 0.02 0.00 0.00 0.00 0.00 36.38 33.24 2bze s VAL 345 CO 0.07 -0.06 0.67 -1.54 0.00 0.00 0.00 175.10 174.24 2bze n SER 346 N 9.70 1.38 -4.07 3.32 3.41 -1.26 -4.87 113.62 121.23 2bze n SER 346 Ca 0.24 -1.28 -0.20 0.00 -0.26 0.00 0.00 58.87 57.38 2bze n SER 346 Cb 0.44 -0.01 -0.15 0.00 -0.26 0.00 0.00 64.21 64.23 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 -0.34 2.04 0.03 1.04 1.43 -1.26 -5.00 118.68 116.62 2bze s LEU 347 Ca 0.03 -0.24 0.19 0.00 -1.03 0.00 0.00 54.13 53.08 2bze s LEU 347 Cb 0.02 -0.58 0.81 0.00 0.03 0.00 0.00 46.19 46.47 2bze s LEU 347 CO 0.03 0.12 1.61 -0.81 0.23 0.00 0.00 176.35 177.52 2bze n PRO 348 N 2.67 0.03 0.09 1.29 -0.04 -1.26 -2.50 135.00 135.27 2bze n PRO 348 Ca -0.14 0.21 -0.07 0.00 -0.04 0.00 0.00 63.50 63.45 2bze n PRO 348 Cb 0.56 -1.55 -0.03 0.00 -0.04 0.00 0.00 33.50 32.44 2bze n PRO 348 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2bze h GLU 349 N 0.00 0.10 0.10 0.54 4.11 -1.94 0.19 114.58 117.67 2bze h GLU 349 Ca 0.00 -0.12 -0.26 0.00 0.07 0.00 0.00 59.36 59.05 2bze h GLU 349 Cb 0.34 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2bze h GLU 349 CO 0.00 0.94 -1.18 0.93 0.07 0.00 0.00 179.01 179.77 2bze h GLU 350 N 0.05 0.22 0.00 1.06 4.39 -1.92 -1.75 114.58 116.62 2bze h GLU 350 Ca -0.03 -0.36 -0.08 0.00 0.34 0.00 0.00 59.36 59.23 2bze h GLU 350 Cb 1.58 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 30.35 2bze h GLU 350 CO 0.13 1.17 -0.36 1.25 -1.16 0.00 0.00 179.01 180.03 2bze h LEU 351 N 0.06 0.00 -0.14 1.33 7.12 -1.43 -2.67 115.31 119.59 2bze h LEU 351 Ca -0.10 0.00 -0.10 0.00 0.13 0.00 0.00 57.88 57.81 2bze h LEU 351 Cb 1.91 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 42.03 2bze h LEU 351 CO 0.19 0.36 -0.47 0.78 -0.13 0.00 0.00 178.44 179.17 2bze h ASN 352 N 0.00 0.00 1.16 1.25 2.35 -0.33 0.13 115.58 120.14 2bze h ASN 352 Ca -0.00 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 2bze h ASN 352 Cb 0.85 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.20 2bze h ASN 352 CO 0.05 0.47 -0.57 0.08 -1.65 0.00 0.00 177.43 175.81 2bze h ARG 353 N 0.00 0.00 -0.01 0.81 0.11 -0.99 -2.96 114.38 111.34 2bze h ARG 353 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bze h ARG 353 Cb 1.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.38 2bze h ARG 353 CO 0.06 0.57 -0.32 1.33 0.10 0.00 0.00 179.97 181.71 2bze n VAL 354 N -3.37 0.00 -1.68 0.08 0.24 -1.08 -4.62 118.33 107.90 2bze n VAL 354 Ca 0.01 -0.19 -0.45 0.00 -2.04 0.00 0.00 64.34 61.66 2bze n VAL 354 Cb 0.70 0.76 -0.04 0.00 -1.47 0.00 0.00 33.84 33.80 2bze n VAL 354 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2bze n ARG 355 N -0.31 2.38 -4.24 7.34 0.63 0.03 -3.14 116.66 119.34 2bze n ARG 355 Ca 0.11 0.86 -0.30 0.00 -0.92 0.00 0.00 57.85 57.60 2bze n ARG 355 Cb 0.40 -2.67 -0.09 0.00 0.45 0.00 0.00 32.46 30.55 2bze n ARG 355 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2bze s LEU 356 N 1.52 3.26 0.31 6.15 1.43 0.33 -4.97 118.68 126.71 2bze s LEU 356 Ca 0.80 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.69 2bze s LEU 356 Cb -0.62 -1.98 -0.06 0.00 0.03 0.00 0.00 46.19 43.56 2bze s LEU 356 CO 0.38 0.20 0.07 -0.44 0.23 0.00 0.00 176.35 176.79 2bze s SER 357 N -2.06 2.12 0.30 2.29 0.01 -1.26 -2.24 113.70 112.86 2bze s SER 357 Ca 0.22 -1.39 0.01 0.00 1.31 0.00 0.00 55.95 56.10 2bze s SER 357 Cb -0.11 -0.00 0.47 0.00 0.21 0.00 0.00 66.02 66.58 2bze s SER 357 CO 0.14 -0.65 1.82 0.08 0.41 0.00 0.00 173.24 175.05 2bze h ARG 358 N 2.16 0.67 0.00 12.44 0.11 -1.16 -1.92 114.38 126.69 2bze h ARG 358 Ca -0.40 -0.16 -0.10 0.00 0.10 0.00 0.00 59.98 59.42 2bze h ARG 358 Cb 1.25 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 32.22 2bze h ARG 358 CO 0.67 0.68 -0.49 1.25 0.10 0.00 0.00 179.97 182.18 2bze h HIS 359 N 0.64 0.00 -0.29 4.08 2.76 -1.91 0.22 115.15 120.65 2bze h HIS 359 Ca 0.13 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.23 2bze h HIS 359 Cb 0.37 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.32 2bze h HIS 359 CO 0.02 0.49 -0.12 0.87 -1.30 0.00 0.00 177.93 177.88 2bze h LYS 360 N 0.00 0.60 -0.55 5.26 1.57 -1.75 0.05 116.57 121.75 2bze h LYS 360 Ca -0.00 -0.25 -0.10 0.00 -1.87 0.00 0.00 60.65 58.42 2bze h LYS 360 Cb 0.94 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.20 2bze h LYS 360 CO 0.06 0.82 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.66 2bze h LEU 361 N 0.36 0.99 -1.03 2.94 3.38 -1.12 -1.36 115.31 119.46 2bze h LEU 361 Ca 0.07 -0.32 0.05 0.00 0.09 0.00 0.00 57.88 57.76 2bze h LEU 361 Cb 0.63 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 2bze h LEU 361 CO 0.04 1.07 0.65 -0.08 0.09 0.00 0.00 178.44 180.21 2bze h GLU 362 N 0.88 1.18 0.00 1.13 4.81 -0.36 0.11 114.58 122.32 2bze h GLU 362 Ca 0.15 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2bze h GLU 362 Cb 0.59 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.70 2bze h GLU 362 CO 0.04 0.78 -0.42 2.89 -0.73 0.00 0.00 179.01 181.57 2bze n ARG 363 N -4.46 0.10 0.00 1.92 1.85 -0.01 -3.02 116.66 113.04 2bze n ARG 363 Ca 0.14 0.04 0.11 0.00 -1.00 0.00 0.00 57.85 57.14 2bze n ARG 363 Cb 0.13 -1.57 0.03 0.00 -1.05 0.00 0.00 32.46 30.00 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 -1.73 0.00 -0.03 2.89 8.01 -0.55 -4.09 117.44 121.94 2bze n TRP 364 Ca 0.05 0.00 -0.08 0.00 -1.31 0.00 0.00 57.50 56.16 2bze n TRP 364 Cb 0.37 -0.01 0.08 0.00 -2.01 0.00 0.00 31.31 29.75 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 0.54 0.00 -3.62 0.00 2.07 -1.73 -3.45 115.15 108.95 2bze h HIS 366 Ca 0.05 0.00 -0.42 0.00 -2.85 0.00 0.00 60.37 57.15 2bze h HIS 366 Cb 0.89 0.00 0.18 0.00 2.57 0.00 0.00 27.41 31.06 2bze h HIS 366 CO 0.04 0.27 0.19 -1.64 -3.07 0.00 0.00 177.93 173.73 2bze s MET 367 N -3.07 -0.80 0.00 5.12 1.00 -0.88 -5.07 119.30 115.59 2bze s MET 367 Ca 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 55.69 55.62 2bze s MET 367 Cb 0.06 -1.65 0.00 0.00 0.00 0.00 0.00 34.83 33.24 2bze s MET 367 CO 0.71 -3.42 0.00 -2.30 0.00 0.00 0.00 175.02 170.01 2bze n PRO 368 N -4.54 -0.19 -1.81 2.03 -0.02 -1.26 -4.86 135.00 124.34 2bze n PRO 368 Ca 0.13 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.22 2bze n PRO 368 Cb 0.59 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 0.12 1.98 0.00 0.00 175.50 177.60 2bze s PHE 369 N -0.64 1.44 -2.51 6.00 5.99 -1.26 -4.80 117.98 122.20 2bze s PHE 369 Ca 0.00 0.94 0.25 0.00 0.00 0.00 0.00 56.93 58.12 2bze s PHE 369 Cb 0.00 -3.92 0.77 0.00 0.00 0.00 0.00 43.02 39.87 2bze s PHE 369 CO 0.00 -2.83 1.58 1.97 -0.00 0.00 0.00 175.22 175.94 2bze n PHE 370 N 12.91 0.11 -0.05 10.12 1.16 -1.26 -4.36 117.46 136.09 2bze n PHE 370 Ca 0.27 -0.05 0.14 0.00 -1.87 0.00 0.00 57.45 55.94 2bze n PHE 370 Cb 0.50 0.00 0.56 0.00 -1.61 0.00 0.00 39.48 38.93 2bze n PHE 370 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2bze h ALA 371 N 4.33 2.14 -0.47 1.98 0.00 -1.95 0.63 119.26 125.93 2bze h ALA 371 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2bze h ALA 371 Cb 0.62 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2bze h ALA 371 CO 0.00 -0.28 -0.10 -0.22 0.00 0.00 0.00 179.25 178.65 2bze h LYS 372 N 0.28 0.89 -0.13 0.00 3.11 -1.92 0.85 116.57 119.65 2bze h LYS 372 Ca 0.26 -0.33 -0.19 0.00 -2.81 0.00 0.00 60.65 57.57 2bze h LYS 372 Cb 0.65 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 31.83 2bze h LYS 372 CO -0.06 0.98 -0.71 1.15 -2.81 0.00 0.00 179.45 178.00 2bze h THR 373 N 0.73 1.33 0.00 1.00 2.02 -1.30 -3.26 112.91 113.43 2bze h THR 373 Ca 0.12 -2.01 -0.19 0.00 0.77 0.00 0.00 66.41 65.10 2bze h THR 373 Cb 0.64 1.99 -0.03 0.00 -1.74 0.00 0.00 68.15 69.01 2bze h THR 373 CO 0.04 0.62 -1.16 -0.37 0.37 0.00 0.00 175.52 175.02 2bze h VAL 374 N 0.41 0.96 -2.70 3.16 -1.51 -0.85 -3.42 116.25 112.30 2bze h VAL 374 Ca -0.03 -2.55 -0.57 0.00 -1.23 0.00 0.00 66.70 62.32 2bze h VAL 374 Cb 1.30 2.41 -0.02 0.00 -2.13 0.00 0.00 31.29 32.84 2bze h VAL 374 CO 0.13 0.55 1.17 -0.89 -1.23 0.00 0.00 177.57 177.29 2bze s THR 375 N -2.81 3.60 0.00 7.19 2.01 0.28 -1.00 115.64 124.91 2bze s THR 375 Ca -0.01 0.67 0.00 0.00 0.31 0.00 0.00 61.69 62.67 2bze s THR 375 Cb 0.09 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 68.96 2bze s THR 375 CO 0.80 -0.28 0.00 0.61 -0.69 0.00 0.00 174.62 175.06 2bze n GLY 376 N 4.79 2.32 3.96 4.40 0.00 -0.86 -4.94 105.19 114.86 2bze n GLY 376 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.77 2.34 0.08 0.00 0.08120.98 -0.64 117.98 238.06 2bze s PHE 378 Ca 0.55 -0.40 0.08 0.00 0.12 0.00 0.00 56.93 57.27 2bze s PHE 378 Cb -0.10 -1.42 -0.04 0.00 -0.57 0.00 0.00 43.02 40.89 2bze s PHE 378 CO 0.39 0.11 -0.15 0.54 -0.10 0.00 0.00 175.22 176.01 2bze s VAL 379 N -0.78 3.02 -0.53 -0.44 0.11 0.59 -0.51 120.40 121.86 2bze s VAL 379 Ca 0.12 -1.30 -0.23 0.00 -2.93 0.00 0.00 61.98 57.63 2bze s VAL 