#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 1.83 2.71 -5.12 0.00 -1.26 -5.02 105.19 98.33 2bze n GLY -20 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.00 1.80 0.34 1.61 0.01 -1.26 -4.96 113.70 110.25 2bze s SER -19 Ca 0.00 -0.24 0.16 0.00 1.31 0.00 0.00 55.95 57.18 2bze s SER -19 Cb 0.00 -0.35 0.58 0.00 0.21 0.00 0.00 66.02 66.45 2bze s SER -19 CO 0.00 -0.25 1.69 -1.28 0.41 0.00 0.00 173.24 173.81 2bze h SER -18 N 8.36 0.00 -3.09 2.44 0.87 -2.01 -3.40 113.55 116.72 2bze h SER -18 Ca -0.16 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.83 2bze h SER -18 Cb 1.13 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.04 2bze h SER -18 CO 0.25 0.44 0.89 -1.00 -0.53 0.00 0.00 176.83 176.88 2bze s HIS -17 N -3.59 2.96 -0.15 2.24 0.09 -1.26 -3.55 115.29 112.03 2bze s HIS -17 Ca -0.00 1.10 -0.04 0.00 -0.00 0.00 0.00 55.06 56.11 2bze s HIS -17 Cb 0.11 -3.61 0.01 0.00 -0.00 0.00 0.00 32.58 29.09 2bze s HIS -17 CO 0.71 -1.28 0.19 1.58 -0.00 0.00 0.00 174.74 175.94 2bze n HIS -16 N 6.89 -1.06 -3.87 1.40 -0.00 -1.26 -5.04 115.22 112.27 2bze n HIS -16 Ca 0.13 0.42 -0.30 0.00 -0.00 0.00 0.00 57.72 57.98 2bze n HIS -16 Cb 0.46 -2.30 -0.14 0.00 -0.00 0.00 0.00 29.99 28.01 2bze n HIS -16 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2bze s HIS -15 N -1.69 2.85 -0.37 1.57 5.65 -1.23 -4.89 115.29 117.17 2bze s HIS -15 Ca 0.07 -2.97 0.02 0.00 0.25 0.00 0.00 55.06 52.43 2bze s HIS -15 Cb -0.02 -2.53 0.15 0.00 -1.18 0.00 0.00 32.58 29.00 2bze s HIS -15 CO 0.24 -0.74 0.29 -1.58 -0.65 0.00 0.00 174.74 172.30 2bze s HIS -14 N -0.19 0.53 -0.00 3.88 5.65 -1.26 -4.81 115.29 119.09 2bze s HIS -14 Ca 0.18 -1.61 0.01 0.00 0.25 0.00 0.00 55.06 53.88 2bze s HIS -14 Cb -0.24 -0.77 0.01 0.00 -1.18 0.00 0.00 32.58 30.40 2bze s HIS -14 CO -0.01 -0.87 0.69 1.58 -0.65 0.00 0.00 174.74 175.48 2bze n HIS -13 N 3.75 0.00 -2.80 3.88 -0.00 -1.26 -4.97 115.22 113.81 2bze n HIS -13 Ca 0.17 -0.17 -0.44 0.00 -0.00 0.00 0.00 57.72 57.28 2bze n HIS -13 Cb 0.42 -0.02 0.00 0.00 -0.00 0.00 0.00 29.99 30.39 2bze n HIS -13 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2bze n HIS -12 N -0.18 4.78 -4.03 1.57 -0.00 -1.26 -4.92 115.22 111.18 2bze n HIS -12 Ca 0.00 -3.19 -0.30 0.00 -0.00 0.00 0.00 57.72 54.23 2bze n HIS -12 Cb 0.45 -2.30 -0.16 0.00 -0.00 0.00 0.00 29.99 27.97 2bze n HIS -12 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 2bze s SER -11 N 3.11 2.79 -0.04 0.26 0.01 -1.26 -4.95 113.70 113.61 2bze s SER -11 Ca 0.46 -0.53 0.15 0.00 1.31 0.00 0.00 55.95 57.33 2bze s SER -11 Cb -0.00 -1.22 0.27 0.00 0.21 0.00 0.00 66.02 65.28 2bze s SER -11 CO 0.02 -0.06 1.12 -1.20 0.41 0.00 0.00 173.24 173.53 2bze n SER -10 N 4.75 0.92 -0.42 2.44 7.64 -1.26 -5.07 113.62 122.62 2bze n SER -10 Ca -0.17 -2.39 0.00 0.00 1.01 0.00 0.00 58.87 57.32 2bze n SER -10 Cb 0.50 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 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 -0.11 1.40 3.07 0.23 0.00 -1.26 -4.93 105.19 103.60 2bze n GLY -9 Ca 0.07 -1.59 -0.18 0.00 0.00 0.00 0.00 46.02 44.33 2bze n GLY -9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bze n LEU -8 N 0.00 -6.17 -4.54 0.99 4.77 -1.26 -4.97 117.00 105.82 2bze n LEU -8 Ca 0.00 0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 55.85 2bze n LEU -8 Cb 0.00 -2.83 -0.08 0.00 -2.33 0.00 0.00 43.42 38.18 2bze n LEU -8 CO 0.00 -1.58 0.17 -0.69 -1.33 0.00 0.00 177.39 173.96 2bze s VAL -7 N -2.26 5.05 1.03 4.08 1.01 -1.26 -5.06 120.40 122.98 2bze s VAL -7 Ca 0.29 0.10 -0.16 0.00 0.00 0.00 0.00 61.98 62.21 2bze s VAL -7 Cb -0.06 -3.97 0.21 0.00 0.00 0.00 0.00 36.38 32.57 2bze s VAL -7 CO 0.80 -0.26 1.21 -2.84 0.00 0.00 0.00 175.10 174.01 2bze s PRO -6 N 2.28 0.17 -0.19 2.72 0.02 -1.26 -4.98 135.00 133.76 2bze s PRO -6 Ca 0.16 -0.14 0.16 0.00 0.02 0.00 0.00 61.00 61.21 2bze s PRO -6 Cb -0.16 -1.76 0.58 0.00 0.02 0.00 0.00 34.50 33.17 2bze s PRO -6 CO 0.13 -2.78 1.48 2.89 -0.33 0.00 0.00 177.00 178.40 2bze n ARG -5 N -4.08 3.26 -0.67 5.54 1.85 -1.26 -4.39 116.66 116.91 2bze n ARG -5 Ca 0.12 -2.89 0.05 0.00 -1.00 0.00 0.00 57.85 54.13 2bze n ARG -5 Cb 0.59 -1.91 0.08 0.00 -1.05 0.00 0.00 32.46 30.17 2bze n ARG -5 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2bze n GLY -4 N -0.29 2.59 0.33 2.89 0.00 -1.26 -3.93 105.19 105.52 2bze n GLY -4 Ca 0.22 -0.74 0.21 0.00 0.00 0.00 0.00 46.02 45.71 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 0.45 0.00 1.67 1.61 0.02 -1.98 -0.49 113.55 114.82 2bze h SER -3 Ca -0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2bze h SER -3 Cb 1.