#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3aez s PRO 7 N 0.00 1.52 -0.16 5.31 0.02 -1.26 -5.04 135.00 135.39 3aez s PRO 7 Ca 0.00 1.55 -0.15 0.00 0.02 0.00 0.00 61.00 62.42 3aez s PRO 7 Cb 0.00 -1.78 0.04 0.00 0.02 0.00 0.00 34.50 32.78 3aez s PRO 7 CO 0.00 -2.26 0.42 0.45 -0.33 0.00 0.00 177.00 175.28 3aez s SER 8 N -2.61 -0.44 0.30 2.53 0.15 -1.26 -5.01 113.70 107.36 3aez s SER 8 Ca 0.68 0.85 0.23 0.00 0.70 0.00 0.00 55.95 58.41 3aez s SER 8 Cb -0.24 0.86 1.10 0.00 -1.71 0.00 0.00 66.02 66.04 3aez s SER 8 CO 0.54 -0.15 1.69 -0.81 1.20 0.00 0.00 173.24 175.71 3aez n PRO 9 N 2.87 0.17 -4.26 5.44 -0.05 -1.26 -4.82 135.00 133.08 3aez n PRO 9 Ca -0.13 0.55 -0.24 0.00 -0.05 0.00 0.00 63.50 63.62 3aez n PRO 9 Cb 0.57 -1.93 -0.07 0.00 -0.05 0.00 0.00 33.50 32.02 3aez n PRO 9 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 175.50 176.16 3aez s TYR 10 N -3.46 2.76 -0.06 0.54 1.51 -1.26 -0.13 117.35 117.25 3aez s TYR 10 Ca 0.00 -0.19 0.03 0.00 -1.01 0.00 0.00 57.07 55.90 3aez s TYR 10 Cb 0.08 -1.26 0.01 0.00 -0.11 0.00 0.00 41.96 40.67 3aez s TYR 10 CO 0.28 0.58 -0.14 0.54 -1.11 0.00 0.00 175.55 175.71 3aez s VAL 11 N -2.11 1.21 0.10 0.71 0.11 0.79 -4.84 120.40 116.38 3aez s VAL 11 Ca 0.30 -0.55 -0.17 0.00 -2.93 0.00 0.00 61.98 58.63 3aez s VAL 11 Cb -0.07 -1.08 -0.07 0.00 -1.53 0.00 0.00 36.38 33.62 3aez s VAL 11 CO 0.19 0.37 0.56 -1.61 -3.33 0.00 0.00 175.10 171.28 3aez s GLU 12 N 0.46 4.11 0.21 1.54 0.41 -1.26 -0.72 118.70 123.45 3aez s GLU 12 Ca -0.11 0.64 0.10 0.00 -0.41 0.00 0.00 54.97 55.19 3aez s GLU 12 Cb -0.14 -3.11 -0.05 0.00 -1.78 0.00 0.00 34.13 29.05 3aez s GLU 12 CO 0.03 0.57 -0.18 -0.06 -0.49 0.00 0.00 175.26 175.13 3aez s PHE 13 N -1.25 1.99 0.57 1.61 0.40 0.39 -5.00 117.98 116.68 3aez s PHE 13 Ca 0.32 -0.44 0.08 0.00 -0.60 0.00 0.00 56.93 56.29 3aez s PHE 13 Cb -0.18 -0.93 0.08 0.00 0.51 0.00 0.00 43.02 42.50 3aez s PHE 13 CO 0.19 0.47 0.79 0.16 0.70 0.00 0.00 175.22 177.53 3aez s ASP 14 N -3.09 5.08 0.31 1.36 1.47 -1.26 -1.77 116.67 118.77 3aez s ASP 14 Ca 0.22 -0.70 -0.00 0.00 1.18 0.00 0.00 52.55 53.26 3aez s ASP 14 Cb -0.04 0.08 0.48 0.00 -0.34 0.00 0.00 42.92 43.10 3aez s ASP 14 CO 0.10 -1.32 1.90 -0.09 0.68 0.00 0.00 175.17 176.43 3aez h ARG 15 N 0.14 0.86 0.25 2.11 2.43 -1.83 0.48 114.38 118.82 3aez h ARG 15 Ca -0.32 -0.12 0.01 0.00 -0.81 0.00 0.00 59.98 58.74 3aez h ARG 15 Cb 1.28 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 3aez h ARG 15 CO 0.42 0.68 -0.37 0.00 -1.51 0.00 0.00 179.97 179.18 3aez h ARG 16 N 0.85 -0.67 -0.64 0.20 2.47 -1.95 0.70 114.38 115.35 3aez h ARG 16 Ca 0.21 0.05 0.01 0.00 -1.26 0.00 0.00 59.98 58.98 3aez h ARG 16 Cb 0.12 0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.56 3aez h ARG 16 CO -0.02 -0.44 0.42 1.96 0.56 0.00 0.00 179.97 182.44 3aez h GLN 17 N -0.69 0.83 -0.23 0.04 4.20 -1.89 -2.97 115.11 114.40 3aez h GLN 17 Ca -0.00 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.59 3aez h GLN 17 Cb 0.66 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 3aez h GLN 17 CO -0.14 0.55 -0.11 2.35 -0.67 0.00 0.00 178.83 180.81 3aez h TRP 18 N 0.86 0.55 0.00 2.96 2.91 -0.76 -3.11 115.95 119.36 3aez h TRP 18 Ca 0.24 -0.14 -0.04 0.00 1.13 0.00 0.00 58.89 60.08 3aez h TRP 18 Cb -0.09 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 28.43 3aez h TRP 18 CO -0.03 0.76 -0.20 0.07 -1.03 0.00 0.00 178.44 178.01 3aez h ARG 19 N 0.19 0.00 -0.02 2.65 0.11 -0.76 -1.35 114.38 115.20 3aez h ARG 19 Ca 0.05 0.00 0.01 0.00 0.10 0.00 0.00 59.98 60.14 3aez h ARG 19 Cb 0.61 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.69 3aez h ARG 19 CO 0.03 0.20 0.09 0.00 0.10 0.00 0.00 179.97 180.39 3aez h ALA 20 N 1.80 1.22 -0.25 0.08 0.00 -1.45 -1.05 119.26 119.61 3aez h ALA 20 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3aez h ALA 20 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3aez h ALA 20 CO 0.03 -0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.46 3aez n LEU 21 N -3.21 1.38 -0.01 0.00 4.77 -0.51 -3.68 117.00 115.74 3aez n LEU 21 Ca -0.02 -0.69 -0.02 0.00 -0.03 0.00 0.00 56.01 55.24 3aez n LEU 21 Cb 0.16 -0.18 0.23 0.00 -2.33 0.00 0.00 43.42 41.30 3aez n LEU 21 CO 0.20 0.33 0.84 -0.09 -1.33 0.00 0.00 177.39 177.35 3aez h ARG 22 N 1.45 0.55 0.00 3.23 2.43 -1.35 -3.42 114.38 117.28 3aez h ARG 22 Ca 0.00 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3aez h ARG 22 Cb 0.36 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 3aez h ARG 22 CO 0.01 0.66 0.00 -1.33 -1.51 0.00 0.00 179.97 177.79 3aez n MET 23 N -4.20 0.00 -0.92 0.20 2.81 -1.24 -2.88 117.12 110.88 3aez n MET 23 Ca 0.01 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.87 3aez n MET 23 Cb 0.32 0.00 0.17 0.00 -0.71 0.00 0.00 33.22 33.00 3aez n MET 23 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3aez n SER 24 N 2.90 2.56 -4.66 7.83 7.64 -1.26 -5.00 113.62 123.62 3aez n SER 24 Ca 0.00 -3.86 -0.54 0.00 1.01 0.00 0.00 58.87 55.48 3aez n SER 24 Cb 0.00 -0.52 -0.06 0.00 -1.01 0.00 0.00 64.21 62.61 3aez n SER 24 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3aez n THR 25 N -1.04 0.19 -2.33 0.44 -1.04 -1.14 -4.95 114.28 104.42 3aez n THR 25 Ca 0.27 -0.03 -0.39 0.00 -2.04 0.00 0.00 64.05 61.86 3aez n THR 25 Cb 0.81 -1.11 -0.03 0.00 -1.82 0.00 0.00 70.33 68.19 3aez n THR 25 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3aez s PRO 26 N 2.25 4.25 -0.38 -2.82 0.02 -1.26 -5.03 135.00 132.03 3aez s PRO 26 Ca 0.92 1.87 -0.22 0.00 0.02 0.00 0.00 61.00 63.59 3aez s PRO 26 Cb -0.99 -2.85 0.01 0.00 0.02 0.00 0.00 34.50 30.69 3aez s PRO 26 CO 0.56 -0.16 0.73 -1.17 -0.33 0.00 0.00 177.00 176.63 3aez s LEU 27 N -2.14 4.21 -0.10 -5.54 2.96 -1.26 -4.94 118.68 111.88 3aez s LEU 27 Ca 0.53 0.17 0.15 0.00 -0.22 0.00 0.00 54.13 54.76 3aez s LEU 27 Cb -0.32 -2.92 0.50 0.00 0.50 0.00 0.00 46.19 43.95 3aez s LEU 27 CO 0.41 -0.72 1.42 0.00 -1.32 0.00 0.00 176.35 176.14 3aez n ALA 28 N 6.33 2.73 -3.04 5.97 0.00 -1.26 -4.97 120.51 126.27 3aez n ALA 28 Ca 0.01 -1.71 -0.27 0.00 0.00 0.00 0.00 53.44 51.48 3aez n ALA 28 Cb 0.48 -0.69 -0.16 0.00 0.00 0.00 0.00 19.45 19.08 3aez n ALA 28 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3aez s LEU 29 N -1.92 1.89 0.48 0.00 2.96 -1.26 -5.09 118.68 115.74 3aez s LEU 29 Ca 0.38 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 3aez s LEU 29 Cb 0.26 -1.00 0.02 0.00 0.50 0.00 0.00 46.19 45.96 3aez s LEU 29 CO 0.15 0.13 0.68 0.42 -1.32 0.00 0.00 176.35 176.42 3aez s THR 30 N 0.18 3.22 0.23 3.68 -4.23 -1.26 -4.95 115.64 112.51 3aez s THR 30 Ca -0.07 -0.71 -0.07 0.00 -1.18 0.00 0.00 61.69 59.66 3aez s THR 30 Cb -0.13 -3.17 0.21 0.00 1.34 0.00 0.00 72.50 70.75 3aez s THR 30 CO 0.03 -0.10 1.85 -0.08 -0.54 0.00 0.00 174.62 175.78 3aez h GLU 31 N 0.33 1.26 -0.14 3.99 4.81 -2.00 -1.28 114.58 121.54 3aez h GLU 31 Ca -0.43 -0.16 -0.07 0.00 -0.13 0.00 0.00 