379 Cb -0.10 -2.36 0.04 0.00 -1.53 0.00 0.00 36.38 32.44 2bze s VAL 379 CO 0.02 0.19 0.86 -0.60 -3.33 0.00 0.00 175.10 172.23 2bze s ARG 380 N -1.91 3.29 0.11 1.54 6.06 -0.95 -2.13 118.95 124.95 2bze s ARG 380 Ca 0.18 -0.40 0.07 0.00 -2.50 0.00 0.00 55.73 53.08 2bze s ARG 380 Cb -0.11 -4.06 -0.04 0.00 0.06 0.00 0.00 34.95 30.81 2bze s ARG 380 CO 0.10 -1.40 -0.19 -1.50 -2.50 0.00 0.00 175.30 169.81 2bze s ILE 381 N 3.59 1.58 -0.32 4.11 1.10 -1.06 -0.83 121.20 129.36 2bze s ILE 381 Ca 0.27 -1.57 -0.16 0.00 -0.51 0.00 0.00 60.65 58.68 2bze s ILE 381 Cb -0.14 -1.50 -0.02 0.00 0.15 0.00 0.00 42.46 40.95 2bze s ILE 381 CO 0.18 -0.16 0.40 -0.83 -2.11 0.00 0.00 174.94 172.42 2bze s GLY 382 N -2.04 1.87 -0.29 1.50 0.00 -1.25 -0.41 107.32 106.70 2bze s GLY 382 Ca 0.06 -1.05 0.02 0.00 0.00 0.00 0.00 44.72 43.75 2bze s GLY 382 CO 0.04 1.06 0.01 -0.26 0.00 0.00 0.00 173.10 173.95 2bze s ILE 383 N 2.13 1.70 0.00 0.90 -4.36 0.69 -4.70 121.20 117.56 2bze s ILE 383 Ca 0.14 -1.69 0.00 0.00 -0.26 0.00 0.00 60.65 58.84 2bze s ILE 383 Cb -0.16 -2.12 0.00 0.00 1.25 0.00 0.00 42.46 41.43 2bze s ILE 383 CO 0.12 -0.40 0.00 0.61 0.24 0.00 0.00 174.94 175.51 2bze n GLY 384 N 4.54 0.61 2.69 6.27 0.00 -1.26 -4.30 105.19 113.74 2bze n GLY 384 Ca -0.04 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.62 3.46 0.00 1.61 3.04 -1.26 -1.01 114.94 120.15 2bze s ASN 385 Ca 0.00 -3.03 0.00 0.00 0.04 0.00 0.00 52.86 49.87 2bze s ASN 385 Cb 0.00 -1.06 0.00 0.00 -1.54 0.00 0.00 41.25 38.65 2bze s ASN 385 CO 0.00 -0.20 0.00 1.57 -3.04 0.00 0.00 177.10 175.43 2bze n HIS 386 N 3.00 -1.08 0.17 0.43 -0.00 -1.26 -4.97 115.22 111.52 2bze n HIS 386 Ca 0.16 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.20 2bze n HIS 386 Cb 0.38 0.22 -0.08 0.00 -0.12 0.00 0.00 29.99 30.38 2bze n HIS 386 CO 0.00 0.00 0.00 -0.91 0.46 0.00 0.00 176.34 175.89 2bze h ASN 387 N 0.00 -0.34 0.00 0.26 4.21 -2.04 -3.48 115.58 114.19 2bze h ASN 387 Ca 0.00 -0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.45 2bze h ASN 387 Cb 0.00 0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.29 2bze h ASN 387 CO 0.00 -0.15 0.00 -0.24 -1.29 0.00 0.00 177.43 175.75 2bze n SER 388 N -5.22 0.00 -4.71 5.81 2.88 -1.26 -5.12 113.62 106.01 2bze n SER 388 Ca -0.10 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.02 2bze n SER 388 Cb 0.21 0.13 -0.03 0.00 -0.75 0.00 0.00 64.21 63.77 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 -0.92 4.51 -0.42 -1.46 -2.85 -1.26 -4.98 119.74 112.35 2bze s LYS 389 Ca 0.00 1.50 -0.29 0.00 -1.00 0.00 0.00 55.97 56.18 2bze s LYS 389 Cb 0.00 -3.45 0.01 0.00 -2.06 0.00 0.00 37.83 32.33 2bze s LYS 389 CO 0.00 -0.14 1.46 -1.25 0.10 0.00 0.00 175.35 175.53 2bze s PRO 390 N 1.17 3.50 -0.83 1.78 0.04 -1.26 -4.45 135.00 134.95 2bze s PRO 390 Ca 0.53 0.93 -0.24 0.00 0.04 0.00 0.00 61.00 62.26 2bze s PRO 390 Cb -0.23 -4.06 0.06 0.00 0.04 0.00 0.00 34.50 30.31 2bze s PRO 390 CO 0.27 -1.66 1.23 0.08 0.04 0.00 0.00 177.00 176.96 2bze s VAL 391 N 5.73 4.07 -0.03 -0.36 1.01 -0.18 -4.93 120.40 125.71 2bze s VAL 391 Ca 0.62 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.92 2bze s VAL 391 Cb -0.14 -4.88 -0.03 0.00 0.00 0.00 0.00 36.38 31.33 2bze s VAL 391 CO 0.32 -1.74 1.03 -0.31 0.00 0.00 0.00 175.10 174.41 2bze s TYR 392 N 4.68 3.55 0.32 5.22 2.02 -1.26 -0.22 117.35 131.65 2bze s TYR 392 Ca 0.35 1.58 0.03 0.00 -0.37 0.00 0.00 57.07 58.66 2bze s TYR 392 Cb -0.07 -3.20 -0.02 0.00 -0.40 0.00 0.00 41.96 38.26 2bze s TYR 392 CO 0.03 -0.34 0.32 1.03 -1.57 0.00 0.00 175.55 175.02 2bze s ARG 393 N 1.44 1.73 -0.23 -0.62 0.52 0.45 -4.91 118.95 117.33 2bze s ARG 393 Ca 0.52 -1.89 -0.20 0.00 -0.52 0.00 0.00 55.73 53.63 2bze s ARG 393 Cb -0.21 0.35 -0.02 0.00 0.52 0.00 0.00 34.95 35.59 2bze s ARG 393 CO 0.24 -0.66 0.63 0.08 0.02 0.00 0.00 175.30 175.61 2bze s VAL 394 N -3.43 5.00 -0.07 3.52 1.01 -1.26 -2.56 120.40 122.61 2bze s VAL 394 Ca 0.38 1.15 0.04 0.00 0.00 0.00 0.00 61.98 63.55 2bze s VAL 394 Cb 0.02 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2bze s VAL 394 CO 0.24 0.07 -0.18 0.00 0.00 0.00 0.00 175.10 175.22 2bze s ALA 395 N 2.23 1.66 0.17 5.51 0.00 -0.91 -4.47 121.76 125.96 2bze s ALA 395 Ca 0.27 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 2bze s ALA 395 Cb -0.16 -0.61 -0.07 0.00 0.00 0.00 0.00 23.12 22.28 2bze s ALA 395 CO 0.09 0.24 1.03 -2.00 0.00 0.00 0.00 175.76 175.12 2bze