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.89 2bze h SER -3 CO 0.03 0.00 -0.14 -0.74 -1.14 0.00 0.00 176.83 174.84 2bze h HIS -2 N 0.00 0.00 -3.56 3.45 6.17 -1.96 -3.50 115.15 115.75 2bze h HIS -2 Ca 0.00 0.00 0.15 0.00 0.71 0.00 0.00 60.37 61.23 2bze h HIS -2 Cb 0.03 0.00 -0.08 0.00 2.52 0.00 0.00 27.41 29.88 2bze h HIS -2 CO 0.00 0.00 -1.08 -0.12 0.71 0.00 0.00 177.93 177.44 2bze n MET -1 N -2.74 -3.70 -1.81 5.26 1.56 -0.19 -4.67 117.12 110.83 2bze n MET -1 Ca 0.04 2.94 -0.41 0.00 -0.27 0.00 0.00 57.70 59.99 2bze n MET -1 Cb 0.50 -3.88 -0.03 0.00 2.15 0.00 0.00 33.22 31.96 2bze n MET -1 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 2bze s VAL 345 N -4.92 3.24 -0.29 1.12 1.01 0.97 -4.73 120.40 116.80 2bze s VAL 345 Ca 0.00 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.23 2bze s VAL 345 Cb 0.00 -3.37 0.01 0.00 0.00 0.00 0.00 36.38 33.02 2bze s VAL 345 CO 0.00 -0.27 0.52 -1.20 0.00 0.00 0.00 175.10 174.15 2bze n SER 346 N 11.84 1.08 -4.13 3.32 7.64 -1.26 -4.85 113.62 127.26 2bze n SER 346 Ca 0.27 -1.04 -0.24 0.00 1.01 0.00 0.00 58.87 58.87 2bze n SER 346 Cb 0.48 0.12 -0.16 0.00 -1.01 0.00 0.00 64.21 63.64 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 -0.44 1.97 0.59 -3.43 1.02 -1.26 -4.98 118.68 112.14 2bze s LEU 347 Ca 0.03 -0.30 0.38 0.00 0.02 0.00 0.00 54.13 54.26 2bze s LEU 347 Cb 0.02 -0.85 1.88 0.00 0.02 0.00 0.00 46.19 47.25 2bze s LEU 347 CO 0.04 0.17 2.15 1.55 0.02 0.00 0.00 176.35 180.28 2bze h PRO 348 N 5.97 0.00 -0.62 1.29 0.13 -1.87 -2.10 132.00 134.80 2bze h PRO 348 Ca -0.35 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.74 2bze h PRO 348 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 2bze h PRO 348 CO 0.48 0.00 0.21 0.93 -0.23 0.00 0.00 178.00 179.40 2bze h GLU 349 N 0.00 0.95 -0.08 0.86 4.39 -1.94 0.35 114.58 119.11 2bze h GLU 349 Ca 0.00 -0.19 -0.15 0.00 0.34 0.00 0.00 59.36 59.36 2bze h GLU 349 Cb 0.23 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2bze h GLU 349 CO 0.00 0.83 -0.61 0.93 -1.16 0.00 0.00 179.01 179.00 2bze h GLU 350 N 0.88 0.29 0.00 2.33 4.39 -1.81 -1.37 114.58 119.29 2bze h GLU 350 Ca 0.20 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2bze h GLU 350 Cb 0.26 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2bze h GLU 350 CO -0.01 0.81 0.00 1.25 -1.16 0.00 0.00 179.01 179.90 2bze h LEU 351 N 0.21 0.00 0.00 1.33 5.85 -1.21 -2.82 115.31 118.67 2bze h LEU 351 Ca -0.01 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.53 2bze h LEU 351 Cb 1.13 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 2bze h LEU 351 CO 0.10 0.00 -0.88 0.78 -0.34 0.00 0.00 178.44 178.10 2bze h ASN 352 N 0.00 0.00 0.95 1.25 2.35 0.73 0.40 115.58 121.27 2bze h ASN 352 Ca 0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 2bze h ASN 352 Cb 0.72 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.06 2bze h ASN 352 CO 0.00 0.84 -0.90 0.08 -1.65 0.00 0.00 177.43 175.80 2bze h ARG 353 N 0.00 0.00 -0.01 0.81 0.11 -1.09 -3.01 114.38 111.19 2bze h ARG 353 Ca -0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.06 2bze h ARG 353 Cb 1.66 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.74 2bze h ARG 353 CO 0.11 0.90 -0.34 1.33 0.10 0.00 0.00 179.97 182.06 2bze n VAL 354 N -3.43 0.00 -1.75 0.08 0.24 -1.09 -4.68 118.33 107.71 2bze n VAL 354 Ca -0.00 -0.10 -0.42 0.00 -2.04 0.00 0.00 64.34 61.79 2bze n VAL 354 Cb 0.87 0.40 -0.02 0.00 -1.47 0.00 0.00 33.84 33.62 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 -2.64 4.11 -0.13 7.34 3.52 0.13 -2.89 118.95 128.39 2bze s ARG 355 Ca 0.20 2.61 -0.01 0.00 -0.13 0.00 0.00 55.73 58.40 2bze s ARG 355 Cb 0.19 -3.03 -0.02 0.00 -1.56 0.00 0.00 34.95 30.53 2bze s ARG 355 CO 0.58 -0.68 -0.08 -0.51 -0.81 0.00 0.00 175.30 173.80 2bze s LEU 356 N -0.16 3.02 0.32 -0.88 1.43 0.05 -4.95 118.68 117.51 2bze s LEU 356 Ca 0.66 -0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.66 2bze s LEU 356 Cb -0.49 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 2bze s LEU 356 CO 0.45 0.21 0.08 -0.44 0.23 0.00 0.00 176.35 176.88 2bze s SER 357 N 0.12 4.56 0.53 2.29 0.01 -1.26 -3.58 113.70 116.36 2bze s SER 357 Ca -0.03 -0.78 0.31 0.00 1.31 0.00 0.00 55.95 56.75 2bze s SER 357 Cb -0.14 -0.73 1.38 0.00 0.21 0.00 0.00 66.02 66.74 2bze s SER 357 CO 0.04 -0.21 2.00 0.08 0.41 0.00 0.00 173.24 175.56 2bze h ARG 358 N 1.68 0.00 -0.27 12.44 0.11 -1.78 -0.41 114.38 126.15 2bze h ARG 358 Ca -0.44 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.62 2bze h ARG 358 Cb 1.25 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.32 2bze h ARG 358 CO 0.63 0.09 0.06 0.45 0.10 0.00 0.00 179.97 181.30 2bze h HIS 359 N 0.00 0.38 0.23 4.08 3.86 -1.93 0.23 115.15 122.00 2bze h HIS 359 Ca -0.00 -0.02 -0.33 0.00 -1.16 0.00 0.00 60.37 58.86 2bze h HIS 359 Cb 0.48 -0.12 0.03 0.00 1.06 0.00 0.00 27.41 28.86 2bze h HIS 359 CO 0.00 0.35 -1.50 0.87 0.86 0.00 0.00 177.93 178.51 2bze h LYS 360 N 0.38 0.50 -0.26 2.45 1.57 -1.50 -2.64 116.57 117.07 2bze h LYS 360 Ca 0.09 -0.85 -0.16 0.00 -1.87 0.00 0.00 60.65 57.87 2bze h LYS 360 Cb 0.16 0.32 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2bze h LYS 360 CO -0.00 1.40 -0.47 -0.07 -0.57 0.00 0.00 179.45 179.74 2bze h LEU 361 N 0.14 0.75 -0.08 2.94 3.38 -1.10 -1.43 115.31 119.90 2bze h LEU 361 Ca -0.26 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.36 2bze h LEU 361 Cb 2.15 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.67 2bze h LEU 361 CO 0.26 1.10 -0.02 -0.08 0.09 0.00 0.00 178.44 179.78 2bze h GLU 362 N 0.55 -0.01 -0.02 1.13 4.22 -0.59 -0.13 114.58 119.72 2bze h GLU 362 Ca 0.03 