59.36 58.57 3aez h GLU 31 Cb 1.28 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 3aez h GLU 31 CO 0.52 0.93 -0.24 1.49 -0.73 0.00 0.00 179.01 180.99 3aez h GLU 32 N 1.26 0.24 -0.10 1.92 4.81 -2.01 -2.53 114.58 118.17 3aez h GLU 32 Ca 0.31 -0.08 -0.20 0.00 -0.13 0.00 0.00 59.36 59.27 3aez h GLU 32 Cb 0.05 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.41 3aez h GLU 32 CO -0.05 0.48 -0.76 0.93 -0.73 0.00 0.00 179.01 178.88 3aez h GLU 33 N 0.22 0.55 -0.74 1.92 5.08 -1.77 -3.24 114.58 116.61 3aez h GLU 33 Ca 0.04 -0.46 -0.06 0.00 -1.00 0.00 0.00 59.36 57.88 3aez h GLU 33 Cb 0.55 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 3aez h GLU 33 CO 0.04 1.09 0.25 1.25 -1.00 0.00 0.00 179.01 180.63 3aez h LEU 34 N 0.38 1.07 -0.59 1.33 5.85 -1.06 -2.56 115.31 119.72 3aez h LEU 34 Ca -0.04 -0.20 0.12 0.00 0.84 0.00 0.00 57.88 58.59 3aez h LEU 34 Cb 1.36 -0.28 -0.11 0.00 0.37 0.00 0.00 40.66 42.00 3aez h LEU 34 CO 0.14 0.99 -0.18 0.58 -0.34 0.00 0.00 178.44 179.63 3aez h VAL 35 N 1.10 0.36 0.00 1.05 2.07 -1.50 0.10 116.25 119.44 3aez h VAL 35 Ca 0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.76 3aez h VAL 35 Cb 0.29 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3aez h VAL 35 CO -0.01 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.19 3aez n GLY 36 N -1.42 -0.86 0.08 2.17 0.00 -0.97 -2.15 105.19 102.04 3aez n GLY 36 Ca 0.06 0.15 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 3aez n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3aez n LEU 37 N -2.11 0.07 -4.71 0.99 4.77 0.28 -4.97 117.00 111.31 3aez n LEU 37 Ca -0.01 0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.58 3aez n LEU 37 Cb 0.05 0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 3aez n LEU 37 CO 0.09 0.35 0.96 -0.60 -1.33 0.00 0.00 177.39 176.86 3aez s ARG 38 N -2.78 4.39 0.57 3.23 3.52 -0.69 -4.62 118.95 122.56 3aez s ARG 38 Ca -0.09 1.88 -0.09 0.00 -0.13 0.00 0.00 55.73 57.30 3aez s ARG 38 Cb 0.08 -3.32 -0.04 0.00 -1.56 0.00 0.00 34.95 30.11 3aez s ARG 38 CO 0.85 -0.34 0.95 0.20 -0.81 0.00 0.00 175.30 176.16 3aez s GLY 39 N 1.11 1.62 -0.13 8.12 0.00 -1.26 -4.97 107.32 111.81 3aez s GLY 39 Ca 0.61 -0.21 -0.36 0.00 0.00 0.00 0.00 44.72 44.76 3aez s GLY 39 CO 0.29 0.03 1.85 -0.10 0.00 0.00 0.00 173.10 175.17 3aez n LEU 40 N -2.55 3.21 0.00 0.66 7.94 -1.26 -0.71 117.00 124.29 3aez n LEU 40 Ca 0.04 1.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.94 3aez n LEU 40 Cb 0.54 -1.32 0.00 0.00 0.53 0.00 0.00 43.42 43.17 3aez n LEU 40 CO 0.56 -0.14 0.00 0.61 -1.11 0.00 0.00 177.39 177.31 3aez n GLY 41 N 4.35 0.88 3.84 -3.96 0.00 -1.26 -5.02 105.19 104.03 3aez n GLY 41 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 3aez n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3aez s GLU 42 N -0.69 4.05 0.00 1.61 0.41 0.12 -5.00 118.70 119.20 3aez s GLU 42 Ca 0.00 0.73 0.10 0.00 -0.41 0.00 0.00 54.97 55.39 3aez s GLU 42 Cb 0.00 -2.47 0.24 0.00 -1.78 0.00 0.00 34.13 30.12 3aez s GLU 42 CO 0.00 0.17 1.15 1.04 -0.49 0.00 0.00 175.26 177.13 3aez n GLN 43 N -0.26 2.38 -1.72 1.61 1.13 -1.26 -4.83 117.38 114.44 3aez n GLN 43 Ca 0.03 -1.82 -0.42 0.00 -1.94 0.00 0.00 57.00 52.84 3aez n GLN 43 Cb 0.53 -1.24 -0.03 0.00 0.11 0.00 0.00 30.24 29.61 3aez n GLN 43 CO 0.00 0.00 0.00 1.51 -1.44 0.00 0.00 177.06 177.13 3aez n ILE 44 N 0.46 0.11 -4.57 5.09 3.06 -1.26 -5.01 119.36 117.24 3aez n ILE 44 Ca 0.10 -0.03 -0.26 0.00 -2.50 0.00 0.00 62.75 60.05 3aez n ILE 44 Cb 0.38 -1.94 -0.11 0.00 0.54 0.00 0.00 39.64 38.51 3aez n ILE 44 CO 0.00 0.00 0.00 1.51 -2.50 0.00 0.00 176.55 175.56 3aez s ASP 45 N 1.07 3.62 0.33 9.51 1.47 -1.26 -5.00 116.67 126.41 3aez s ASP 45 Ca 0.74 -1.32 0.09 0.00 1.18 0.00 0.00 52.55 53.24 3aez s ASP 45 Cb -0.52 -0.34 0.84 0.00 -0.34 0.00 0.00 42.92 42.56 3aez s ASP 45 CO 0.34 -0.40 1.78 -0.07 0.68 0.00 0.00 175.17 177.50 3aez h LEU 46 N 1.89 0.69 -0.47 2.11 3.38 -1.97 -0.20 115.31 120.75 3aez h LEU 46 Ca -0.43 0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.68 3aez h LEU 46 Cb 1.24 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.92 3aez h LEU 46 CO 0.77 0.22 0.22 0.25 0.09 0.00 0.00 178.44 179.98 3aez h LEU 47 N 0.66 0.30 -0.53 1.67 5.85 -1.99 0.35 115.31 121.61 3aez h LEU 47 Ca 0.58 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 59.26 3aez h LEU 47 Cb 1.04 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 3aez h LEU 47 CO -0.36 0.21 0.06 -0.08 -0.34 0.00 0.00 178.44 177.93 3aez h GLU 48 N 0.43 0.90 -0.82 1.25 4.81 -1.50 0.40 114.58 120.05 3aez h GLU 48 Ca 0.21 -0.25 0.15 0.00 -0.13 0.00 0.00 59.36 59.34 3aez h GLU 48 Cb 0.14 -0.10 -0.10 0.00 0.63 0.00 0.00 28.75 29.33 3aez h GLU 48 CO -0.16 0.89 0.39 0.28 -0.73 0.00 0.00 179.01 179.67 3aez h VAL 49 N 0.78 0.67 -0.02 0.32 2.07 -0.47 -0.47 116.25 119.13 3aez h VAL 49 Ca 0.16 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 3aez h VAL 49 Cb 0.44 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 3aez h VAL 49 CO 0.02 0.10 -0.26 -0.33 0.02 0.00 0.00 177.57 177.11 3aez h GLU 50 N 0.53 0.22 0.00 1.57 5.08 0.69 -0.93 114.58 121.74 3aez h GLU 50 Ca 0.46 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3aez h GLU 50 Cb 0.70 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3aez h GLU 50 CO -0.40 0.90 0.00 0.93 -1.00 0.00 0.00 179.01 179.44 3aez h GLU 51 N -0.39 0.00 0.00 2.33 5.08 -0.81 -3.36 114.58 117.43 3aez h GLU 51 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3aez h GLU 51 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 3aez h GLU 51 CO 0.05 0.00 -0.90 0.28 -1.00 0.00 0.00 179.01 177.44 3aez n VAL 52 N -3.10 0.00 0.19 3.13 0.31 -0.20 -3.67 118.33 114.99 3aez n VAL 52 Ca 0.04 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.45 3aez n VAL 52 Cb 0.51 -1.36 0.15 0.00 -0.91 0.00 0.00 33.84 32.23 3aez n VAL 52 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 3aez h TYR 53 N 0.00 0.00 0.05 3.52 -1.99 -1.22 -3.11 116.97 114.22 3aez h TYR 53 Ca 0.00 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.60 3aez h TYR 53 Cb 0.90 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.64 3aez h TYR 53 CO 0.00 0.23 -0.52 -0.07 -0.00 0.00 0.00 178.16 177.80 3aez h LEU 54 N 0.00 0.37 -0.92 3.88 3.38 -1.36 -1.06 115.31 119.60 3aez h LEU 54 Ca -0.00 -0.86 0.04 0.00 0.09 0.00 0.00 57.88 57.15 3aez h LEU 54 Cb 1.13 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 3aez h LEU 54 CO 0.03 1.20 0.59 -0.65 0.09 0.00 0.00 178.44 179.70 3aez h PRO 55 N -0.40 1.10 -0.31 1.13 0.11 -1.80 -1.29 132.00 130.54 3aez h PRO 55 Ca -0.08 -0.07 0.07 0.00 0.11 0.00 0.00 66.00 66.03 3aez h PRO 55 Cb 1.32 -0.25 -0.07 0.00 0.11 0.00 0.00 31.00 32.12 3aez h PRO 55 CO 0.10 0.73 -0.12 1.25 -0.21 0.00 0.00 178.00 179.75 3aez h LEU 56 N 1.13 -0.41 -1.54 2.35 5.85 -1.54 0.14 115.31 121.29 3aez h LEU 56 Ca 0.37 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 