s GLU 396 N 0.28 4.67 -0.29 0.00 2.12 0.12 -0.43 118.70 125.18 2bze s GLU 396 Ca -0.11 1.60 -0.26 0.00 0.36 0.00 0.00 54.97 56.56 2bze s GLU 396 Cb -0.15 -3.31 0.00 0.00 0.26 0.00 0.00 34.13 30.94 2bze s GLU 396 CO 0.04 0.20 0.89 0.42 -0.54 0.00 0.00 175.26 176.28 2bze s ILE 397 N -0.37 4.72 -0.75 -3.70 1.01 0.19 -0.65 121.20 121.65 2bze s ILE 397 Ca 0.47 1.48 0.01 0.00 0.00 0.00 0.00 60.65 62.61 2bze s ILE 397 Cb -0.27 -4.22 0.19 0.00 0.01 0.00 0.00 42.46 38.17 2bze s ILE 397 CO 0.33 -0.26 0.58 0.42 0.00 0.00 0.00 174.94 176.01 2bze s THR 398 N 3.12 3.62 0.06 2.92 -4.23 0.12 -2.02 115.64 119.23 2bze s THR 398 Ca 0.37 -3.78 0.00 0.00 -1.18 0.00 0.00 61.69 57.10 2bze s THR 398 Cb -0.14 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.38 2bze s THR 398 CO 0.11 -1.00 0.00 0.61 -0.54 0.00 0.00 174.62 173.81 2bze n GLY 399 N 2.50 -1.76 3.10 3.99 0.00 -1.26 -2.38 105.19 109.39 2bze n GLY 399 Ca 0.17 -1.27 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.59 1.65 0.04 1.61 1.01 -1.26 -2.06 120.40 120.80 2bze s VAL 400 Ca 0.00 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.30 2bze s VAL 400 Cb 0.00 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 2bze s VAL 400 CO 0.00 0.47 -0.16 0.68 0.00 0.00 0.00 175.10 176.09 2bze s VAL 401 N 0.81 2.98 -0.07 2.92 -7.23 -0.65 -4.91 120.40 114.26 2bze s VAL 401 Ca -0.10 -1.12 -0.12 0.00 -1.81 0.00 0.00 61.98 58.83 2bze s VAL 401 Cb -0.16 -2.27 -0.05 0.00 0.56 0.00 0.00 36.38 34.46 2bze s VAL 401 CO 0.01 0.33 0.31 -1.61 -0.31 0.00 0.00 175.10 173.83 2bze s GLU 402 N -1.48 3.86 0.48 4.82 2.02 -1.26 0.64 118.70 127.77 2bze s GLU 402 Ca 0.15 0.20 0.08 0.00 0.02 0.00 0.00 54.97 55.43 2bze s GLU 402 Cb -0.11 -3.26 0.03 0.00 0.10 0.00 0.00 34.13 30.90 2bze s GLU 402 CO 0.06 0.62 0.60 0.95 0.02 0.00 0.00 175.26 177.51 2bze s THR 403 N -0.74 2.57 -2.71 3.63 -4.23 0.15 -4.90 115.64 109.42 2bze s THR 403 Ca 0.20 -1.09 0.26 0.00 -1.18 0.00 0.00 61.69 59.89 2bze s THR 403 Cb -0.15 -2.65 0.40 0.00 1.34 0.00 0.00 72.50 71.44 2bze s THR 403 CO 0.09 0.00 1.54 0.00 -0.54 0.00 0.00 174.62 175.71 2bze n ALA 404 N -1.93 2.53 -3.94 3.99 0.00 -1.26 -4.76 120.51 115.14 2bze n ALA 404 Ca 0.09 -0.55 -0.28 0.00 0.00 0.00 0.00 53.44 52.70 2bze n ALA 404 Cb 0.61 -1.02 -0.17 0.00 0.00 0.00 0.00 19.45 18.87 2bze n ALA 404 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2bze s LYS 405 N -2.00 1.74 -0.07 0.00 2.36 -1.26 -5.08 119.74 115.42 2bze s LYS 405 Ca 0.34 -0.41 -0.30 0.00 -2.55 0.00 0.00 55.97 53.05 2bze s LYS 405 Cb 0.21 -1.84 -0.02 0.00 -1.05 0.00 0.00 37.83 35.13 2bze s LYS 405 CO 0.32 -0.29 1.07 0.08 1.55 0.00 0.00 175.35 178.08 2bze s VAL 406 N 1.62 4.60 0.40 4.02 1.01 -1.26 -4.31 120.40 126.49 2bze s VAL 406 Ca 0.04 1.88 0.08 0.00 0.00 0.00 0.00 61.98 63.98 2bze s VAL 406 Cb -0.13 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 2bze s VAL 406 CO -0.09 0.02 0.27 -0.72 0.00 0.00 0.00 175.10 174.58 2bze s TYR 407 N 1.94 2.67 -0.35 5.22 -0.85 -0.06 -4.85 117.35 121.07 2bze s TYR 407 Ca 0.51 -0.51 -0.09 0.00 -0.52 0.00 0.00 57.07 56.46 2bze s TYR 407 Cb -0.21 -2.02 0.02 0.00 0.38 0.00 0.00 41.96 40.13 2bze s TYR 407 CO 0.21 0.06 0.16 -1.14 -1.52 0.00 0.00 175.55 173.32 2bze s GLN 408 N -4.01 2.85 0.38 -3.49 -0.44 -1.26 -2.45 119.66 111.25 2bze s GLN 408 Ca 0.44 -1.04 0.07 0.00 -2.50 0.00 0.00 55.36 52.32 2bze s GLN 408 Cb -0.00 -3.61 -0.07 0.00 -1.64 0.00 0.00 33.01 27.69 2bze s GLN 408 CO 0.25 -0.63 0.01 -1.17 0.50 0.00 0.00 175.29 174.24 2bze s LEU 409 N 1.52 2.68 -0.03 3.68 2.96 -1.12 -4.98 118.68 123.39 2bze s LEU 409 Ca 0.01 -1.34 -0.33 0.00 -0.22 0.00 0.00 54.13 52.25 2bze s LEU 409 Cb -0.19 -0.78 -0.16 0.00 0.50 0.00 0.00 46.19 45.56 2bze s LEU 409 CO 0.05 -0.45 0.90 0.61 -1.32 0.00 0.00 176.35 176.14 2bze n GLY 410 N -0.87 -0.19 3.54 7.98 0.00 -1.26 -2.03 105.19 112.35 2bze n GLY 410 Ca -0.04 0.63 -0.18 0.00 0.00 0.00 0.00 46.02 46.42 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 1.38 -0.24 3.08 -0.02 0.00 -1.26 -4.85 105.19 103.28 2bze n GLY 411 Ca 0.17 0.28 -0.10 0.00 0.00 0.00 0.00 46.02 46.36 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 10.13 0.42 -0.28 2.61 -1.32 -0.86 -5.10 115.64 121.23 2bze s THR 412 Ca 1.06 -1.44 -0.01 0.00 -1.21 0.00 0.00 61.69 60.10 2bze s THR 412 Cb -0.39 -1.03 0.09 0.00 -1.51 0.00 0.00 72.50 69.66 2bze s THR 412 CO 0.25 -0.68 0.06 -0.13 -2.21 0.00 0.00 174.62 