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.34 2bze h GLU 362 Cb 1.02 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 2bze h GLU 362 CO 0.10 -0.01 -0.61 0.07 -2.18 0.00 0.00 179.01 176.38 2bze h ARG 363 N -0.01 0.07 -0.00 1.92 0.11 -1.37 -2.57 114.38 112.53 2bze h ARG 363 Ca 0.04 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2bze h ARG 363 Cb 0.07 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.16 2bze h ARG 363 CO -0.08 0.66 -0.13 0.91 0.10 0.00 0.00 179.97 181.43 2bze n TRP 364 N -3.83 0.00 0.30 4.08 7.02 -0.55 -3.51 117.44 120.95 2bze n TRP 364 Ca -0.02 0.00 0.19 0.00 -1.02 0.00 0.00 57.50 56.66 2bze n TRP 364 Cb 0.61 -0.40 0.90 0.00 -2.42 0.00 0.00 31.31 30.00 2bze n TRP 364 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2bze h HIS 366 N 0.00 0.00 -3.73 0.00 2.07 -1.74 -3.47 115.15 108.28 2bze h HIS 366 Ca -0.00 0.00 -0.43 0.00 -2.85 0.00 0.00 60.37 57.09 2bze h HIS 366 Cb 0.31 0.00 0.17 0.00 2.57 0.00 0.00 27.41 30.46 2bze h HIS 366 CO 0.00 0.00 0.20 -1.64 -3.07 0.00 0.00 177.93 173.42 2bze s MET 367 N -3.30 -0.41 0.00 5.12 1.00 -0.44 -5.07 119.30 116.20 2bze s MET 367 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 55.69 55.75 2bze s MET 367 Cb 0.10 -1.68 0.00 0.00 0.00 0.00 0.00 34.83 33.24 2bze s MET 367 CO 0.75 -3.19 0.00 -2.30 0.00 0.00 0.00 175.02 170.28 2bze n PRO 368 N -4.41 -0.03 -1.80 2.03 -0.02 -1.26 -4.87 135.00 124.64 2bze n PRO 368 Ca 0.11 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.19 2bze n PRO 368 Cb 0.59 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.04 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 -0.62 1.43 -2.31 6.00 5.36 -1.26 -4.79 117.98 121.79 2bze s PHE 369 Ca 0.00 0.87 0.22 0.00 -0.96 0.00 0.00 56.93 57.07 2bze s PHE 369 Cb 0.00 -3.93 0.51 0.00 -0.34 0.00 0.00 43.02 39.26 2bze s PHE 369 CO 0.00 -3.00 1.45 1.97 -1.46 0.00 0.00 175.22 174.17 2bze n PHE 370 N 12.55 0.59 -0.25 10.12 1.16 -1.26 -4.51 117.46 135.87 2bze n PHE 370 Ca 0.28 -0.30 0.15 0.00 -1.87 0.00 0.00 57.45 55.71 2bze n PHE 370 Cb 0.49 0.00 0.44 0.00 -1.61 0.00 0.00 39.48 38.81 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 4.38 2.00 -0.28 1.98 0.00 -1.95 0.59 119.26 125.98 2bze h ALA 371 Ca 0.00 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 2bze h ALA 371 Cb 0.91 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2bze h ALA 371 CO 0.00 -0.26 -0.33 -0.22 0.00 0.00 0.00 179.25 178.45 2bze h LYS 372 N 0.55 0.71 -0.60 0.00 1.63 -1.92 0.28 116.57 117.23 2bze h LYS 372 Ca 0.45 -0.40 -0.04 0.00 -0.85 0.00 0.00 60.65 59.81 2bze h LYS 372 Cb 0.90 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.53 2bze h LYS 372 CO -0.19 1.01 0.20 1.15 -3.45 0.00 0.00 179.45 178.17 2bze h THR 373 N 0.45 1.23 0.00 1.00 2.02 -1.38 -2.84 112.91 113.39 2bze h THR 373 Ca 0.04 -0.76 -0.15 0.00 0.77 0.00 0.00 66.41 66.31 2bze h THR 373 Cb 0.91 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 2bze h THR 373 CO 0.08 0.29 -1.13 -0.37 0.37 0.00 0.00 175.52 174.76 2bze h VAL 374 N 0.87 0.61 -2.82 3.16 -1.51 -0.84 -3.43 116.25 112.28 2bze h VAL 374 Ca 0.20 -2.05 -0.56 0.00 -1.23 0.00 0.00 66.70 63.06 2bze h VAL 374 Cb 0.24 2.14 -0.03 0.00 -2.13 0.00 0.00 31.29 31.51 2bze h VAL 374 CO -0.01 0.35 1.06 -0.89 -1.23 0.00 0.00 177.57 176.84 2bze s THR 375 N -2.94 3.84 0.00 7.19 2.01 0.08 -1.27 115.64 124.55 2bze s THR 375 Ca -0.01 0.98 0.00 0.00 0.31 0.00 0.00 61.69 62.97 2bze s THR 375 Cb 0.08 -3.79 0.00 0.00 0.01 0.00 0.00 72.50 68.81 2bze s THR 375 CO 0.79 -0.26 0.00 0.61 -0.69 0.00 0.00 174.62 175.07 2bze n GLY 376 N 4.35 0.94 3.98 4.40 0.00 -0.61 -4.93 105.19 113.31 2bze n GLY 376 Ca 0.17 0.00 -0.20 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 -2.60 2.13 0.10 0.00 0.08188.30 -0.54 117.98 305.45 2bze s PHE 378 Ca 0.55 -0.39 0.07 0.00 0.12 0.00 0.00 56.93 57.27 2bze s PHE 378 Cb -0.10 -1.13 -0.03 0.00 -0.57 0.00 0.00 43.02 41.18 2bze s PHE 378 CO 0.37 0.33 -0.18 0.54 -0.10 0.00 0.00 175.22 176.17 2bze s VAL 379 N -1.26 1.53 -0.72 -0.44 0.11 0.30 -0.77 120.40 119.15 2bze s VAL 379 Ca 0.13 -1.55 -0.20 0.00 -2.93 0.00 0.00 61.98 57.43 2bze s VAL 379 Cb -0.09 -1.47 0.10 0.00 -1.53 0.00 0.00 36.38 33.39 2bze s VAL 379 CO 0.06 -0.17 0.93 -0.60 -3.33 0.00 0.00 175.10 171.99 2bze s ARG 380 N -2.05 3.24 0.10 1.54 6.06 -1.23 -2.00 118.95 124.60 2bze s ARG 380 Ca 0.06 -1.27 0.08 0.00 -2.50 0.00 0.00 55.73 52.10 2bze s ARG 380 Cb -0.09 -4.43 -0.04 0.00 0.06 0.00 0.00 34.95 30.45 2bze s ARG 380 CO 0.04 -1.71 -0.16 -1.50 -2.50 0.00 0.00 175.30 169.46 2bze s ILE 381 N 3.19 2.95 -0.22 4.11 1.10 -1.01 -0.91 121.20 130.41 2bze s ILE 381 Ca 0.22 -1.38 -0.01 0.00 -0.51 0.00 0.00 60.65 58.97 2bze s ILE 381 Cb -0.15 -2.34 0.02 0.00 0.15 0.00 0.00 42.46 40.14 2bze s ILE 381 CO 0.03 0.15 -0.11 -0.83 -2.11 0.00 0.00 174.94 172.08 2bze s GLY 382 N -2.00 1.54 -1.22 1.50 0.00 -1.16 -0.46 107.32 105.51 2bze s GLY 382 Ca 0.18 -1.33 -0.13 0.00 0.00 0.00 0.00 44.72 43.43 2bze s GLY 382 CO 0.10 0.42 1.47 0.29 0.00 0.00 0.00 173.10 175.38 2bze n ILE 383 N 4.66 4.26 -0.01 0.90 -5.35 0.32 -4.81 119.36 