59.16 3aez h LEU 56 Cb 0.05 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 3aez h LEU 56 CO -0.13 -0.15 -0.18 0.00 -0.34 0.00 0.00 178.44 177.64 3aez h ALA 57 N 1.22 1.62 0.37 1.25 0.00 -0.73 -1.38 119.26 121.61 3aez h ALA 57 Ca 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3aez h ALA 57 Cb 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3aez h ALA 57 CO -0.36 0.28 -0.18 -0.09 0.00 0.00 0.00 179.25 178.91 3aez h ARG 58 N 0.07 -0.48 -0.84 0.00 2.43 0.04 -2.09 114.38 113.52 3aez h ARG 58 Ca 0.01 0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.40 3aez h ARG 58 Cb 0.36 0.11 -0.16 0.00 -0.42 0.00 0.00 29.97 29.86 3aez h ARG 58 CO 0.02 -0.16 -0.17 -0.11 -1.51 0.00 0.00 179.97 178.03 3aez n LEU 59 N -5.13 -0.27 -0.07 3.80 7.94 0.34 -0.66 117.00 122.95 3aez n LEU 59 Ca -0.09 1.45 -0.10 0.00 -1.11 0.00 0.00 56.01 56.15 3aez n LEU 59 Cb 0.27 -0.45 0.04 0.00 0.53 0.00 0.00 43.42 43.81 3aez n LEU 59 CO 0.26 -1.40 0.57 0.40 -1.11 0.00 0.00 177.39 176.11 3aez h ILE 60 N 0.00 1.28 -0.41 1.96 2.04 -1.15 -1.45 117.51 119.78 3aez h ILE 60 Ca 0.42 -1.56 -0.01 0.00 1.00 0.00 0.00 64.86 64.71 3aez h ILE 60 Cb 0.69 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 3aez h ILE 60 CO -0.86 0.51 0.22 -0.74 0.00 0.00 0.00 178.15 177.28 3aez h HIS 61 N 0.64 0.57 -0.47 1.37 2.76 -0.16 0.60 115.15 120.45 3aez h HIS 61 Ca 0.05 -0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.26 3aez h HIS 61 Cb 0.94 -0.18 -0.05 0.00 1.55 0.00 0.00 27.41 29.67 3aez h HIS 61 CO 0.05 0.44 0.19 -0.07 -1.30 0.00 0.00 177.93 177.24 3aez h LEU 62 N 0.53 0.22 -1.08 0.26 3.38 -0.83 -2.91 115.31 114.89 3aez h LEU 62 Ca 0.14 0.05 -0.08 0.00 0.09 0.00 0.00 57.88 58.08 3aez h LEU 62 Cb 0.07 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3aez h LEU 62 CO -0.02 0.16 -0.40 1.56 0.09 0.00 0.00 178.44 179.83 3aez h GLN 63 N 0.38 0.00 -0.40 1.13 4.20 -0.89 -3.02 115.11 116.51 3aez h GLN 63 Ca 0.22 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.82 3aez h GLN 63 Cb 0.20 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 3aez h GLN 63 CO -0.21 0.40 -0.19 0.28 -0.67 0.00 0.00 178.83 178.45 3aez h VAL 64 N 0.00 1.27 0.24 -0.54 2.07 -0.68 0.55 116.25 119.16 3aez h VAL 64 Ca -0.00 -1.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.23 3aez h VAL 64 Cb 0.82 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3aez h VAL 64 CO 0.05 0.43 -0.11 0.00 0.02 0.00 0.00 177.57 177.96 3aez h ALA 65 N 1.11 -0.32 -0.88 1.67 0.00 -1.54 -2.62 119.26 116.68 3aez h ALA 65 Ca 0.10 -0.20 0.14 0.00 0.00 0.00 0.00 54.91 54.95 3aez h ALA 65 Cb 0.68 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.51 3aez h ALA 65 CO 0.05 -0.41 0.48 0.00 0.00 0.00 0.00 179.25 179.38 3aez h ALA 66 N -0.36 1.34 -0.25 0.00 0.00 -1.50 -2.32 119.26 116.17 3aez h ALA 66 Ca -0.03 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3aez h ALA 66 Cb 0.51 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3aez h ALA 66 CO 0.05 -0.02 -0.32 -0.09 0.00 0.00 0.00 179.25 178.87 3aez h ARG 67 N 0.70 0.52 -0.85 0.00 9.65 -0.91 -2.43 114.38 121.05 3aez h ARG 67 Ca 0.47 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 59.13 3aez h ARG 67 Cb 0.63 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.15 3aez h ARG 67 CO -0.34 0.78 0.54 1.96 2.80 0.00 0.00 179.97 185.71 3aez h GLN 68 N 0.44 1.14 -0.91 0.20 4.20 -1.02 -2.42 115.11 116.74 3aez h GLN 68 Ca 0.05 -0.08 0.21 0.00 0.06 0.00 0.00 58.65 58.89 3aez h GLN 68 Cb 0.78 -0.25 -0.12 0.00 0.30 0.00 0.00 27.48 28.19 3aez h GLN 68 CO 0.06 0.77 0.44 0.00 -0.67 0.00 0.00 178.83 179.44 3aez h ARG 69 N 1.16 0.46 -0.38 1.46 2.47 -1.24 -1.05 114.38 117.25 3aez h ARG 69 Ca 0.31 -0.03 -0.05 0.00 -1.26 0.00 0.00 59.98 58.95 3aez h ARG 69 Cb -0.10 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.11 3aez h ARG 69 CO -0.06 0.30 0.04 1.25 0.56 0.00 0.00 179.97 182.06 3aez h LEU 70 N 0.47 0.63 -1.12 3.04 6.46 -1.36 0.24 115.31 123.66 3aez h LEU 70 Ca 0.56 -0.28 -0.08 0.00 -0.12 0.00 0.00 57.88 57.96 3aez h LEU 70 Cb 1.03 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.78 3aez h LEU 70 CO -0.49 0.75 -0.39 -0.26 -0.62 0.00 0.00 178.44 177.42 3aez h PHE 71 N 0.48 0.00 -0.13 1.25 -1.00 -1.38 -3.03 116.94 113.13 3aez h PHE 71 Ca 0.11 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.70 3aez h PHE 71 Cb 0.41 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.97 3aez h PHE 71 CO 0.03 0.39 -0.69 0.00 -1.61 0.00 0.00 178.31 176.43 3aez h ALA 72 N 1.61 0.53 -0.63 2.45 0.00 -0.40 -1.82 119.26 121.00 3aez h ALA 72 Ca -0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.30 3aez h ALA 72 Cb 0.79 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 3aez h ALA 72 CO 0.05 0.72 0.28 0.00 0.00 0.00 0.00 179.25 180.30 3aez h ALA 73 N 0.83 0.81 -0.71 0.00 0.00 -0.90 0.31 119.26 119.60 3aez h ALA 73 Ca -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 3aez h ALA 73 Cb 1.28 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 3aez h ALA 73 CO 0.13 0.40 0.25 1.15 0.00 0.00 0.00 179.25 181.18 3aez h THR 74 N 0.87 1.25 -0.29 0.00 2.02 -1.47 0.36 112.91 115.65 3aez h THR 74 Ca 0.21 -0.82 -0.13 0.00 0.77 0.00 0.00 66.41 66.44 3aez h THR 74 Cb 0.16 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 3aez h THR 74 CO -0.02 0.33 -0.36 0.00 0.37 0.00 0.00 175.52 175.83 3aez h ALA 75 N 1.24 0.82 0.67 6.16 0.00 -0.49 -1.20 119.26 126.45 3aez h ALA 75 Ca 0.23 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3aez h ALA 75 Cb 0.24 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.92 3aez h ALA 75 CO -0.01 0.65 -0.32 1.49 0.00 0.00 0.00 179.25 181.05 3aez h GLU 76 N 0.56 -0.87 -0.88 0.00 4.81 -0.19 -0.99 114.58 117.02 3aez h GLU 76 Ca 0.05 0.06 0.24 0.00 -0.13 0.00 0.00 59.36 59.58 3aez h GLU 76 Cb 0.88 0.20 -0.15 0.00 0.63 0.00 0.00 28.75 30.31 3aez h GLU 76 CO 0.08 -0.57 0.17 0.35 -0.73 0.00 0.00 179.01 178.31 3aez h PHE 77 N -0.96 0.23 0.00 0.92 3.57 -0.74 0.56 116.94 120.53 3aez h PHE 77 Ca -0.09 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.46 3aez h PHE 77 Cb 0.71 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.49 3aez h PHE 77 CO -0.02 -0.26 0.00 1.28 -2.23 0.00 0.00 178.31 177.08 3aez n LEU 78 N -5.29 0.00 -3.42 0.59 4.77 -0.47 -4.89 117.00 108.29 3aez n LEU 78 Ca 0.21 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 56.02 3aez n LEU 78 Cb 0.68 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.85 3aez n LEU 78 CO 0.03 0.00 0.07 0.61 -1.33 0.00 0.00 177.39 176.77 3aez n GLY 79 N 0.72 -0.58 3.72 -0.72 0.00 0.20 -5.00 105.19 103.52 3aez n GLY 79 Ca 0.16 0.24 -0.32 0.00 0.00 0.00 0.00 46.02 46.10 3aez n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3aez s GLU 80 N -5.18 2.84 0.00 1.61 2.02 -0.40 -5.01 118.70 114.58 3aez s GLU 80 Ca 0.13 -0.61 0.00 0.00 0.02 0.00 0.00 54.97 54.52 3aez s GLU 80 Cb -0.02 -2.71 0.00 0.00 0.10 0.00 0.00 34.13 31.50 3aez s GLU 80 CO 0.74 0.62 0.00 -2.30 0.02 0.00 0.00 175.26 174.34 3aez n PRO 81 N 1.19 0.00 0.00 0.39 -0.02 -1.26 -4.78 135.00 130.52 3aez n PRO 81 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 3aez n PRO 81 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 3aez n PRO 81 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 3aez n GLN 82 N -3.47 0.00 0.00 -0.52 -0.06 -1.26 -5.09 117.38 106.97 3aez n GLN 82 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 3aez n GLN 82 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 3aez n GLN 82 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3aez n GLN 83 N 0.00 0.00 -2.43 3.69 10.64 -1.26 -4.96 117.38 123.05 3aez n GLN 83 Ca 0.00 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 54.74 3aez n GLN 83 Cb 0.00 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 29.36 3aez n GLN 83 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 3aez s ASN 84 N 0.00 6.99 0.31 2.61 3.84 -1.26 -4.95 114.94 122.49 3aez s ASN 84 Ca 0.00 1.77 0.26 0.00 0.21 0.00 0.00 52.86 55.10 3aez s ASN 84 Cb 0.00 -2.55 0.83 0.00 -0.55 0.00 0.00 41.25 38.98 3aez s ASN 84 CO 0.00 -0.67 1.75 -0.65 -2.79 0.00 0.00 177.10 174.74 3aez h PRO 85 N 7.82 0.00 0.00 0.43 0.11 -1.99 -2.39 132.00 135.98 3aez h PRO 85 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3aez h PRO 85 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3aez h PRO 85 CO 0.92 0.00 -0.74 -0.44 -0.21 0.00 0.00 178.00 177.54 3aez h ASP 86 N 0.00 0.00 -2.70 -2.05 3.32 -2.05 -3.40 116.42 109.54 3aez h ASP 86 Ca 0.00 -0.07 -0.60 0.00 0.02 0.00 0.00 57.03 56.37 3aez h ASP 86 Cb 0.67 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.82 3aez h ASP 86 CO 0.00 0.04 -0.75 0.54 -1.72 0.00 0.00 179.24 177.34 3aez n ARG 87 N -2.54 1.20 -1.30 3.56 1.74 -0.92 -5.02 116.66 113.38 3aez n ARG 87 Ca 0.02 -3.94 -0.29 0.00 -0.77 0.00 0.00 57.85 52.87 3aez n ARG 87 Cb 0.51 -2.00 0.16 0.00 -1.02 0.00 0.00 32.46 30.11 3aez n ARG 87 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3aez s PRO 88 N -0.95 0.75 0.13 5.56 0.04 -1.08 -4.13 135.00 135.32 3aez s PRO 88 Ca 0.29 0.46 -0.31 0.00 0.04 0.00 0.00 61.00 61.48 3aez s PRO 88 Cb 0.01 -1.78 -0.10 0.00 0.04 0.00 0.00 34.50 32.67 3aez s PRO 88 CO -0.17 -2.50 1.70 0.08 0.04 0.00 0.00 177.00 176.15 3aez s VAL 89 N -3.07 2.60 0.25 -0.36 1.01 -1.26 -4.93 120.40 114.64 3aez s VAL 89 Ca 0.65 0.26 -0.31 0.00 0.00 0.00 0.00 61.98 62.57 3aez s VAL 89 Cb -0.17 -3.16 -0.12 0.00 0.00 0.00 0.00 36.38 32.93 3aez s VAL 89 CO 0.56 0.01 1.66 -2.65 0.00 0.00 0.00 175.10 174.68 3aez n PRO 90 N 4.93 2.74 -2.94 2.72 -0.02 -1.26 -4.96 135.00 136.21 3aez n PRO 90 Ca 0.16 0.98 -0.41 0.00 -2.02 0.00 0.00 63.50 62.21 3aez n PRO 90 Cb 0.38 -2.80 -0.05 0.00 -0.02 0.00 0.00 33.50 31.02 3aez n PRO 90 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3aez s PHE 91 N 0.59 3.37 -0.20 6.00 2.19 -0.84 -4.93 117.98 124.17 3aez s PHE 91 Ca 0.70 1.14 -0.05 0.00 0.33 0.00 0.00 56.93 59.05 3aez s PHE 91 Cb -0.50 -2.98 -0.02 0.00 -1.31 0.00 0.00 43.02 38.21 3aez s PHE 91 CO 0.40 -0.28 -0.00 0.42 1.83 0.00 0.00 175.22 177.59 3aez s ILE 92 N 2.33 3.94 -0.15 3.12 -1.09 -1.26 -1.02 121.20 127.07 3aez s ILE 92 Ca 0.35 -0.32 0.02 0.00 -2.23 0.00 0.00 60.65 58.47 3aez s ILE 92 Cb -0.16 -2.78 0.01 0.00 -1.58 0.00 0.00 42.46 37.95 3aez s ILE 92 CO 0.10 0.43 -0.20 -0.63 -1.23 0.00 0.00 174.94 173.42 3aez s ILE 93 N 0.98 2.22 0.04 2.92 1.01 0.70 -0.56 121.20 128.50 3aez s ILE 93 Ca 0.01 -0.92 -0.07 0.00 0.00 0.00 0.00 60.65 59.67 3aez s ILE 93 Cb -0.14 -1.91 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 3aez s ILE 93 CO 0.02 0.54 0.31 -0.83 0.00 0.00 0.00 174.94 174.98 3aez s GLY 94 N 0.91 2.28 -0.13 6.18 0.00 -0.08 0.24 107.32 116.72 3aez s GLY 94 Ca -0.04 -0.52 -0.01 0.00 0.00 0.00 0.00 44.72 44.15 3aez s GLY 94 CO -0.03 -0.33 -0.02 0.14 0.00 0.00 0.00 173.10 172.86 3aez s VAL 95 N -1.35 0.74 0.35 1.40 1.01 0.12 -0.28 120.40 122.39 3aez s VAL 95 Ca 0.30 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 62.04 3aez s VAL 95 Cb -0.13 -0.95 -0.07 0.00 0.00 0.00 0.00 36.38 35.23 3aez s VAL 95 CO 0.17 0.15 -0.03 0.00 0.00 0.00 0.00 175.10 175.39 3aez s ALA 96 N 1.80 2.85 0.00 5.51 0.00 0.33 -1.34 121.76 130.91 3aez s ALA 96 Ca 0.03 -2.13 0.00 0.00 0.00 0.00 0.00 51.96 49.85 3aez s ALA 96 Cb -0.14 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.13 3aez s ALA 96 CO -0.07 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.04 3aez n GLY 97 N -0.80 1.03 3.66 0.00 0.00 -1.23 -0.73 105.19 107.11 3aez n GLY 97 Ca -0.05 -1.87 -0.33 0.00 0.00 0.00 0.00 46.02 43.77 3aez n GLY 97 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3aez n SER 98 N 0.00 0.64 -4.62 1.61 2.88 -1.26 -4.19 113.62 108.68 3aez n SER 98 Ca 0.00 0.55 -0.42 0.00 -1.33 0.00 0.00 58.87 57.67 3aez n SER 98 Cb 0.00 -1.47 0.00 0.00 -0.75 0.00 0.00 64.21 61.99 3aez n SER 98 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 3aez n VAL 99 N -3.38 2.29 -0.93 2.46 0.31 -1.26 -2.99 118.33 114.83 3aez n VAL 99 Ca 0.13 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 3aez n VAL 99 Cb 0.51 -1.18 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 3aez n VAL 99 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3aez n ALA 100 N -0.24 0.00 1.02 3.52 0.00 -1.26 -4.82 120.51 118.72 3aez n ALA 100 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.66 3aez n ALA 100 Cb 0.37 -0.16 0.41 0.00 0.00 0.00 0.00 19.45 20.08 3aez n ALA 100 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3aez n VAL 101 N -2.05 0.00 -0.21 0.00 3.14 -1.16 -4.71 118.33 113.34 3aez n VAL 101 Ca 0.00 -0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 3aez n VAL 101 Cb 0.00 -0.05 0.00 0.00 -1.06 0.00 0.00 33.84 32.73 3aez n VAL 101 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3aez n GLY 102 N 1.49 1.13 0.35 7.55 0.00 -1.26 -4.92 105.19 109.52 3aez n GLY 102 Ca 0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 3aez n GLY 102 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3aez h LYS 103 N 0.00 1.12 0.00 1.61 1.57 -1.92 -2.09 116.57 116.86 3aez h LYS 103 Ca 0.00 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 3aez h LYS 103 Cb 0.04 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 3aez h LYS 103 CO 0.00 0.74 -0.19 0.66 -0.57 0.00 0.00 179.45 180.09 3aez h SER 104 N 1.16 0.00 0.01 0.86 4.64 -1.98 -0.61 113.55 117.63 3aez h SER 104 Ca 0.38 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.70 3aez h SER 104 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3aez h SER 104 CO -0.13 0.19 -0.00 0.74 -0.87 0.00 0.00 176.83 176.76 3aez h THR 105 N 0.00 1.61 -0.86 2.95 2.02 -1.65 -1.83 112.91 115.14 3aez h THR 105 Ca -0.00 -1.93 0.17 0.00 0.77 0.00 0.00 66.41 65.42 3aez h THR 105 Cb 0.41 2.90 -0.11 0.00 -1.74 0.00 0.00 