171.91 2bze s ARG 413 N -2.69 0.91 0.01 7.08 3.00 -1.26 -2.78 118.95 123.22 2bze s ARG 413 Ca -0.02 -1.01 0.01 0.00 0.00 0.00 0.00 55.73 54.72 2bze s ARG 413 Cb -0.02 -2.21 -0.01 0.00 0.00 0.00 0.00 34.95 32.71 2bze s ARG 413 CO -0.04 -0.86 -0.05 -0.08 0.00 0.00 0.00 175.30 174.27 2bze s THR 414 N 1.56 0.37 -0.79 0.02 -1.32 -1.03 -4.87 115.64 109.58 2bze s THR 414 Ca 0.06 -0.44 -0.01 0.00 -1.21 0.00 0.00 61.69 60.09 2bze s THR 414 Cb -0.18 -0.36 0.36 0.00 -1.51 0.00 0.00 72.50 70.81 2bze s THR 414 CO -0.18 -0.06 1.84 -0.46 -2.21 0.00 0.00 174.62 173.56 2bze n ASN 415 N 2.52 7.01 -3.89 8.08 6.94 -1.26 -0.88 115.26 133.78 2bze n ASN 415 Ca -0.16 -3.80 -0.15 0.00 -0.02 0.00 0.00 54.58 50.45 2bze n ASN 415 Cb 0.57 -0.97 -0.15 0.00 -2.36 0.00 0.00 39.78 36.88 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 0.23 0.00 -3.83 0.00 -1.26 0.34 119.74 111.21 2bze s LYS 416 Ca 0.50 -0.05 0.00 0.00 0.00 0.00 0.00 55.97 56.42 2bze s LYS 416 Cb 0.41 -0.27 0.00 0.00 0.00 0.00 0.00 37.83 37.97 2bze s LYS 416 CO -0.35 0.01 0.00 0.41 0.00 0.00 0.00 175.35 175.41 2bze n GLY 417 N 3.31 3.39 3.32 0.59 0.00 0.21 -4.48 105.19 111.52 2bze n GLY 417 Ca -0.16 -2.17 -0.22 0.00 0.00 0.00 0.00 46.02 43.46 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 2.40 -0.42 0.99 1.43 -0.90 -1.63 118.68 120.54 2bze s LEU 418 Ca 0.00 -0.81 -0.22 0.00 -1.03 0.00 0.00 54.13 52.07 2bze s LEU 418 Cb 0.00 -0.83 0.02 0.00 0.03 0.00 0.00 46.19 45.41 2bze s LEU 418 CO 0.00 -0.01 0.69 -1.58 0.23 0.00 0.00 176.35 175.68 2bze s GLN 419 N -2.54 3.42 0.02 1.70 2.00 -0.87 -2.27 119.66 121.12 2bze s GLN 419 Ca 0.13 -0.17 -0.05 0.00 -2.00 0.00 0.00 55.36 53.27 2bze s GLN 419 Cb -0.07 -3.91 -0.04 0.00 0.80 0.00 0.00 33.01 29.78 2bze s GLN 419 CO 0.06 -0.98 0.24 -0.51 -0.50 0.00 0.00 175.29 173.60 2bze s LEU 420 N 2.96 4.36 -0.04 3.68 1.43 0.62 0.10 118.68 131.79 2bze s LEU 420 Ca 0.26 0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 53.81 2bze s LEU 420 Cb -0.13 -2.72 0.03 0.00 0.03 0.00 0.00 46.19 43.39 2bze s LEU 420 CO 0.19 0.24 0.04 -0.60 0.23 0.00 0.00 176.35 176.45 2bze s ARG 421 N -1.94 0.09 -0.76 1.70 3.52 0.18 -0.53 118.95 121.22 2bze s ARG 421 Ca 0.29 0.26 -0.07 0.00 -0.13 0.00 0.00 55.73 56.08 2bze s ARG 421 Cb -0.13 -0.54 0.20 0.00 -1.56 0.00 0.00 34.95 32.91 2bze s ARG 421 CO 0.18 -0.27 0.63 -1.58 -0.81 0.00 0.00 175.30 173.45 2bze s HIS 422 N 1.81 3.63 0.00 5.12 5.65 -0.85 0.13 115.29 130.77 2bze s HIS 422 Ca 0.01 -2.50 0.00 0.00 0.25 0.00 0.00 55.06 52.82 2bze s HIS 422 Cb -0.12 -3.46 0.00 0.00 -1.18 0.00 0.00 32.58 27.82 2bze s HIS 422 CO -0.03 -0.89 0.00 0.41 -0.65 0.00 0.00 174.74 173.58 2bze n GLY 423 N 3.47 1.96 3.01 1.59 0.00 -1.26 -3.16 105.19 110.81 2bze n GLY 423 Ca 0.12 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 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 5.31 -0.29 1.61 0.01 -1.26 -4.86 114.94 111.46 2bze s ASN 424 Ca 0.00 -3.62 -0.03 0.00 -0.71 0.00 0.00 52.86 48.50 2bze s ASN 424 Cb 0.00 -1.77 0.11 0.00 0.41 0.00 0.00 41.25 40.00 2bze s ASN 424 CO 0.00 -0.17 0.17 -0.62 -1.51 0.00 0.00 177.10 174.97 2bze s ASP 425 N -0.59 3.11 -0.37 -1.22 -1.08 -1.19 -5.03 116.67 110.29 2bze s ASP 425 Ca 0.24 -1.20 -0.08 0.00 -0.52 0.00 0.00 52.55 50.99 2bze s ASP 425 Cb -0.09 -0.16 0.05 0.00 -1.46 0.00 0.00 42.92 41.26 2bze s ASP 425 CO -0.12 -0.43 0.18 -1.58 0.52 0.00 0.00 175.17 173.74 2bze s GLN 426 N 2.13 2.65 0.38 4.34 0.74 -1.26 -2.02 119.66 126.63 2bze s GLN 426 Ca 0.09 -1.25 0.04 0.00 0.05 0.00 0.00 55.36 54.29 2bze s GLN 426 Cb -0.16 -3.63 -0.03 0.00 1.10 0.00 0.00 33.01 30.29 2bze s GLN 426 CO -0.35 -0.77 0.13 1.03 -0.55 0.00 0.00 175.29 174.77 2bze s ARG 427 N 1.44 1.84 -0.10 1.67 0.52 0.31 -4.98 118.95 119.66 2bze s ARG 427 Ca 0.01 -2.10 0.00 0.00 -0.52 0.00 0.00 55.73 53.12 2bze s ARG 427 Cb -0.21 -0.55 -0.02 0.00 0.52 0.00 0.00 34.95 34.69 2bze s ARG 427 CO 0.03 -0.44 -0.10 0.08 0.02 0.00 0.00 175.30 174.89 2bze s VAL 428 N -3.28 3.34 0.01 3.52 1.01 -1.26 -0.27 120.40 123.46 2bze s VAL 428 Ca 0.27 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.70 2bze s VAL 428 Cb 0.04 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 2bze s VAL 428 CO 0.15 0.55 -0.11 -0.36 0.00 0.00 0.00 175.10 175.34 2bze s PHE 429 N -0.18 0.94 0.55 5.22 0.40 -0.96 -4.90 117.98 119.05 2bze s PHE 429 Ca 0.01 -0.26 -0.12 0.00 -0.60 0.00 0.00 56.93 55.96 2bze s PHE 429 Cb -0.13 -0.58 -0.05 0.00 0.51 0.00 0.00 43.02 42.76 2bze s PHE 429 CO 0.03 -0.01 0.96 1.03 0.70 0.00 0.00 175.22 177.94 2bze s ARG 430 N -0.69 3.70 0.55 0.44 0.52 -1.26 -2.13 118.95 120.08 2bze s ARG 430 Ca 0.01 0.71 0.33 0.00 -0.52 0.00 0.00 55.73 56.26 2bze s ARG 430 Cb -0.06 -2.16 1.42 0.00 0.52 0.00 0.00 34.95 34.67 2bze s ARG 430 CO 0.00 -0.39 2.01 -0.07 0.02 0.00 0.00 175.30 176.87 2bze h LEU 431 N 0.23 0.00 -1.24 2.53 3.38 -1.96 -2.44 115.31 115.81 2bze h LEU 431 Ca -0.45 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 2bze h LEU 431 Cb 1.