119.33 2bze n ILE 383 Ca -0.18 -4.71 0.00 0.00 -0.27 0.00 0.00 62.75 57.59 2bze n ILE 383 Cb 0.49 -2.46 0.00 0.00 -1.74 0.00 0.00 39.64 35.93 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 3.97 -2.95 2.66 3.28 0.00 -1.26 -4.66 105.19 106.24 2bze n GLY 384 Ca 0.37 -1.20 -0.23 0.00 0.00 0.00 0.00 46.02 44.97 2bze n GLY 384 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bze s ASN 385 N -2.24 1.68 0.00 1.61 4.22 -1.26 -3.22 114.94 115.72 2bze s ASN 385 Ca 0.00 -0.21 0.00 0.00 -2.14 0.00 0.00 52.86 50.51 2bze s ASN 385 Cb 0.00 -0.22 0.00 0.00 1.28 0.00 0.00 41.25 42.31 2bze s ASN 385 CO 0.00 -0.28 0.00 1.41 -2.04 0.00 0.00 177.10 176.19 2bze n HIS 386 N 5.27 0.00 -1.86 1.54 8.25 -1.26 -5.07 115.22 122.09 2bze n HIS 386 Ca -0.05 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.13 2bze n HIS 386 Cb 0.50 0.00 0.20 0.00 1.12 0.00 0.00 29.99 31.80 2bze n HIS 386 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2bze n ASN 387 N -1.42 0.04 0.22 0.41 3.02 -1.26 -4.95 115.26 111.32 2bze n ASN 387 Ca 0.00 -1.45 0.08 0.00 -0.03 0.00 0.00 54.58 53.18 2bze n ASN 387 Cb 0.08 -0.97 0.51 0.00 -0.61 0.00 0.00 39.78 38.79 2bze n ASN 387 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2bze h SER 388 N -1.70 0.00 -3.35 6.41 0.02 -2.03 -3.40 113.55 109.50 2bze h SER 388 Ca -0.41 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 59.90 2bze h SER 388 Cb 1.14 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.45 2bze h SER 388 CO 0.29 0.25 -0.68 -1.59 -1.14 0.00 0.00 176.83 173.96 2bze s LYS 389 N -4.07 3.61 0.37 3.45 -2.85 -1.26 -5.10 119.74 113.89 2bze s LYS 389 Ca -0.02 -0.54 -0.19 0.00 -1.00 0.00 0.00 55.97 54.21 2bze s LYS 389 Cb 0.13 -2.94 -0.10 0.00 -2.06 0.00 0.00 37.83 32.86 2bze s LYS 389 CO 0.65 0.14 0.87 -1.25 0.10 0.00 0.00 175.35 175.87 2bze s PRO 390 N 0.61 4.18 -0.62 1.78 0.04 -1.26 -4.68 135.00 135.06 2bze s PRO 390 Ca -0.02 0.97 -0.16 0.00 0.04 0.00 0.00 61.00 61.83 2bze s PRO 390 Cb -0.14 -2.35 0.15 0.00 0.04 0.00 0.00 34.50 32.20 2bze s PRO 390 CO 0.02 0.08 0.59 0.08 0.04 0.00 0.00 177.00 177.81 2bze s VAL 391 N -2.03 5.28 -0.12 -0.36 1.01 -1.20 -5.03 120.40 117.95 2bze s VAL 391 Ca 0.57 -1.70 -0.05 0.00 0.00 0.00 0.00 61.98 60.80 2bze s VAL 391 Cb -0.11 -4.39 -0.04 0.00 0.00 0.00 0.00 36.38 31.85 2bze s VAL 391 CO 0.16 -0.94 0.06 -0.31 0.00 0.00 0.00 175.10 174.07 2bze s TYR 392 N 1.34 3.33 0.33 5.22 2.02 -1.26 -0.53 117.35 127.80 2bze s TYR 392 Ca 0.08 0.27 0.03 0.00 -0.37 0.00 0.00 57.07 57.08 2bze s TYR 392 Cb -0.24 -1.91 -0.04 0.00 -0.40 0.00 0.00 41.96 39.37 2bze s TYR 392 CO 0.00 0.48 0.15 1.03 -1.57 0.00 0.00 175.55 175.64 2bze s ARG 393 N -0.63 1.67 -0.25 -0.62 0.52 0.39 -4.81 118.95 115.23 2bze s ARG 393 Ca 0.11 -1.97 -0.17 0.00 -0.52 0.00 0.00 55.73 53.19 2bze s ARG 393 Cb -0.12 -0.26 -0.03 0.00 0.52 0.00 0.00 34.95 35.06 2bze s ARG 393 CO 0.02 -0.44 0.45 0.08 0.02 0.00 0.00 175.30 175.43 2bze s VAL 394 N -3.49 5.13 -0.05 3.52 1.01 -1.26 -2.40 120.40 122.85 2bze s VAL 394 Ca 0.33 0.76 0.06 0.00 0.00 0.00 0.00 61.98 63.13 2bze s VAL 394 Cb 0.05 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 2bze s VAL 394 CO 0.17 0.15 -0.24 0.00 0.00 0.00 0.00 175.10 175.18 2bze s ALA 395 N 1.96 2.07 0.09 5.51 0.00 -0.85 -4.54 121.76 126.01 2bze s ALA 395 Ca 0.19 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.86 2bze s ALA 395 Cb -0.15 -0.64 -0.06 0.00 0.00 0.00 0.00 23.12 22.27 2bze s ALA 395 CO 0.09 0.40 0.91 -2.00 0.00 0.00 0.00 175.76 175.16 2bze s GLU 396 N -0.15 4.64 -0.21 0.00 2.12 0.76 -0.54 118.70 125.33 2bze s GLU 396 Ca -0.03 1.34 -0.28 0.00 0.36 0.00 0.00 54.97 56.36 2bze s GLU 396 Cb -0.13 -3.37 -0.00 0.00 0.26 0.00 0.00 34.13 30.88 2bze s GLU 396 CO 0.03 0.23 0.96 0.42 -0.54 0.00 0.00 175.26 176.36 2bze s ILE 397 N 0.00 4.76 -0.59 -3.70 1.01 0.30 -0.35 121.20 122.63 2bze s ILE 397 Ca 0.45 1.87 0.03 0.00 0.00 0.00 0.00 60.65 62.99 2bze s ILE 397 Cb -0.22 -4.24 0.15 0.00 0.01 0.00 0.00 42.46 38.15 2bze s ILE 397 CO 0.28 -0.10 0.36 0.42 0.00 0.00 0.00 174.94 175.90 2bze s THR 398 N 2.79 2.90 0.09 2.92 -4.23 0.11 -1.57 115.64 118.67 2bze s THR 398 Ca 0.42 -3.50 0.00 0.00 -1.18 0.00 0.00 61.69 57.42 2bze s THR 398 Cb -0.16 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.73 2bze s THR 398 CO 0.09 -0.87 0.00 0.61 -0.54 0.00 0.00 174.62 173.91 2bze n GLY 399 N 2.88 -1.73 3.07 3.99 0.00 -1.26 -2.31 105.19 109.83 2bze n GLY 399 Ca 0.09 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.83 1.54 0.25 1.61 1.01 -1.26 -1.98 120.40 120.74 2bze s VAL 400 Ca 0.00 -0.68 0.09 0.00 0.00 0.00 0.00 61.98 61.40 2bze s VAL 400 Cb 0.00 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 2bze s VAL 400 CO 0.00 0.45 -0.03 0.68 0.00 0.00 0.00 175.10 176.20 2bze s VAL 401 N 0.89 3.39 0.05 2.92 -7.23 0.12 -4.93 120.40 115.61 2bze s VAL 401 Ca -0.08 -1.86 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 2bze s VAL 401 Cb -0.15 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 33.97 2bze s VAL 401 CO -0.00 -0.31 0.11 -1.83 -0.31 0.00 0.00 175.10 172.76 2bze s GLU 402 N -3.48 3.07 0.53 