68.15 69.62 3aez h THR 105 CO 0.02 0.49 0.41 0.74 0.37 0.00 0.00 175.52 177.56 3aez h THR 106 N -0.85 0.63 -0.10 3.16 2.02 -1.17 0.32 112.91 116.92 3aez h THR 106 Ca -0.00 -0.18 -0.17 0.00 0.77 0.00 0.00 66.41 66.82 3aez h THR 106 Cb 0.81 0.05 0.01 0.00 -1.74 0.00 0.00 68.15 67.29 3aez h THR 106 CO 0.00 0.10 -0.61 0.00 0.37 0.00 0.00 175.52 175.37 3aez h ALA 107 N 1.61 0.21 -0.85 6.16 0.00 -1.09 0.36 119.26 125.66 3aez h ALA 107 Ca 0.50 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3aez h ALA 107 Cb 0.81 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 3aez h ALA 107 CO -0.43 0.47 0.43 0.00 0.00 0.00 0.00 179.25 179.72 3aez h ARG 108 N 0.22 1.21 -0.07 0.00 3.08 -1.12 -0.01 114.38 117.69 3aez h ARG 108 Ca -0.05 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.81 3aez h ARG 108 Cb 1.26 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 3aez h ARG 108 CO 0.13 0.91 -0.04 0.28 -1.07 0.00 0.00 179.97 180.17 3aez h VAL 109 N 1.20 1.34 -0.49 2.04 2.07 -0.72 -1.92 116.25 119.78 3aez h VAL 109 Ca 0.29 -1.11 0.08 0.00 0.82 0.00 0.00 66.70 66.78 3aez h VAL 109 Cb 0.09 1.94 -0.06 0.00 -1.52 0.00 0.00 31.29 31.74 3aez h VAL 109 CO -0.04 0.31 0.13 0.25 0.02 0.00 0.00 177.57 178.24 3aez h LEU 110 N -0.25 0.08 -1.08 2.57 5.85 -0.89 -0.52 115.31 121.08 3aez h LEU 110 Ca 0.01 0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.90 3aez h LEU 110 Cb 0.51 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 3aez h LEU 110 CO 0.01 0.07 0.62 -0.61 -0.34 0.00 0.00 178.44 178.19 3aez h GLN 111 N 0.28 0.99 -0.19 1.25 4.15 -0.78 -0.75 115.11 120.06 3aez h GLN 111 Ca 0.24 -0.06 -0.22 0.00 0.77 0.00 0.00 58.65 59.38 3aez h GLN 111 Cb 0.29 -0.22 0.01 0.00 0.21 0.00 0.00 27.48 27.77 3aez h GLN 111 CO -0.28 0.65 -0.72 0.00 -1.93 0.00 0.00 178.83 176.55 3aez h ALA 112 N 1.52 0.34 0.14 3.38 0.00 -0.34 -0.52 119.26 123.78 3aez h ALA 112 Ca 0.45 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3aez h ALA 112 Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3aez h ALA 112 CO -0.20 0.68 -0.07 -0.07 0.00 0.00 0.00 179.25 179.59 3aez h LEU 113 N 0.58 -0.16 -1.45 0.00 3.38 -0.76 -2.96 115.31 113.93 3aez h LEU 113 Ca -0.04 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 3aez h LEU 113 Cb 1.35 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 3aez h LEU 113 CO 0.15 0.06 0.30 -0.07 0.09 0.00 0.00 178.44 178.98 3aez h LEU 114 N -0.38 0.59 -0.66 1.67 3.38 -1.08 -1.71 115.31 117.12 3aez h LEU 114 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3aez h LEU 114 Cb 0.30 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3aez h LEU 114 CO 0.03 0.45 0.00 0.00 0.09 0.00 0.00 178.44 179.01 3aez h ALA 115 N 1.65 1.00 -0.37 1.53 0.00 -0.97 -2.54 119.26 119.56 3aez h ALA 115 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3aez h ALA 115 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3aez h ALA 115 CO -0.03 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.76 3aez n ARG 116 N -2.33 2.39 -0.45 0.00 1.74 -0.65 -4.26 116.66 113.10 3aez n ARG 116 Ca 0.02 -2.10 -0.29 0.00 -0.77 0.00 0.00 57.85 54.72 3aez n ARG 116 Cb 0.27 -1.49 0.25 0.00 -1.02 0.00 0.00 32.46 30.46 3aez n ARG 116 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3aez n TRP 117 N 1.30 -2.03 0.20 -1.55 8.01 -0.96 -4.90 117.44 117.51 3aez n TRP 117 Ca 0.19 -0.27 -0.13 0.00 -1.31 0.00 0.00 57.50 55.97 3aez n TRP 117 Cb 0.56 -1.56 -0.07 0.00 -2.01 0.00 0.00 31.31 28.23 3aez n TRP 117 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.69 176.24 3aez h ASP 118 N -2.85 -1.06 0.00 -0.99 3.45 -1.91 -1.96 116.42 111.10 3aez h ASP 118 Ca -0.54 0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.00 3aez h ASP 118 Cb 1.31 0.35 0.00 0.00 -0.56 0.00 0.00 39.33 40.43 3aez h ASP 118 CO 0.40 -0.49 0.00 0.00 -1.57 0.00 0.00 179.24 177.58 3aez n HIS 119 N -4.69 0.00 -3.48 4.55 1.44 -1.26 -4.88 115.22 106.91 3aez n HIS 119 Ca -0.09 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.46 3aez n HIS 119 Cb 0.34 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.46 3aez n HIS 119 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3aez n HIS 120 N -0.75 -2.40 -1.96 -1.40 8.25 -0.74 -4.93 115.22 111.30 3aez n HIS 120 Ca 0.07 0.88 -0.41 0.00 -0.26 0.00 0.00 57.72 58.01 3aez n HIS 120 Cb 0.03 -3.44 -0.01 0.00 1.12 0.00 0.00 29.99 27.69 3aez n HIS 120 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3aez s PRO 121 N -4.36 4.23 -0.26 -0.41 0.04 -1.26 -4.96 135.00 128.02 3aez s PRO 121 Ca 0.09 2.39 -0.29 0.00 0.04 0.00 0.00 61.00 63.23 3aez s PRO 121 Cb -0.03 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.45 3aez s PRO 121 CO 0.83 -0.37 1.76 0.50 0.04 0.00 0.00 177.00 179.76 3aez s ARG 122 N -1.76 3.56 -0.30 4.56 3.52 -1.26 -4.65 118.95 122.61 3aez s ARG 122 Ca 0.52 1.64 0.02 0.00 -0.13 0.00 0.00 55.73 57.78 3aez s ARG 122 Cb -0.43 -4.14 0.08 0.00 -1.56 0.00 0.00 34.95 28.90 3aez s ARG 122 CO 0.56 -1.59 -0.02 0.08 -0.81 0.00 0.00 175.30 173.53 3aez s VAL 123 N 6.14 2.38 0.21 7.11 1.01 -1.26 -0.42 120.40 135.57 3aez s VAL 123 Ca 0.78 -1.90 -0.04 0.00 0.00 0.00 0.00 61.98 60.82 3aez s VAL 123 Cb -0.25 -2.55 -0.05 0.00 0.00 0.00 0.00 36.38 33.52 3aez s VAL 123 CO 0.32 -0.29 0.45 -1.81 0.00 0.00 0.00 175.10 173.77 3aez s ASP 124 N 1.10 6.46 -0.06 3.32 1.01 -0.22 -4.99 116.67 123.29 3aez s ASP 124 Ca -0.00 0.61 -0.00 0.00 0.71 0.00 0.00 52.55 53.86 3aez s ASP 124 Cb -0.20 -2.10 0.03 0.00 1.01 0.00 0.00 42.92 41.66 3aez s ASP 124 CO -0.06 -0.06 -0.02 -0.22 0.21 0.00 0.00 175.17 175.03 3aez s LEU 125 N -3.12 0.88 0.00 1.23 2.96 -1.26 -0.56 118.68 118.81 3aez s LEU 125 Ca 0.42 -0.11 0.04 0.00 -0.22 0.00 0.00 54.13 54.27 3aez s LEU 125 Cb -0.11 -0.45 -0.01 0.00 0.50 0.00 0.00 46.19 46.11 3aez s LEU 125 CO 0.27 -0.14 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.33 3aez s VAL 126 N 1.59 1.11 -0.08 1.68 1.01 0.06 -4.97 120.40 120.79 3aez s VAL 126 Ca -0.01 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 3aez s VAL 126 Cb -0.13 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 3aez s VAL 126 CO -0.04 0.23 -0.01 0.42 0.00 0.00 0.00 175.10 175.70 3aez s THR 127 N -0.46 4.17 -1.84 3.92 -4.23 -1.26 -0.90 115.64 115.05 3aez s THR 127 Ca 0.04 -0.30 0.22 0.00 -1.18 0.00 0.00 61.69 60.47 3aez s THR 127 Cb -0.06 -2.74 0.55 0.00 1.34 0.00 0.00 72.50 71.58 3aez s THR 127 CO -0.00 0.60 1.68 0.35 -0.54 0.00 0.00 174.62 176.71 3aez n THR 128 N 2.16 0.10 0.25 3.99 -2.24 -0.43 -3.20 114.28 114.91 3aez n THR 128 Ca -0.18 0.03 0.13 0.00 -2.27 0.00 0.00 64.05 61.75 3aez n THR 128 Cb 0.53 -0.68 0.58 0.00 -2.10 0.00 0.00 70.33 68.66 3aez n THR 128 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3aez h ASP 129 N 0.00 0.00 0.00 3.42 3.04 -1.94 0.54 116.42 121.48 3aez h ASP 129 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 3aez h ASP 129 Cb 0.06 