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2bze h LEU 431 CO 0.62 0.04 -0.00 1.05 0.09 0.00 0.00 178.44 180.23 2bze h GLU 432 N 0.00 0.00 -0.01 1.13 4.11 -1.93 -2.68 114.58 115.20 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 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2bze h GLU 432 CO 0.01 0.00 -0.29 1.19 0.07 0.00 0.00 179.01 179.99 2bze n PHE 433 N -3.10 0.00 -2.58 2.06 3.72 -0.92 -4.92 117.46 111.72 2bze n PHE 433 Ca 0.01 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.07 2bze n PHE 433 Cb 0.34 -0.07 -0.04 0.00 -0.94 0.00 0.00 39.48 38.77 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 -2.43 3.86 0.77 -4.37 1.01 -1.01 -3.78 120.40 114.44 2bze s VAL 434 Ca 0.24 1.19 -0.07 0.00 0.00 0.00 0.00 61.98 63.34 2bze s VAL 434 Cb 0.19 -3.50 0.12 0.00 0.00 0.00 0.00 36.38 33.19 2bze s VAL 434 CO 0.51 -0.22 1.08 -0.44 0.00 0.00 0.00 175.10 176.04 2bze s SER 435 N -1.95 4.21 0.00 3.32 0.01 -0.01 -4.48 113.70 114.80 2bze s SER 435 Ca 0.65 0.11 0.00 0.00 1.31 0.00 0.00 55.95 58.02 2bze s SER 435 Cb -0.16 -0.51 0.00 0.00 0.21 0.00 0.00 66.02 65.56 2bze s SER 435 CO 0.20 -1.98 0.49 -0.46 0.41 0.00 0.00 173.24 171.90 2bze n ASN 436 N -3.10 0.90 -4.98 2.44 0.23 -1.26 -0.74 115.26 108.75 2bze n ASN 436 Ca 0.12 -1.19 -0.20 0.00 -0.53 0.00 0.00 54.58 52.78 2bze n ASN 436 Cb 0.60 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.30 2bze n ASN 436 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2bze s GLN 437 N -0.19 3.08 0.80 -3.83 0.00 -1.26 -5.01 119.66 113.25 2bze s GLN 437 Ca 0.00 -0.83 -0.06 0.00 -0.00 0.00 0.00 55.36 54.47 2bze s GLN 437 Cb 0.00 -2.72 0.15 0.00 0.00 0.00 0.00 33.01 30.44 2bze s GLN 437 CO 0.00 -0.08 1.11 -1.21 0.00 0.00 0.00 175.29 175.11 2bze s GLU 438 N -4.32 1.32 0.32 9.60 2.02 -1.26 -4.86 118.70 121.51 2bze s GLU 438 Ca 0.47 -0.88 -0.01 0.00 0.02 0.00 0.00 54.97 54.57 2bze s GLU 438 Cb -0.10 -2.17 -0.04 0.00 0.10 0.00 0.00 34.13 31.93 2bze s GLU 438 CO 0.34 -1.78 0.54 -0.06 0.02 0.00 0.00 175.26 174.32 2bze s PHE 439 N -3.40 3.50 0.41 1.61 0.08 -1.26 -5.09 117.98 113.83 2bze s PHE 439 Ca 0.69 0.44 0.05 0.00 0.12 0.00 0.00 56.93 58.22 2bze s PHE 439 Cb -0.05 -1.96 -0.05 0.00 -0.57 0.00 0.00 43.02 40.39 2bze s PHE 439 CO 0.47 0.15 0.03 0.95 -0.10 0.00 0.00 175.22 176.72 2bze s THR 440 N -2.23 1.46 0.24 0.64 -4.23 -1.26 -4.94 115.64 105.33 2bze s THR 440 Ca 0.41 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.86 2bze s THR 440 Cb -0.10 -2.68 0.21 0.00 1.34 0.00 0.00 72.50 71.27 2bze s THR 440 CO 0.34 0.00 1.87 1.05 -0.54 0.00 0.00 174.62 177.34 2bze h GLU 441 N 1.75 1.01 -0.50 3.99 9.09 -1.98 0.18 114.58 128.12 2bze h GLU 441 Ca -0.42 -0.06 -0.04 0.00 0.05 0.00 0.00 59.36 58.89 2bze h GLU 441 Cb 1.26 -0.23 -0.02 0.00 -1.65 0.00 0.00 28.75 28.11 2bze h GLU 441 CO 0.74 0.67 0.16 0.77 0.05 0.00 0.00 179.01 181.39 2bze h SER 442 N 1.04 0.72 -0.48 3.06 0.02 -1.99 0.16 113.55 116.09 2bze h SER 442 Ca 0.36 -0.21 -0.08 0.00 -0.84 0.00 0.00 61.79 61.02 2bze h SER 442 Cb 0.08 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 2bze h SER 442 CO -0.14 0.74 -0.02 -0.33 -1.14 0.00 0.00 176.83 175.94 2bze h GLU 443 N 0.67 0.86 -0.17 3.45 4.39 -1.82 -2.16 114.58 119.79 2bze h GLU 443 Ca 0.16 -0.28 0.02 0.00 0.34 0.00 0.00 59.36 59.59 2bze h GLU 443 Cb 0.27 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2bze h GLU 443 CO -0.01 0.91 0.06 0.35 -1.16 0.00 0.00 179.01 179.17 2bze h PHE 444 N 0.71 0.11 -0.97 4.33 3.04 -0.26 -2.36 116.94 121.54 2bze h PHE 444 Ca 0.13 0.01 0.06 0.00 3.98 0.00 0.00 57.97 62.15 2bze h PHE 444 Cb 0.53 -0.03 -0.06 0.00 2.56 0.00 0.00 35.95 38.95 2bze h PHE 444 CO 0.04 0.06 0.62 0.52 -2.02 0.00 0.00 178.31 177.53 2bze h MET 445 N 0.15 1.11 -0.63 1.11 2.86 -0.45 0.20 114.93 119.27 2bze h MET 445 Ca 0.07 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2bze