4.82 -1.05 -1.26 0.01 118.70 121.35 2bze s GLU 402 Ca 0.30 -0.56 0.07 0.00 -0.15 0.00 0.00 54.97 54.63 2bze s GLU 402 Cb -0.07 -2.85 0.05 0.00 -0.44 0.00 0.00 34.13 30.82 2bze s GLU 402 CO 0.19 0.60 0.53 0.95 0.95 0.00 0.00 175.26 178.48 2bze s THR 403 N -1.35 1.98 -0.97 1.83 -4.23 0.90 -4.80 115.64 108.99 2bze s THR 403 Ca 0.28 -1.31 0.23 0.00 -1.18 0.00 0.00 61.69 59.72 2bze s THR 403 Cb -0.12 -2.28 -0.13 0.00 1.34 0.00 0.00 72.50 71.31 2bze s THR 403 CO 0.21 0.00 1.12 0.00 -0.54 0.00 0.00 174.62 175.40 2bze n ALA 404 N -1.89 4.17 -4.06 3.99 0.00 -1.26 -4.77 120.51 116.69 2bze n ALA 404 Ca 0.05 -0.48 -0.32 0.00 0.00 0.00 0.00 53.44 52.68 2bze n ALA 404 Cb 0.63 -0.93 -0.16 0.00 0.00 0.00 0.00 19.45 18.99 2bze n ALA 404 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2bze s LYS 405 N -3.02 2.87 -0.49 0.00 2.36 -1.26 -5.06 119.74 115.13 2bze s LYS 405 Ca 0.09 -0.78 -0.28 0.00 -2.55 0.00 0.00 55.97 52.44 2bze s LYS 405 Cb 0.17 -2.47 0.03 0.00 -1.05 0.00 0.00 37.83 34.50 2bze s LYS 405 CO 0.80 -0.20 1.10 0.08 1.55 0.00 0.00 175.35 178.68 2bze s VAL 406 N 1.28 4.23 0.62 4.02 1.01 -1.26 -4.29 120.40 126.01 2bze s VAL 406 Ca 0.04 1.07 -0.04 0.00 0.00 0.00 0.00 61.98 63.05 2bze s VAL 406 Cb -0.13 -4.59 0.04 0.00 0.00 0.00 0.00 36.38 31.69 2bze s VAL 406 CO -0.12 -1.03 0.90 -0.72 0.00 0.00 0.00 175.10 174.14 2bze s TYR 407 N 4.39 2.99 -0.44 5.22 -0.85 -0.85 -4.84 117.35 122.96 2bze s TYR 407 Ca 0.45 0.35 -0.15 0.00 -0.52 0.00 0.00 57.07 57.20 2bze s TYR 407 Cb -0.08 -2.92 0.05 0.00 0.38 0.00 0.00 41.96 39.40 2bze s TYR 407 CO 0.30 -1.07 0.34 -1.14 -1.52 0.00 0.00 175.55 172.46 2bze s GLN 408 N -5.01 2.94 0.40 -3.49 2.00 -1.26 -3.91 119.66 111.32 2bze s GLN 408 Ca 0.57 -1.24 0.07 0.00 -2.00 0.00 0.00 55.36 52.77 2bze s GLN 408 Cb -0.11 -4.03 -0.06 0.00 0.80 0.00 0.00 33.01 29.61 2bze s GLN 408 CO 0.43 -0.92 0.09 -1.17 -0.50 0.00 0.00 175.29 173.22 2bze s LEU 409 N 1.63 3.00 -0.01 3.68 2.96 -1.25 -5.04 118.68 123.65 2bze s LEU 409 Ca 0.04 -1.19 -0.36 0.00 -0.22 0.00 0.00 54.13 52.40 2bze s LEU 409 Cb -0.22 -1.20 -0.18 0.00 0.50 0.00 0.00 46.19 45.08 2bze s LEU 409 CO 0.07 -0.46 0.96 0.61 -1.32 0.00 0.00 176.35 176.21 2bze n GLY 410 N -1.09 -0.24 3.55 7.98 0.00 -1.26 -3.70 105.19 110.42 2bze n GLY 410 Ca -0.03 0.68 -0.17 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.19 3.05 -0.02 0.00 -1.26 -4.82 105.19 103.32 2bze n GLY 411 Ca 0.18 0.30 -0.11 0.00 0.00 0.00 0.00 46.02 46.39 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 12.17 0.37 -0.26 2.61 -1.32 -1.24 -5.11 115.64 122.85 2bze s THR 412 Ca 1.01 -1.17 0.01 0.00 -1.21 0.00 0.00 61.69 60.33 2bze s THR 412 Cb -0.27 -0.67 0.07 0.00 -1.51 0.00 0.00 72.50 70.12 2bze s THR 412 CO 0.18 -0.53 -0.02 -0.13 -2.21 0.00 0.00 174.62 171.91 2bze s ARG 413 N -1.97 1.53 -0.01 7.08 3.00 -1.26 -3.85 118.95 123.47 2bze s ARG 413 Ca -0.08 -1.17 0.01 0.00 0.00 0.00 0.00 55.73 54.48 2bze s ARG 413 Cb -0.07 -2.64 0.01 0.00 0.00 0.00 0.00 34.95 32.25 2bze s ARG 413 CO -0.02 -0.70 -0.02 -0.08 0.00 0.00 0.00 175.30 174.48 2bze s THR 414 N 1.32 0.21 -0.93 0.02 -1.32 -1.25 -4.97 115.64 108.72 2bze s THR 414 Ca -0.01 -0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 2bze s THR 414 Cb -0.19 -0.21 0.32 0.00 -1.51 0.00 0.00 72.50 70.91 2bze s THR 414 CO -0.09 0.08 1.60 -0.46 -2.21 0.00 0.00 174.62 173.54 2bze n ASN 415 N 3.30 6.62 -3.88 8.08 6.94 -1.26 -2.01 115.26 133.04 2bze n ASN 415 Ca -0.16 -3.67 -0.11 0.00 -0.02 0.00 0.00 54.58 50.62 2bze n ASN 415 Cb 0.57 -1.03 -0.11 0.00 -2.36 0.00 0.00 39.78 36.85 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 -4.03 0.37 0.23 -3.83 0.00 -1.26 -0.07 119.74 111.15 2bze s LYS 416 Ca 0.41 -0.31 0.10 0.00 0.00 0.00 0.00 55.97 56.17 2bze s LYS 416 Cb 0.20 0.15 -0.05 0.00 0.00 0.00 0.00 37.83 38.14 2bze s LYS 416 CO -0.12 -0.08 -0.18 0.20 0.00 0.00 0.00 175.35 175.18 2bze s GLY 417 N -1.06 1.64 0.25 0.59 0.00 0.10 -4.46 107.32 104.38 2bze s GLY 417 Ca -0.12 -1.74 -0.03 0.00 0.00 0.00 0.00 44.72 42.84 2bze s GLY 417 CO 0.01 -1.82 0.48 1.08 0.00 0.00 0.00 173.10 172.85 2bze s LEU 418 N -3.30 4.13 -0.43 0.66 2.01 -0.95 0.13 118.68 120.93 2bze s LEU 418 Ca 0.25 0.57 -0.23 0.00 0.01 0.00 0.00 54.13 54.72 2bze s LEU 418 Cb -0.03 -3.37 0.02 0.00 0.01 0.00 0.00 46.19 42.82 2bze s LEU 418 CO 0.10 -0.13 0.81 -1.58 1.01 0.00 0.00 176.35 176.56 2bze s GLN 419 N -3.46 3.51 -0.05 1.70 2.00 -0.84 -2.40 119.66 120.12 2bze s GLN 419 Ca 0.41 0.04 -0.12 0.00 -2.00 0.00 0.00 55.36 53.69 2bze s GLN 419 Cb -0.11 -3.91 -0.05 0.00 0.80 0.00 0.00 33.01 29.75 2bze s GLN 419 CO 0.30 -1.07 0.32 -0.51 -0.50 0.00 0.00 175.29 173.82 2bze s LEU 420 N 3.32 4.44 -0.08 3.68 1.43 0.16 0.09 118.68 131.71 2bze s LEU 420 Ca 0.31 0.78 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 2bze s LEU 420 Cb -0.12 -2.41 0.02 0.00 0.03 0.00 0.00 46.19 43.72 2bze s LEU 420 CO 0.22 0.34 -0.06 -0.60 0.23 0.00 0.00 176.35 176.49 2bze s ARG 421 N -0.99 1.17 -0.67 1.70 3.52 0.53 -0.26 118.95 123.95 2bze s ARG 421 Ca 0.21 -0.15 -0.10 0.00 -0.13 0.00 0.00 55.73 55.55 2bze s ARG 421 Cb -0.15 -1.25 