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.35 3aez h ASP 129 CO 0.00 0.13 0.00 1.23 -2.04 0.00 0.00 179.24 178.56 3aez h GLY 130 N 1.87 0.00 -1.74 7.15 0.00 -1.74 -2.08 103.07 106.53 3aez h GLY 130 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3aez h GLY 130 CO 0.02 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.25 3aez n PHE 131 N -2.51 0.38 -1.78 5.60 3.01 0.18 -4.21 117.46 118.14 3aez n PHE 131 Ca -0.02 -0.26 -0.38 0.00 1.01 0.00 0.00 57.45 57.80 3aez n PHE 131 Cb 0.05 -0.01 0.05 0.00 -0.01 0.00 0.00 39.48 39.56 3aez n PHE 131 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3aez s LEU 132 N -1.23 3.79 0.47 4.37 1.43 -0.78 -0.43 118.68 126.29 3aez s LEU 132 Ca 0.29 2.73 -0.25 0.00 -1.03 0.00 0.00 54.13 55.87 3aez s LEU 132 Cb 0.17 -4.35 -0.08 0.00 0.03 0.00 0.00 46.19 41.96 3aez s LEU 132 CO 0.24 -1.67 1.40 -0.31 0.23 0.00 0.00 176.35 176.24 3aez s TYR 133 N -1.33 2.45 0.99 0.29 4.12 -0.45 -4.72 117.35 118.71 3aez s TYR 133 Ca 0.74 1.30 -0.12 0.00 0.02 0.00 0.00 57.07 59.01 3aez s TYR 133 Cb -0.40 -3.88 0.19 0.00 -1.52 0.00 0.00 41.96 36.35 3aez s TYR 133 CO 0.46 -2.86 1.08 -1.25 0.02 0.00 0.00 175.55 173.00 3aez s PRO 134 N -2.52 0.46 0.42 -1.71 0.04 -1.26 -4.61 135.00 125.82 3aez s PRO 134 Ca 0.63 1.01 0.12 0.00 0.04 0.00 0.00 61.00 62.79 3aez s PRO 134 Cb -0.43 -1.70 0.92 0.00 0.04 0.00 0.00 34.50 33.33 3aez s PRO 134 CO 0.54 -2.84 1.98 -0.91 0.04 0.00 0.00 177.00 175.81 3aez h ASN 135 N -1.99 0.15 0.26 6.66 2.35 -1.94 -0.69 115.58 120.38 3aez h ASN 135 Ca -0.52 -0.02 -0.20 0.00 -0.55 0.00 0.00 56.30 55.01 3aez h ASN 135 Cb 1.30 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 39.63 3aez h ASN 135 CO 0.50 0.27 -0.80 0.00 -1.65 0.00 0.00 177.43 175.75 3aez h ALA 136 N 1.75 0.50 -0.08 -0.83 0.00 -1.98 0.30 119.26 118.92 3aez h ALA 136 Ca 0.03 -0.64 -0.24 0.00 0.00 0.00 0.00 54.91 54.06 3aez h ALA 136 Cb 0.27 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.03 3aez h ALA 136 CO 0.01 0.78 -0.89 1.49 0.00 0.00 0.00 179.25 180.64 3aez h GLU 137 N 0.27 0.72 -0.52 0.00 4.57 -1.68 -1.07 114.58 116.87 3aez h GLU 137 Ca -0.05 -0.67 -0.02 0.00 -1.18 0.00 0.00 59.36 57.45 3aez h GLU 137 Cb 1.40 0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 30.13 3aez h GLU 137 CO 0.14 1.26 0.25 -0.07 -1.18 0.00 0.00 179.01 179.41 3aez h LEU 138 N 0.45 0.69 -0.82 1.64 3.38 -0.99 -1.39 115.31 118.28 3aez h LEU 138 Ca -0.08 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.79 3aez h LEU 138 Cb 1.53 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 42.05 3aez h LEU 138 CO 0.18 0.63 0.52 -0.61 0.09 0.00 0.00 178.44 179.25 3aez h GLN 139 N 0.70 0.96 -1.00 1.13 5.75 -0.28 0.38 115.11 122.75 3aez h GLN 139 Ca 0.18 -0.06 0.04 0.00 -0.15 0.00 0.00 58.65 58.66 3aez h GLN 139 Cb 0.13 -0.22 -0.06 0.00 1.07 0.00 0.00 27.48 28.40 3aez h GLN 139 CO -0.02 0.64 0.66 -0.09 -2.65 0.00 0.00 178.83 177.36 3aez h ARG 140 N 0.99 1.22 -0.24 1.69 2.43 -0.67 -1.45 114.38 118.35 3aez h ARG 140 Ca 0.34 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 3aez h ARG 140 Cb 0.06 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 29.34 3aez h ARG 140 CO -0.13 0.81 0.00 0.54 -1.51 0.00 0.00 179.97 179.67 3aez n ARG 141 N -4.45 1.66 -3.22 0.20 1.74 -0.57 -4.94 116.66 107.09 3aez n ARG 141 Ca 0.14 -1.02 -0.23 0.00 -0.77 0.00 0.00 57.85 55.97 3aez n ARG 141 Cb 0.11 -1.29 0.04 0.00 -1.02 0.00 0.00 32.46 30.30 3aez n ARG 141 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3aez n ASN 142 N 0.29 -5.90 -0.40 0.55 5.03 -0.55 -4.93 115.26 109.35 3aez n ASN 142 Ca 0.12 -0.37 0.06 0.00 0.87 0.00 0.00 54.58 55.27 3aez n ASN 142 Cb 0.27 -4.74 0.14 0.00 -1.02 0.00 0.00 39.78 34.43 3aez n ASN 142 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3aez n LEU 143 N -4.24 2.81 0.23 3.41 4.77 0.12 -4.71 117.00 119.40 3aez n LEU 143 Ca -0.07 -2.59 0.16 0.00 -0.03 0.00 0.00 56.01 53.48 3aez n LEU 143 Cb 0.60 -0.32 0.74 0.00 -2.33 0.00 0.00 43.42 42.10 3aez n LEU 143 CO 0.53 0.66 0.97 0.24 -1.33 0.00 0.00 177.39 178.46 3aez h MET 144 N 0.92 0.00 -0.49 3.23 2.86 -1.91 -0.70 114.93 118.84 3aez h MET 144 Ca 0.00 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.52 3aez h MET 144 Cb 0.95 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.54 3aez h MET 144 CO 0.06 0.00 0.10 0.72 1.06 0.00 0.00 176.91 178.85 3aez n HIS 145 N -2.72 1.67 -1.92 -0.22 8.25 -1.26 -4.50 115.22 114.51 3aez n HIS 145 Ca -0.00 -1.13 0.03 0.00 -0.26 0.00 0.00 57.72 56.36 3aez n HIS 145 Cb 0.19 -0.51 0.04 0.00 1.12 0.00 0.00 29.99 30.83 3aez n HIS 145 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3aez n ARG 146 N -0.40 0.34 -1.71 -0.41 5.12 -0.27 -4.80 116.66 114.53 3aez n ARG 146 Ca 0.32 -1.68 -0.43 0.00 -1.93 0.00 0.00 57.85 54.13 3aez n ARG 146 Cb 1.14 -0.64 -0.03 0.00 -1.16 0.00 0.00 32.46 31.78 3aez n ARG 146 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3aez n LYS 147 N -0.22 2.54 0.00 5.56 5.02 -1.24 -0.79 118.16 129.02 3aez n LYS 147 Ca 0.06 0.91 0.00 0.00 -2.02 0.00 0.00 58.31 57.25 3aez n LYS 147 Cb 0.79 -2.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.12 3aez n LYS 147 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3aez n GLY 148 N 2.88 3.29 3.76 0.72 0.00 -1.26 -4.98 105.19 109.60 3aez n GLY 148 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3aez n GLY 148 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3aez s PHE 149 N -2.67 2.50 0.38 1.61 0.40 0.03 -4.81 117.98 115.41 3aez s PHE 149 Ca 0.00 1.51 0.13 0.00 -0.60 0.00 0.00 56.93 57.97 3aez s PHE 149 Cb 0.00 -3.46 0.94 0.00 0.51 0.00 0.00 43.02 41.01 3aez s PHE 149 CO 0.00 -2.06 1.83 -1.35 0.70 0.00 0.00 175.22 174.35 3aez h PRO 150 N 1.14 0.54 0.00 0.24 0.11 -1.98 -0.33 132.00 131.73 3aez h PRO 150 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 3aez h PRO 150 Cb 1.28 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3aez h PRO 150 CO 0.56 0.36 0.00 -0.85 -0.21 0.00 0.00 178.00 177.86 3aez n GLU 151 N -4.59 0.37 -0.00 1.05 0.00 -1.26 -2.89 120.64 113.32 3aez n GLU 151 Ca 0.20 0.06 0.14 0.00 0.00 0.00 0.00 57.16 57.56 3aez n GLU 151 Cb 0.63 -1.50 0.51 0.00 0.00 0.00 0.00 31.44 31.08 3aez n GLU 151 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 3aez n SER 152 N -1.26 1.56 -4.73 -1.84 3.41 -0.13 -4.85 113.62 105.77 3aez n SER 152 Ca 0.12 -1.52 -0.32 0.00 -0.26 0.00 0.00 58.87 56.89 3aez n SER 152 Cb 0.18 -0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.05 3aez n SER 152 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3aez s TYR 153 N -2.00 3.14 -1.23 7.33 1.51 -1.14 -1.34 117.35 123.62 3aez s TYR 153 Ca 0.38 0.10 -0.19 0.00 -1.01 0.00 0.00 57.07 56.34 3aez s TYR 153 Cb 0.21 -1.66 0.07 0.00 -0.11 0.00 0.00 41.96 40.47 3aez s TYR 153 CO 0.33 0.50 1.65 1.21 -1.11 0.00 0.00 175.55 178.13 3aez s ASN 154 N -1.88 6.78 0.21 2.29 3.84 0.42 -4.82 114.94 121.78 3aez