h MET 445 Cb 0.04 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.42 2bze h MET 445 CO -0.07 0.74 0.36 0.87 1.06 0.00 0.00 176.91 179.87 2bze h LYS 446 N 1.14 0.87 -0.20 1.72 1.57 -1.18 -0.13 116.57 120.36 2bze h LYS 446 Ca 0.41 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 59.03 2bze h LYS 446 Cb 0.13 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 2bze h LYS 446 CO -0.16 0.64 -0.13 2.35 -0.57 0.00 0.00 179.45 181.58 2bze h TRP 447 N 0.85 0.52 -0.48 -1.35 7.01 -0.80 -1.75 115.95 119.96 2bze h TRP 447 Ca 0.22 -0.14 0.09 0.00 2.11 0.00 0.00 58.89 61.18 2bze h TRP 447 Cb 0.01 -0.12 -0.08 0.00 -2.10 0.00 0.00 29.16 26.87 2bze h TRP 447 CO -0.01 0.76 -0.05 -0.22 -2.79 0.00 0.00 178.44 176.12 2bze h LYS 448 N 0.13 0.06 0.00 2.65 1.63 -0.41 0.85 116.57 121.48 2bze h LYS 448 Ca 0.04 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2bze h LYS 448 Cb 0.64 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 2bze h LYS 448 CO 0.04 0.04 0.00 1.05 -3.45 0.00 0.00 179.45 177.12 2bze h GLU 449 N 0.06 0.00 0.01 1.90 4.11 -0.86 0.14 114.58 119.95 2bze h GLU 449 Ca 0.24 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.63 2bze h GLU 449 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2bze h GLU 449 CO -0.44 0.00 -0.14 0.00 0.07 0.00 0.00 179.01 178.50 2bze h ALA 450 N 2.03 -0.00 -0.62 1.06 0.00 -0.13 -1.47 119.26 120.13 2bze h ALA 450 Ca 0.00 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 2bze h ALA 450 Cb 0.47 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2bze h ALA 450 CO 0.00 0.03 0.15 0.52 0.00 0.00 0.00 179.25 179.95 2bze h MET 451 N -0.76 0.99 -0.40 0.00 2.86 -0.61 0.11 114.93 117.11 2bze h MET 451 Ca -0.02 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.37 2bze h MET 451 Cb 1.01 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.52 2bze h MET 451 CO 0.03 0.90 0.22 0.35 1.06 0.00 0.00 176.91 179.47 2bze h PHE 452 N 0.90 0.55 0.00 -0.22 3.57 -0.80 0.32 116.94 121.26 2bze h PHE 452 Ca 0.19 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 2bze h PHE 452 Cb 0.36 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.92 2bze h PHE 452 CO 0.03 0.42 -0.09 1.03 -2.23 0.00 0.00 178.31 177.47 2bze h SER 453 N 0.52 0.00 1.01 0.41 0.87 -0.92 -2.66 113.55 112.79 2bze h SER 453 Ca 0.14 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.50 2bze h SER 453 Cb 0.05 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 2bze h SER 453 CO -0.02 0.09 -1.02 0.00 -0.53 0.00 0.00 176.83 175.34 2bze h ALA 454 N 1.91 0.46 0.00 6.23 0.00 -0.15 -3.47 119.26 124.25 2bze h ALA 454 Ca -0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.01 2bze h ALA 454 Cb 0.83 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2bze h ALA 454 CO 0.01 1.18 0.00 0.41 0.00 0.00 0.00 179.25 180.85 2bze n GLY 455 N 1.36 0.90 3.87 0.00 0.00 0.48 -4.88 105.19 106.91 2bze n GLY 455 Ca -0.02 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 2bze n GLY 455 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2bze s MET 456 N -0.56 3.81 0.10 1.61 -2.45 0.83 -5.00 119.30 117.63 2bze s MET 456 Ca 0.00 0.50 -0.09 0.00 -1.25 0.00 0.00 55.69 54.84 2bze s MET 456 Cb 0.00 -2.39 -0.06 0.00 1.25 0.00 0.00 34.83 33.63 2bze s MET 456 CO 0.00 -0.01 0.41 -1.14 1.05 0.00 0.00 175.02 175.32 2bze s GLN 457 N -3.74 3.75 0.50 4.11 0.74 -1.26 -4.17 119.66 119.58 2bze s GLN 457 Ca 0.52 0.15 -0.15 0.00 0.05 0.00 0.00 55.36 55.93 2bze s GLN 457 Cb -0.10 -2.96 -0.07 0.00 1.10 0.00 0.00 33.01 30.98 2bze s GLN 457 CO 0.30 0.53 0.94 -0.51 -0.55 0.00 0.00 175.29 176.00 2bze s LEU 458 N -2.06 3.63 0.77 3.68 2.01 -1.26 -5.04 118.68 120.42 2bze s LEU 458 Ca 0.35 1.46 -0.11 0.00 0.01 0.00 0.00 54.13 55.83 2bze s LEU 458 Cb -0.14 -4.39 0.05 0.00 0.01 0.00 0.00 46.19 41.72 2bze s LEU 458 CO 0.19 -0.57 1.09 -2.16 1.01 0.00 0.00 176.35 175.91 2bze s PRO 459 N -4.13 2.30 0.20 1.29 0.05 -1.26 -4.81 135.00 128.65 2bze s PRO 459 Ca 0.57 0.68 0.04 0.00 0.05 0.00 0.00 61.00 62.34 2bze s PRO 459 Cb -0.10 -1.94 -0.03 0.00 0.05 0.00 0.00 34.50 32.48 2bze s PRO 459 CO 0.33 -1.48 0.30 0.95 0.05 0.00 0.00 177.00 177.15 2bze s THR 460 N -3.15 5.13 0.35 1.26 -4.23 -1.26 -0.08 115.64 113.65 2bze s THR 460 Ca 0.60 -0.94 0.21 0.00 -1.18 0.00 0.00 61.69 60.38 2bze s THR 460 Cb -0.14 -3.72 0.20 0.00 1.34 0.00 0.00 72.50 70.18 2bze s THR 460 CO 0.54 -0.23 1.93 -0.07 -0.54 