0.17 0.00 -1.56 0.00 0.00 34.95 32.16 2bze s ARG 421 CO 0.10 -0.20 0.57 -1.01 -0.81 0.00 0.00 175.30 173.95 2bze s HIS 422 N 1.46 3.55 0.00 5.12 3.76 -0.84 -0.17 115.29 128.18 2bze s HIS 422 Ca -0.01 -2.08 0.00 0.00 -0.15 0.00 0.00 55.06 52.82 2bze s HIS 422 Cb -0.13 -3.59 0.00 0.00 1.11 0.00 0.00 32.58 29.96 2bze s HIS 422 CO -0.04 -0.96 0.00 0.41 -0.85 0.00 0.00 174.74 173.30 2bze n GLY 423 N 4.17 2.98 3.14 -2.22 0.00 -1.26 -2.63 105.19 109.37 2bze n GLY 423 Ca 0.05 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 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 6.06 -0.28 1.61 2.20 -1.26 -4.88 114.94 114.39 2bze s ASN 424 Ca 0.00 -3.55 -0.04 0.00 -0.94 0.00 0.00 52.86 48.33 2bze s ASN 424 Cb 0.00 -1.94 0.10 0.00 -2.00 0.00 0.00 41.25 37.41 2bze s ASN 424 CO 0.00 -0.23 0.15 -0.62 -2.94 0.00 0.00 177.10 173.46 2bze s ASP 425 N 0.21 3.14 -0.52 3.54 3.68 -1.08 -5.04 116.67 120.61 2bze s ASP 425 Ca 0.26 -1.15 -0.16 0.00 2.13 0.00 0.00 52.55 53.64 2bze s ASP 425 Cb -0.09 -0.20 0.11 0.00 -1.45 0.00 0.00 42.92 41.29 2bze s ASP 425 CO -0.11 -0.42 0.46 -1.58 0.13 0.00 0.00 175.17 173.65 2bze s GLN 426 N 2.15 2.97 0.32 4.34 0.74 -1.26 -1.98 119.66 126.94 2bze s GLN 426 Ca 0.09 -1.60 0.08 0.00 0.05 0.00 0.00 55.36 53.97 2bze s GLN 426 Cb -0.16 -4.23 -0.06 0.00 1.10 0.00 0.00 33.01 29.66 2bze s GLN 426 CO -0.34 -1.23 -0.06 1.03 -0.55 0.00 0.00 175.29 174.13 2bze s ARG 427 N 1.60 1.71 -0.07 1.67 0.52 0.64 -4.98 118.95 120.05 2bze s ARG 427 Ca 0.03 -1.89 0.04 0.00 -0.52 0.00 0.00 55.73 53.39 2bze s ARG 427 Cb -0.28 -1.43 -0.02 0.00 0.52 0.00 0.00 34.95 33.74 2bze s ARG 427 CO 0.04 0.07 -0.17 0.54 0.02 0.00 0.00 175.30 175.79 2bze s VAL 428 N -2.82 2.75 0.06 3.52 0.11 -1.26 0.36 120.40 123.12 2bze s VAL 428 Ca 0.32 -0.82 0.03 0.00 -2.93 0.00 0.00 61.98 58.58 2bze s VAL 428 Cb 0.04 -2.07 -0.03 0.00 -1.53 0.00 0.00 36.38 32.79 2bze s VAL 428 CO 0.15 0.57 -0.10 -0.36 -3.33 0.00 0.00 175.10 172.03 2bze s PHE 429 N -0.32 0.87 0.41 1.54 0.08 -1.01 -4.88 117.98 114.66 2bze s PHE 429 Ca 0.02 -0.50 0.01 0.00 0.12 0.00 0.00 56.93 56.58 2bze s PHE 429 Cb -0.13 -0.50 -0.01 0.00 -0.57 0.00 0.00 43.02 41.81 2bze s PHE 429 CO 0.02 -0.04 0.62 1.03 -0.10 0.00 0.00 175.22 176.75 2bze s ARG 430 N -1.73 3.18 0.47 0.44 3.00 -1.26 -2.24 118.95 120.81 2bze s ARG 430 Ca -0.06 -0.51 0.32 0.00 0.00 0.00 0.00 55.73 55.48 2bze s ARG 430 Cb -0.09 -2.62 1.63 0.00 0.00 0.00 0.00 34.95 33.87 2bze s ARG 430 CO 0.01 -0.12 1.97 -0.07 0.00 0.00 0.00 175.30 177.09 2bze h LEU 431 N 0.55 0.00 -0.83 2.53 4.07 -1.98 -2.20 115.31 117.45 2bze h LEU 431 Ca -0.47 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.40 2bze h LEU 431 Cb 1.24 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.97 2bze h LEU 431 CO 0.58 0.00 -0.10 -0.33 -1.08 0.00 0.00 178.44 177.50 2bze h GLU 432 N 0.00 0.76 -0.13 1.13 5.08 -1.96 -2.93 114.58 116.53 2bze h GLU 432 Ca 0.00 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2bze h GLU 432 Cb 0.14 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2bze h GLU 432 CO 0.00 0.84 0.00 1.19 -1.00 0.00 0.00 179.01 180.04 2bze n PHE 433 N -4.17 0.17 -3.30 4.33 3.72 -0.83 -4.82 117.46 112.56 2bze n PHE 433 Ca 0.01 -0.08 -0.38 0.00 -0.05 0.00 0.00 57.45 56.95 2bze n PHE 433 Cb 0.36 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.84 2bze n PHE 433 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2bze s VAL 434 N -1.83 5.17 0.46 -4.37 1.01 -1.11 -3.01 120.40 116.72 2bze s VAL 434 Ca 0.33 0.99 -0.01 0.00 0.00 0.00 0.00 61.98 63.29 2bze s VAL 434 Cb 0.17 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 2bze s VAL 434 CO 0.27 0.33 0.70 -0.44 0.00 0.00 0.00 175.10 175.96 2bze s SER 435 N 0.57 5.89 -0.03 3.32 0.01 -0.09 -4.44 113.70 118.94 2bze s SER 435 Ca 0.27 0.42 0.13 0.00 1.31 0.00 0.00 55.95 58.09 2bze s SER 435 Cb -0.15 -1.68 0.40 0.00 0.21 0.00 0.00 66.02 64.80 2bze s SER 435 CO 0.11 -0.69 1.34 0.59 0.41 0.00 0.00 173.24 174.99 2bze n ASN 436 N -2.13 3.30 -4.83 2.44 3.02 -1.26 -3.86 115.26 111.93 2bze n ASN 436 Ca 0.01 -2.17 -0.32 0.00 -0.03 0.00 0.00 54.58 52.07 2bze n ASN 436 Cb 0.57 -0.33 -0.02 0.00 -0.61 0.00 0.00 39.78 39.39 2bze n ASN 436 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2bze s GLN 437 N -1.31 3.77 0.61 3.52 1.11 -1.26 -5.00 119.66 121.10 2bze s GLN 437 Ca 0.31 1.05 -0.10 0.00 0.01 0.00 0.00 55.36 56.63 2bze s GLN 437 Cb 0.18 -2.11 -0.02 0.00 -1.01 0.00 0.00 33.01 30.05 2bze s GLN 437 CO 0.17 -0.42 0.99 -1.21 0.01 0.00 0.00 175.29 174.83 2bze s GLU 438 N -4.01 3.37 0.02 2.91 0.41 -1.26 -4.89 118.70 115.26 2bze s GLU 438 Ca 0.61 0.52 -0.27 0.00 -0.41 0.00 0.00 54.97 55.42 2bze s GLU 438 Cb -0.12 -2.14 -0.04 0.00 -1.78 0.00 0.00 34.13 30.05 2bze s GLU 438 CO 0.32 -0.61 0.87 -0.06 -0.49 0.00 0.00 175.26 175.28 2bze s PHE 439 N -3.12 3.70 0.34 1.61 0.08 -1.26 -5.06 117.98 114.27 2bze s PHE 439 Ca 0.54 1.58 0.07 0.00 0.12 0.00 0.00 56.93 59.23 2bze s PHE 439 Cb -0.11 -2.97 -0.01 0.00 -0.57 0.00 0.00 43.02 39.37 2bze s PHE 439 CO 0.51 0.13 0.48 0.95 -0.10 0.00 0.00 175.22 177.19 2bze s THR 440 N 0.47 4.02 