s ASN 154 Ca 0.23 -2.26 -0.10 0.00 0.21 0.00 0.00 52.86 50.94 3aez s ASN 154 Cb -0.12 -2.56 0.15 0.00 -0.55 0.00 0.00 41.25 38.17 3aez s ASN 154 CO 0.15 -1.22 1.85 0.03 -2.79 0.00 0.00 177.10 175.12 3aez h ARG 155 N 8.05 1.03 -0.50 0.43 3.08 -1.89 -1.99 114.38 122.58 3aez h ARG 155 Ca 0.38 -0.09 0.08 0.00 0.07 0.00 0.00 59.98 60.42 3aez h ARG 155 Cb 0.90 -0.22 -0.07 0.00 0.08 0.00 0.00 29.97 30.67 3aez h ARG 155 CO 1.44 0.72 0.13 0.00 -1.07 0.00 0.00 179.97 181.18 3aez h ARG 156 N 1.04 0.27 -0.83 0.04 3.08 -1.99 0.17 114.38 116.16 3aez h ARG 156 Ca 0.27 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.29 3aez h ARG 156 Cb -0.05 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 3aez h ARG 156 CO -0.05 0.18 0.43 0.00 -1.07 0.00 0.00 179.97 179.46 3aez h ALA 157 N 1.37 1.06 -0.19 0.04 0.00 -1.90 0.79 119.26 120.42 3aez h ALA 157 Ca 0.25 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3aez h ALA 157 Cb 0.31 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3aez h ALA 157 CO -0.30 0.59 0.01 1.25 0.00 0.00 0.00 179.25 180.80 3aez h LEU 158 N 1.16 0.33 -0.31 0.00 5.85 -0.72 0.04 115.31 121.64 3aez h LEU 158 Ca 0.29 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3aez h LEU 158 Cb 0.06 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3aez h LEU 158 CO -0.04 0.55 0.14 -0.03 -0.34 0.00 0.00 178.44 178.72 3aez h MET 159 N 0.10 0.46 -0.61 1.25 4.05 -0.55 -1.80 114.93 117.83 3aez h MET 159 Ca 0.06 -0.07 0.12 0.00 -0.28 0.00 0.00 59.70 59.53 3aez h MET 159 Cb 0.38 -0.08 -0.11 0.00 -0.80 0.00 0.00 31.60 30.99 3aez h MET 159 CO 0.01 0.44 -0.09 0.00 0.23 0.00 0.00 176.91 177.51 3aez h ARG 160 N 0.37 0.04 0.10 0.39 3.08 -0.63 0.90 114.38 118.64 3aez h ARG 160 Ca 0.11 -0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.17 3aez h ARG 160 Cb 0.14 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 3aez h ARG 160 CO -0.01 0.03 -0.18 0.35 -1.07 0.00 0.00 179.97 179.09 3aez h PHE 161 N 0.05 -0.46 -0.15 3.04 3.57 -0.40 -0.62 116.94 121.96 3aez h PHE 161 Ca 0.30 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.67 3aez h PHE 161 Cb 0.48 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 3aez h PHE 161 CO -0.44 -0.26 -0.51 0.28 -2.23 0.00 0.00 178.31 175.15 3aez h VAL 162 N -0.34 1.33 -0.48 1.41 2.07 -1.00 -2.10 116.25 117.14 3aez h VAL 162 Ca 0.02 -1.75 -0.01 0.00 0.82 0.00 0.00 66.70 65.79 3aez h VAL 162 Cb 0.36 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 3aez h VAL 162 CO -0.10 0.53 0.27 0.74 0.02 0.00 0.00 177.57 179.04 3aez h THR 163 N 0.33 1.16 0.10 2.57 2.02 -0.71 -0.33 112.91 118.06 3aez h THR 163 Ca 0.01 -0.41 0.01 0.00 0.77 0.00 0.00 66.41 66.80 3aez h THR 163 Cb 1.01 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3aez h THR 163 CO 0.09 0.17 -0.14 -1.28 0.37 0.00 0.00 175.52 174.73 3aez h SER 164 N 0.63 -0.38 -0.31 4.18 0.87 -0.92 0.13 113.55 117.76 3aez h SER 164 Ca 0.17 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.81 3aez h SER 164 Cb 0.04 0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 62.10 3aez h SER 164 CO -0.03 -0.21 0.09 0.58 -0.53 0.00 0.00 176.83 176.74 3aez h VAL 165 N -0.28 0.89 -0.01 2.23 2.07 -1.17 -2.31 116.25 117.66 3aez h VAL 165 Ca 0.02 -0.07 -0.14 0.00 0.82 0.00 0.00 66.70 67.33 3aez h VAL 165 Cb 0.29 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3aez h VAL 165 CO -0.07 0.04 -0.64 0.50 0.02 0.00 0.00 177.57 177.42 3aez h LYS 166 N 0.22 0.04 0.00 1.57 3.64 -0.37 -2.08 116.57 119.58 3aez h LYS 166 Ca 0.14 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3aez h LYS 166 Cb 0.13 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3aez h LYS 166 CO -0.16 0.66 0.00 -1.13 -2.27 0.00 0.00 179.45 176.55 3aez n SER 167 N -3.79 0.00 0.00 4.20 3.41 0.39 -4.31 113.62 113.52 3aez n SER 167 Ca -0.01 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 3aez n SER 167 Cb 0.63 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 3aez n SER 167 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3aez n GLY 168 N 0.27 0.80 3.69 5.00 0.00 -0.78 -5.06 105.19 109.11 3aez n GLY 168 Ca 0.12 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 3aez n GLY 168 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3aez n SER 169 N 0.61 1.47 0.16 1.61 3.41 -0.89 -4.91 113.62 115.07 3aez n SER 169 Ca 0.00 0.77 0.02 0.00 -0.26 0.00 0.00 58.87 59.39 3aez n SER 169 Cb 0.00 -1.50 0.26 0.00 -0.26 0.00 0.00 64.21 62.71 3aez n SER 169 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3aez h ASP 170 N 0.19 0.00 -2.98 4.04 3.32 -1.92 -3.30 116.42 115.78 3aez h ASP 170 Ca -0.49 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 3aez h ASP 170 Cb 1.34 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.65 3aez h ASP 170 CO 0.51 0.49 -0.17 -0.47 -1.72 0.00 0.00 179.24 177.88 3aez s TYR 171 N -3.70 -0.86 -0.02 4.55 6.14 -1.26 -3.07 117.35 119.14 3aez s TYR 171 Ca -0.01 1.72 -0.04 0.00 0.64 0.00 0.00 57.07 59.38 3aez s TYR 171 Cb 0.12 0.46 0.00 0.00 0.42 0.00 0.00 41.96 42.96 3aez s TYR 171 CO 0.73 -0.45 0.09 0.00 0.64 0.00 0.00 175.55 176.56 3aez s ALA 172 N 1.72 -0.22 -0.07 3.97 0.00 0.00 -4.97 121.76 122.19 3aez s ALA 172 Ca -0.09 0.05 0.03 0.00 0.00 0.00 0.00 51.96 51.95 3aez s ALA 172 Cb -0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 3aez s ALA 172 CO -0.16 -0.11 -0.15 0.00 0.00 0.00 0.00 175.76 175.34 3aez s ALA 174 N -0.43 2.66 1.09 0.00 0.00 -0.32 -4.94 121.76 119.82 3aez s ALA 174 Ca 0.05 -1.20 -0.16 0.00 0.00 0.00 0.00 51.96 50.64 3aez s ALA 174 Cb -0.12 -0.77 0.23 0.00 0.00 0.00 0.00 23.12 22.47 3aez s ALA 174 CO 0.02 0.58 1.14 -2.14 0.00 0.00 0.00 175.76 175.37 3aez s PRO 175 N -1.57 -0.31 -0.08 0.00 0.02 -1.26 -0.44 135.00 131.35 3aez s PRO 175 Ca 0.16 0.03 0.00 0.00 0.02 0.00 0.00 61.00 61.20 3aez s PRO 175 Cb -0.11 -1.69 0.02 0.00 0.02 0.00 0.00 34.50 32.74 3aez s PRO 175 CO 0.07 -3.12 -0.07 0.08 -0.33 0.00 0.00 177.00 173.63 3aez s VAL 176 N -3.18 0.83 0.02 3.83 1.01 -1.24 -4.32 120.40 117.34 3aez s VAL 176 Ca 0.69 -0.22 -0.11 0.00 0.00 0.00 0.00 61.98 62.35 3aez s VAL 176 Cb -0.11 -0.85 -0.05 0.00 0.00 0.00 0.00 36.38 35.36 3aez s VAL 176 CO 0.55 0.32 0.35 -0.47 0.00 0.00 0.00 175.10 175.85 3aez s TYR 177 N 1.37 3.64 -0.23 5.22 5.04 -1.26 -0.84 117.35 130.29 3aez s TYR 177 Ca -0.03 0.80 -0.04 0.00 -2.44 0.00 0.00 57.07 55.37 3aez s TYR 177 Cb -0.14 -2.15 -0.00 0.00 0.35 0.00 0.00 41.96 40.02 3aez s TYR 177 CO -0.03 0.61 -0.03 0.45 -1.34 0.00 0.00 175.55 175.20 3aez s SER 178 N -1.41 4.38 0.19 4.32 0.15 -0.56 -4.91 113.70 115.86 3aez s SER 178 Ca 0.27 -0.51 -0.11 0.00 0.70 0.00 0.00 55.95 56.30 3aez s SER 178 Cb -0.15 -1.74 0.12 0.00 -1.71 0.00 0.00 66.02 62.55 3aez s SER 178 CO 0.14 -0.06 1.81 0.45 1.20 0.00 0.00 173.24 176.79 3aez h HIS 179 N 8.11 0.96 -0.44 3.44 3.86 -1.96 0.17 115.15 129.29 3aez h HIS 179 Ca -0.39 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 