0.00 0.00 174.62 176.25 2bze h LEU 461 N 1.63 0.00 -0.72 4.79 -0.00 -1.77 -0.74 115.31 118.51 2bze h LEU 461 Ca -0.50 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.27 2bze h LEU 461 Cb 1.22 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.86 2bze h LEU 461 CO 0.64 0.24 -0.18 -0.78 -0.00 0.00 0.00 178.44 178.36 2bze h ASP 462 N 0.00 0.80 0.62 -0.43 3.58 -1.59 -0.28 116.42 119.13 2bze h ASP 462 Ca -0.00 -0.27 -0.28 0.00 0.42 0.00 0.00 57.03 56.90 2bze h ASP 462 Cb 0.53 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.36 2bze h ASP 462 CO 0.03 0.98 -1.29 1.05 -2.88 0.00 0.00 179.24 177.13 2bze h GLU 463 N 0.71 0.25 -0.97 0.28 4.11 -1.70 -3.05 114.58 114.20 2bze h GLU 463 Ca 0.11 -0.43 0.06 0.00 0.07 0.00 0.00 59.36 59.17 2bze h GLU 463 Cb 0.68 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 30.03 2bze h GLU 463 CO 0.05 1.18 0.63 0.82 0.07 0.00 0.00 179.01 181.76 2bze h ILE 464 N 0.07 1.10 -0.40 -1.06 1.08 -1.00 -0.36 117.51 116.93 2bze h ILE 464 Ca -0.15 -0.40 -0.07 0.00 -0.39 0.00 0.00 64.86 63.86 2bze h ILE 464 Cb 1.97 -0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.54 2bze h ILE 464 CO 0.19 0.21 -0.03 -1.13 -0.69 0.00 0.00 178.15 176.70 2bze h ASN 465 N 1.16 0.63 -0.22 1.72 -1.24 -1.01 0.15 115.58 116.78 2bze h ASN 465 Ca 0.41 -0.15 -0.20 0.00 0.71 0.00 0.00 56.30 57.07 2bze h ASN 465 Cb 0.12 -0.17 0.01 0.00 0.73 0.00 0.00 38.32 39.01 2bze h ASN 465 CO -0.16 0.72 -0.65 0.11 -1.29 0.00 0.00 177.43 176.16 2bze h LYS 466 N 0.62 0.83 -0.12 6.67 1.79 -1.21 -2.17 116.57 122.99 2bze h LYS 466 Ca 0.12 -0.60 -0.04 0.00 -2.18 0.00 0.00 60.65 57.96 2bze h LYS 466 Cb 0.43 0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 31.18 2bze h LYS 466 CO 0.02 1.22 -0.07 0.87 -1.08 0.00 0.00 179.45 180.41 2bze h LYS 467 N 0.59 0.25 -0.49 3.15 1.79 -0.54 -1.59 116.57 119.74 2bze h LYS 467 Ca -0.02 -0.11 -0.01 0.00 -2.18 0.00 0.00 60.65 58.33 2bze h LYS 467 Cb 1.27 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.89 2bze h LYS 467 CO 0.14 0.61 0.28 1.05 -1.08 0.00 0.00 179.45 180.45 2bze h GLU 468 N -0.11 0.66 -0.74 3.15 4.11 -0.78 -0.20 114.58 120.67 2bze h GLU 468 Ca 0.02 -0.06 -0.00 0.00 0.07 0.00 0.00 59.36 59.40 2bze h GLU 468 Cb 0.54 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 2bze h GLU 468 CO 0.02 0.48 0.46 1.25 0.07 0.00 0.00 179.01 181.29 2bze h LEU 469 N 0.67 0.87 -0.87 3.06 7.12 -1.15 -1.21 115.31 123.81 2bze h LEU 469 Ca 0.18 -0.05 -0.12 0.00 0.13 0.00 0.00 57.88 58.02 2bze h LEU 469 Cb -0.01 -0.22 -0.02 0.00 -0.53 0.00 0.00 40.66 39.89 2bze h LEU 469 CO -0.03 0.66 -0.56 -1.28 -0.13 0.00 0.00 178.44 177.10 2bze h SER 470 N 1.01 0.02 -0.64 1.25 0.87 -0.09 -1.90 113.55 114.07 2bze h SER 470 Ca 0.27 -0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.76 2bze h SER 470 Cb -0.06 -0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 2bze h SER 470 CO -0.05 0.57 0.16 0.40 -0.53 0.00 0.00 176.83 177.38 2bze h ILE 471 N 0.01 1.25 -0.50 2.23 1.08 -0.40 -0.55 117.51 120.64 2bze h ILE 471 Ca -0.01 -0.92 -0.00 0.00 -0.39 0.00 0.00 64.86 63.54 2bze h ILE 471 Cb 1.00 0.63 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 2bze h ILE 471 CO 0.07 0.35 0.30 0.11 -0.69 0.00 0.00 178.15 178.29 2bze h LYS 472 N 0.94 0.68 -0.60 2.37 1.57 -0.60 -0.59 116.57 120.36 2bze h LYS 472 Ca 0.20 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.82 2bze h LYS 472 Cb 0.35 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2bze h LYS 472 CO 0.00 0.50 0.01 0.93 -0.57 0.00 0.00 179.45 180.32 2bze h GLU 473 N 0.67 1.04 -0.32 3.15 5.08 -1.02 0.17 114.58 123.35 2bze h GLU 473 Ca 0.18 -0.33 -0.10 0.00 -1.00 0.00 0.00 59.36 58.11 2bze h GLU 473 Cb -0.00 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2bze h GLU 473 CO -0.03 1.02 -0.19 0.00 -1.00 0.00 0.00 179.01 178.80 2bze h ALA 474 N 0.98 0.45 0.00 3.43 0.00 -0.71 -3.13 119.26 120.29 2bze h ALA 474 Ca 0.17 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 2bze h ALA 474 Cb 0.54 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2bze h ALA 474 CO 0.03 0.39 -0.75 1.37 0.00 0.00 0.00 179.25 180.29 2bze h LEU 475 N 0.45 0.00 0.00 0.00 8.10 -1.06 -3.50 115.31 119.31 2bze h LEU 475 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.06 2bze h LEU 475 Cb 0.74 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.96 2bze h LEU 475 CO 0.05 0.66 0.00 -3.20 -4.11 0.00 0.00 178.44 171.84