0.42 0.64 -4.23 -1.26 -4.73 115.64 110.98 2bze s THR 440 Ca 0.45 -0.99 0.09 0.00 -1.18 0.00 0.00 61.69 60.05 2bze s THR 440 Cb -0.21 -3.39 0.25 0.00 1.34 0.00 0.00 72.50 70.49 2bze s THR 440 CO 0.25 -0.15 2.05 1.05 -0.54 0.00 0.00 174.62 177.28 2bze h GLU 441 N 0.88 0.41 -0.22 3.99 4.11 -1.97 0.30 114.58 122.07 2bze h GLU 441 Ca -0.45 -0.03 -0.04 0.00 0.07 0.00 0.00 59.36 58.90 2bze h GLU 441 Cb 1.26 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 2bze h GLU 441 CO 0.52 0.30 -0.03 1.03 0.07 0.00 0.00 179.01 180.91 2bze h SER 442 N 0.41 0.41 -0.02 3.06 0.87 -1.98 0.14 113.55 116.44 2bze h SER 442 Ca 0.11 -0.34 -0.16 0.00 -1.23 0.00 0.00 61.79 60.17 2bze h SER 442 Cb 0.02 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2bze h SER 442 CO -0.02 0.65 -0.53 -0.33 -0.53 0.00 0.00 176.83 176.07 2bze h GLU 443 N 0.16 0.60 0.05 2.24 5.08 -1.82 -2.39 114.58 118.50 2bze h GLU 443 Ca 0.06 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2bze h GLU 443 Cb 0.46 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2bze h GLU 443 CO 0.02 0.98 -0.02 0.35 -1.00 0.00 0.00 179.01 179.33 2bze h PHE 444 N 0.46 -0.06 0.00 4.33 3.04 -0.74 -2.37 116.94 121.60 2bze h PHE 444 Ca 0.01 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.94 2bze h PHE 444 Cb 1.08 0.02 -0.00 0.00 2.56 0.00 0.00 35.95 39.61 2bze h PHE 444 CO 0.05 0.02 -0.12 0.00 -2.02 0.00 0.00 178.31 176.24 2bze h MET 445 N -0.12 0.00 -0.10 1.11 -0.00 -0.62 0.15 114.93 115.34 2bze h MET 445 Ca -0.01 0.00 -0.19 0.00 -0.00 0.00 0.00 59.70 59.50 2bze h MET 445 Cb 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.70 2bze h MET 445 CO 0.01 0.12 -0.74 0.87 -0.00 0.00 0.00 176.91 177.17 2bze h LYS 446 N 0.00 0.53 -0.35 -0.10 1.79 -1.20 -1.30 116.57 115.93 2bze h LYS 446 Ca -0.00 -0.43 -0.15 0.00 -2.18 0.00 0.00 60.65 57.90 2bze h LYS 446 Cb 0.32 0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 2bze h LYS 446 CO 0.02 1.05 -0.35 2.35 -1.08 0.00 0.00 179.45 181.44 2bze h TRP 447 N 0.36 1.03 -0.49 -1.35 7.01 -0.70 -1.89 115.95 119.92 2bze h TRP 447 Ca -0.04 -0.31 0.10 0.00 2.11 0.00 0.00 58.89 60.75 2bze h TRP 447 Cb 1.33 -0.22 -0.09 0.00 -2.10 0.00 0.00 29.16 28.08 2bze h TRP 447 CO 0.06 1.11 -0.07 -0.22 -2.79 0.00 0.00 178.44 176.53 2bze h LYS 448 N 0.65 0.05 0.00 2.65 1.63 -0.69 0.79 116.57 121.64 2bze h LYS 448 Ca 0.06 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 2bze h LYS 448 Cb 0.94 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2bze h LYS 448 CO 0.09 0.03 0.00 1.05 -3.45 0.00 0.00 179.45 177.17 2bze h GLU 449 N 0.05 0.00 0.17 1.90 4.11 -1.07 0.12 114.58 119.86 2bze h GLU 449 Ca 0.24 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 59.37 2bze h GLU 449 Cb 0.37 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.65 2bze h GLU 449 CO -0.46 0.00 -1.30 0.00 0.07 0.00 0.00 179.01 177.32 2bze h ALA 450 N 2.25 -0.07 -0.14 1.06 0.00 -0.17 -1.64 119.26 120.56 2bze h ALA 450 Ca 0.00 -0.79 -0.05 0.00 0.00 0.00 0.00 54.91 54.07 2bze h ALA 450 Cb 0.53 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2bze h ALA 450 CO 0.00 0.66 -0.11 0.52 0.00 0.00 0.00 179.25 180.32 2bze h MET 451 N 0.19 0.32 -0.55 0.00 2.86 -0.57 -1.45 114.93 115.73 2bze h MET 451 Ca -0.21 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.23 2bze h MET 451 Cb 1.98 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.62 2bze h MET 451 CO 0.25 0.69 0.18 0.35 1.06 0.00 0.00 176.91 179.44 2bze h PHE 452 N -0.05 0.88 0.00 -0.22 3.57 -0.85 0.28 116.94 120.54 2bze h PHE 452 Ca 0.02 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 2bze h PHE 452 Cb 0.62 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.10 2bze h PHE 452 CO 0.08 0.74 -0.13 1.03 -2.23 0.00 0.00 178.31 177.80 2bze h SER 453 N 0.76 0.00 1.58 0.41 0.87 -1.31 -1.92 113.55 113.94 2bze h SER 453 Ca 0.18 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2bze h SER 453 Cb 0.27 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 2bze h SER 453 CO -0.01 0.13 -0.14 0.00 -0.53 0.00 0.00 176.83 176.27 2bze h ALA 454 N 1.87 0.92 0.00 6.23 0.00 -0.09 -3.47 119.26 124.72 2bze h ALA 454 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bze h ALA 454 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2bze h ALA 454 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2bze n GLY 455 N 1.22 0.67 3.86 0.00 0.00 -0.17 -4.87 105.19 105.90 2bze n GLY 455 Ca 0.04 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.54 3.65 0.27 1.61 -1.94 0.83 -4.98 119.30 118.20 2bze s MET 456 Ca 0.00 0.09 -0.29 0.00 -1.71 0.00 0.00 55.69 53.79 2bze s MET 456 Cb 0.00 -3.17 -0.09 0.00 2.01 0.00 0.00 34.83 33.57 2bze s MET 456 CO 0.00 0.72 0.95 -1.14 -0.01 0.00 0.00 175.02 175.54 2bze s GLN 457 N -1.21 4.74 0.53 2.03 0.74 -1.26 -3.81 119.66 121.42 2bze s GLN 457 Ca 0.21 1.45 -0.20 0.00 0.05 0.00 0.00 55.36 56.88 2bze s GLN 457 Cb -0.14 -3.10 -0.06 0.00 1.10 0.00 0.00 33.01 30.81 2bze s GLN 457 CO 0.10 0.41 1.11 -0.51 -0.55 0.00 0.00 175.29 175.86 2bze s LEU 458 N -1.52 3.76 0.88 3.68 2.01 -1.26 -5.02 118.68 121.22 2bze s LEU 458 Ca 0.45 2.14 -0.12 0.00 0.01 0.00 0.00 54.13 56.60 2bze s LEU 458 Cb -0.24 -4.58 0.12 0.00 0.01 0.00 0.00 46.19 41.50 2bze s LEU 458 CO 0.30 -1.15 1.13 -2.16 1.01 0.00 0.00 176.35 175.47 2bze s PRO 459 N -3.28 1.39 0.26 1.29 0.04 -1.26 -4.78 135.00 128.66 2bze s PRO 459 Ca 0.72 0.38 0.07 0.00 0.04 0.00 0.00 61.00 62.21 2bze s PRO 459 Cb -0.23 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 2bze s PRO 459 CO 0.26 -2.04 0.23 0.95 0.04 0.00 0.00 177.00 176.43 2bze s THR 460 N -3.25 4.38 -0.14 1.26 -4.23 -1.26 -0.02 115.64 112.37 2bze s THR 460 Ca 0.63 -1.36 0.29 0.00 -1.18 0.00 0.00 61.69 60.07 2bze s THR 460 Cb -0.15 -3.41 0.32 0.00 1.34 0.00 0.00 72.50 70.61 2bze s THR 460 CO 0.53 -0.32 1.87 -0.07 -0.54 0.00 0.00 174.62 176.09 2bze h LEU 461 N 1.42 0.00 -0.22 4.79 -0.00 -1.79 -1.69 115.31 117.83 2bze h LEU 461 Ca -0.48 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.35 2bze h LEU 461 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.89 2bze h LEU 461 CO 0.60 0.00 -0.06 -0.78 -0.00 0.00 0.00 178.44 178.20 2bze h ASP 462 N 0.00 0.43 -0.52 -0.43 3.58 -1.85 0.33 116.42 117.96 2bze h ASP 462 Ca 0.00 -0.37 -0.07 0.00 0.42 0.00 0.00 57.03 57.01 2bze h ASP 462 Cb 0.37 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 2bze h ASP 462 CO 0.00 0.70 0.05 -0.33 -2.88 0.00 0.00 179.24 176.79 2bze h GLU 463 N 0.15 0.89 -0.73 0.28 5.08 -1.72 0.25 114.58 118.77 2bze h GLU 463 Ca 0.05 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.17 2bze h GLU 463 Cb 0.52 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 2bze h GLU 463 CO 0.02 0.89 0.48 0.82 -1.00 0.00 0.00 179.01 180.22 2bze h ILE 464 N 0.77 1.17 -0.40 3.13 1.08 -1.32 0.13 117.51 122.07 2bze h ILE 464 Ca 0.16 -0.34 -0.08 0.00 -0.39 0.00 0.00 64.86 64.21 2bze h ILE 464 Cb 0.45 0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 34.29 2bze h ILE 464 CO 0.02 0.18 -0.10 -1.13 -0.69 0.00 0.00 178.15 176.43 2bze h ASN 465 N 0.98 0.68 -0.54 1.72 -0.00 -0.04 0.16 115.58 118.54 2bze h ASN 465 Ca 0.27 -0.19 -0.09 0.00 -0.00 0.00 0.00 56.30 56.29 2bze h ASN 465 Cb -0.09 -0.18 -0.02 0.00 -0.00 0.00 0.00 38.32 38.03 2bze h ASN 465 CO -0.07 0.81 -0.02 0.11 -0.00 0.00 0.00 177.43 178.27 2bze h LYS 466 N 0.64 0.97 -0.09 6.67 1.79 -0.16 0.18 116.57 126.57 2bze h LYS 466 Ca 0.11 -0.32 -0.07 0.00 -2.18 0.00 0.00 60.65 58.19 2bze h LYS 466 Cb 0.54 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.11 2bze h LYS 466 CO 0.03 0.99 -0.22 0.87 -1.08 0.00 0.00 179.45 180.04 2bze h LYS 467 N 0.85 0.30 -0.02 3.15 1.79 -0.32 -0.84 116.57 121.48 2bze h LYS 467 Ca 0.15 -0.21 -0.04 0.00 -2.18 0.00 0.00 60.65 58.38 2bze h LYS 467 Cb 0.56 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 2bze h LYS 467 CO 0.03 0.82 -0.16 1.05 -1.08 0.00 0.00 179.45 180.10 2bze h GLU 468 N -0.16 0.03 -0.18 3.15 4.11 -0.68 0.13 114.58 120.98 2bze h GLU 468 Ca -0.00 -0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 2bze h GLU 468 Cb 0.82 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 2bze h GLU 468 CO 0.05 0.19 0.11 1.25 0.07 0.00 0.00 179.01 180.68 2bze h LEU 469 N 0.02 0.21 -1.19 3.06 7.12 -0.81 0.50 115.31 124.22 2bze h LEU 469 Ca 0.00 -0.04 -0.05 0.00 0.13 0.00 0.00 57.88 57.93 2bze h LEU 469 Cb 0.31 -0.05 -0.02 0.00 -0.53 0.00 0.00 40.66 40.36 2bze h LEU 469 CO 0.02 0.19 0.01 0.28 -0.13 0.00 0.00 178.44 178.81 2bze h SER 470 N 0.22 0.53 0.10 1.25 0.02 0.47 -0.42 113.55 115.72 2bze h SER 470 Ca 0.06 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 2bze h SER 470 Cb 0.01 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2bze h SER 470 CO -0.01 0.60 -0.05 0.40 -1.14 0.00 0.00 176.83 176.62 2bze h ILE 471 N 0.54 1.06 -0.07 3.27 1.08 -0.49 -1.97 117.51 120.93 2bze h ILE 471 Ca 0.12 -0.65 -0.10 0.00 -0.39 0.00 0.00 64.86 63.84 2bze h ILE 471 Cb 0.33 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.55 2bze h ILE 471 CO 0.01 0.16 -0.40 0.07 -0.69 0.00 0.00 178.15 177.29 2bze h LYS 472 N -0.44 0.16 -0.13 2.37 2.10 -0.46 -1.57 116.57 118.59 2bze h LYS 472 Ca -0.01 -0.07 -0.14 0.00 -2.00 0.00 0.00 60.65 58.42 2bze h LYS 472 Cb 0.36 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.68 2bze h LYS 472 CO 0.02 0.54 -0.53 0.93 -2.00 0.00 0.00 179.45 178.41 2bze h GLU 473 N 0.13 0.38 -0.12 0.07 4.39 -1.07 -2.31 114.58 116.05 2bze h GLU 473 Ca 0.01 -0.23 -0.04 0.00 0.34 0.00 0.00 59.36 59.44 2bze h GLU 473 Cb 0.78 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.45 2bze h GLU 473 CO 0.06 0.82 -0.10 0.00 -1.16 0.00 0.00 179.01 178.63 2bze h ALA 474 N 1.14 0.17 0.00 3.43 0.00 -0.79 -3.12 119.26 120.09 2bze h ALA 474 Ca 0.01 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 2bze h ALA 474 Cb 1.03 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2bze h ALA 474 CO 0.09 0.00 -0.22 1.37 0.00 0.00 0.00 179.25 180.50 2bze h LEU 475 N -0.10 0.00 0.00 0.00 8.10 -1.34 -3.52 115.31 118.45 2bze h LEU 475 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.01 2bze h LEU 475 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.82 2bze h LEU 475 CO 0.02 0.22 0.00 -3.20 -4.11 0.00 0.00 178.44 171.37