58.79 3aez h HIS 179 Cb 1.15 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 29.29 3aez h HIS 179 CO 0.59 0.68 0.25 1.25 0.86 0.00 0.00 177.93 181.56 3aez h LEU 180 N 0.96 0.53 -1.04 2.43 5.85 -1.95 -0.75 115.31 121.35 3aez h LEU 180 Ca 0.24 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3aez h LEU 180 Cb 0.04 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.94 3aez h LEU 180 CO -0.04 0.45 -0.11 1.41 -0.34 0.00 0.00 178.44 179.81 3aez n HIS 181 N -4.72 0.00 -3.57 1.25 8.25 -1.22 -1.23 115.22 113.97 3aez n HIS 181 Ca 0.01 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.23 3aez n HIS 181 Cb 0.07 -0.03 0.08 0.00 1.12 0.00 0.00 29.99 31.22 3aez n HIS 181 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 3aez n TYR 182 N 0.18 -2.83 -3.57 4.41 9.36 0.54 -4.85 117.16 120.39 3aez n TYR 182 Ca 0.15 1.00 -0.06 0.00 3.32 0.00 0.00 57.90 62.31 3aez n TYR 182 Cb 0.41 -4.96 -0.03 0.00 -0.63 0.00 0.00 39.34 34.13 3aez n TYR 182 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3aez s ASP 183 N -3.31 -0.23 0.53 2.98 3.68 -0.92 -4.84 116.67 114.56 3aez s ASP 183 Ca 0.58 0.08 -0.23 0.00 2.13 0.00 0.00 52.55 55.11 3aez s ASP 183 Cb -0.25 0.22 -0.06 0.00 -1.45 0.00 0.00 42.92 41.38 3aez s ASP 183 CO 0.71 -0.33 1.38 -0.38 0.13 0.00 0.00 175.17 176.68 3aez n ILE 184 N 0.08 3.61 -3.48 4.11 2.08 -1.26 -1.50 119.36 123.00 3aez n ILE 184 Ca -0.04 -0.50 -0.38 0.00 0.56 0.00 0.00 62.75 62.39 3aez n ILE 184 Cb 0.59 -1.72 -0.09 0.00 -0.75 0.00 0.00 39.64 37.68 3aez n ILE 184 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 3aez s ILE 185 N -1.26 5.24 0.17 1.39 1.01 -0.02 -4.87 121.20 122.86 3aez s ILE 185 Ca 0.69 0.49 -0.32 0.00 0.00 0.00 0.00 60.65 61.51 3aez s ILE 185 Cb -0.42 -3.64 -0.11 0.00 0.01 0.00 0.00 42.46 38.30 3aez s ILE 185 CO 0.51 0.25 1.70 -2.84 0.00 0.00 0.00 174.94 174.57 3aez s PRO 186 N 1.47 4.16 0.00 2.79 0.02 -1.26 -2.21 135.00 139.97 3aez s PRO 186 Ca 0.14 2.52 0.00 0.00 0.02 0.00 0.00 61.00 63.68 3aez s PRO 186 Cb -0.15 -3.26 0.00 0.00 0.02 0.00 0.00 34.50 31.12 3aez s PRO 186 CO 0.08 -0.74 0.00 0.41 -0.33 0.00 0.00 177.00 176.42 3aez n GLY 187 N 3.99 1.65 3.77 0.52 0.00 -1.26 -5.00 105.19 108.86 3aez n GLY 187 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3aez n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3aez s ALA 188 N -3.37 3.37 -0.02 4.61 0.00 -0.94 -5.06 121.76 120.36 3aez s ALA 188 Ca 0.00 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 3aez s ALA 188 Cb 0.00 -3.06 0.01 0.00 0.00 0.00 0.00 23.12 20.06 3aez s ALA 188 CO 0.00 0.25 0.05 -1.83 0.00 0.00 0.00 175.76 174.24 3aez s GLU 189 N -1.38 0.07 -0.25 0.00 -1.05 -1.26 -3.69 118.70 111.14 3aez s GLU 189 Ca 0.40 0.07 -0.09 0.00 -0.15 0.00 0.00 54.97 55.20 3aez s GLU 189 Cb -0.23 0.03 -0.04 0.00 -0.44 0.00 0.00 34.13 33.45 3aez s GLU 189 CO 0.27 -0.01 0.13 -1.14 0.95 0.00 0.00 175.26 175.47 3aez s GLN 190 N 0.02 3.92 -0.24 -4.83 0.74 0.41 -4.94 119.66 114.74 3aez s GLN 190 Ca -0.00 -0.35 -0.09 0.00 0.05 0.00 0.00 55.36 54.98 3aez s GLN 190 Cb -0.00 -3.48 -0.04 0.00 1.10 0.00 0.00 33.01 30.59 3aez s GLN 190 CO 0.00 -0.04 0.11 0.08 -0.55 0.00 0.00 175.29 174.89 3aez s VAL 191 N 1.30 4.75 -0.19 1.34 1.01 -1.26 -1.17 120.40 126.18 3aez s VAL 191 Ca 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.98 3aez s VAL 191 Cb -0.14 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.00 3aez s VAL 191 CO 0.06 0.34 -0.05 -0.69 0.00 0.00 0.00 175.10 174.76 3aez s VAL 192 N 1.34 3.47 -0.43 2.92 1.01 0.12 -4.96 120.40 123.87 3aez s VAL 192 Ca 0.06 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.58 3aez s VAL 192 Cb -0.15 -2.55 0.12 0.00 0.00 0.00 0.00 36.38 33.80 3aez s VAL 192 CO 0.05 0.45 0.17 -0.13 0.00 0.00 0.00 175.10 175.64 3aez s ARG 193 N 1.05 1.79 -0.70 2.72 0.52 -1.26 -0.82 118.95 122.26 3aez s ARG 193 Ca 0.01 -2.16 -0.19 0.00 -0.52 0.00 0.00 55.73 52.87 3aez s ARG 193 Cb -0.15 -3.34 0.03 0.00 0.52 0.00 0.00 34.95 32.01 3aez s ARG 193 CO 0.00 -1.03 0.40 -2.39 0.02 0.00 0.00 175.30 172.30 3aez n HIS 194 N 3.88 -0.85 -0.95 -0.53 1.44 -1.17 -4.89 115.22 112.15 3aez n HIS 194 Ca 0.04 0.07 -0.31 0.00 -2.01 0.00 0.00 57.72 55.52 3aez n HIS 194 Cb 0.38 -1.62 0.14 0.00 0.12 0.00 0.00 29.99 29.01 3aez n HIS 194 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 3aez s PRO 195 N -6.20 1.36 0.15 -1.40 0.04 -1.26 -4.93 135.00 122.75 3aez s PRO 195 Ca 0.26 1.28 0.03 0.00 0.04 0.00 0.00 61.00 62.61 3aez s PRO 195 Cb -0.15 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.56 3aez s PRO 195 CO 0.57 -2.31 1.35 -0.44 0.04 0.00 0.00 177.00 176.22 3aez h ASP 196 N -1.62 0.21 -3.58 6.66 5.19 -1.09 -3.41 116.42 118.78 3aez h ASP 196 Ca -0.45 -0.18 -0.26 0.00 -0.62 0.00 0.00 57.03 55.52 3aez h ASP 196 Cb 1.26 -0.07 -0.31 0.00 0.18 0.00 0.00 39.33 40.39 3aez h ASP 196 CO 0.47 1.02 -0.68 -0.63 -3.12 0.00 0.00 179.24 176.30 3aez s ILE 197 N -3.08 -0.04 -0.15 0.35 1.01 -0.93 -1.98 121.20 116.39 3aez s ILE 197 Ca -0.02 0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.78 3aez s ILE 197 Cb 0.10 -0.11 0.01 0.00 0.01 0.00 0.00 42.46 42.47 3aez s ILE 197 CO 0.83 0.05 -0.22 -0.22 0.00 0.00 0.00 174.94 175.39 3aez s LEU 198 N 0.71 2.11 -0.22 2.97 2.96 -0.19 -1.06 118.68 125.97 3aez s LEU 198 Ca -0.06 -0.61 -0.09 0.00 -0.22 0.00 0.00 54.13 53.16 3aez s LEU 198 Cb -0.08 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.12 3aez s LEU 198 CO -0.03 0.06 0.10 -0.63 -1.32 0.00 0.00 176.35 174.54 3aez s ILE 199 N 0.91 4.90 -0.19 6.68 1.01 0.27 -0.21 121.20 134.57 3aez s ILE 199 Ca -0.05 0.02 -0.01 0.00 0.00 0.00 0.00 60.65 60.61 3aez s ILE 199 Cb -0.15 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.07 3aez s ILE 199 CO -0.04 0.39 -0.13 -0.22 0.00 0.00 0.00 174.94 174.94 3aez s LEU 200 N 0.92 2.50 -0.06 2.97 2.96 0.14 -0.76 118.68 127.35 3aez s LEU 200 Ca 0.05 -0.51 0.05 0.00 -0.22 0.00 0.00 54.13 53.50 3aez s LEU 200 Cb -0.13 -1.60 -0.00 0.00 0.50 0.00 0.00 46.19 44.95 3aez s LEU 200 CO 0.03 0.01 -0.21 -0.70 -1.32 0.00 0.00 176.35 174.16 3aez s GLU 201 N 1.29 2.29 0.00 1.98 2.12 -0.08 -0.70 118.70 125.60 3aez s GLU 201 Ca 0.04 -0.75 0.00 0.00 0.36 0.00 0.00 54.97 54.62 3aez s GLU 201 Cb -0.14 -1.90 0.00 0.00 0.26 0.00 0.00 34.13 32.35 3aez s GLU 201 CO -0.07 0.26 0.00 0.41 -0.54 0.00 0.00 175.26 175.32 3aez n GLY 202 N 3.22 1.48 0.28 -1.50 0.00 -0.45 -1.31 105.19 106.91 3aez n GLY 202 Ca -0.19 -0.76 -0.04 0.00 0.00 0.00 0.00 46.02 45.03 3aez n GLY 202 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3aez h LEU 203 N 0.00 -0.79 -3.29 0.99 3.38 -1.84 -3.19 115.31 110.57 3aez h LEU 203 Ca 0.00 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 3aez h LEU 203 Cb 0.00 0.44 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3aez h LEU 203 CO 0.00 -0.25 0.00 0.59 0.09 0.00 0.00 178.44 178.87 3aez n ASN 204 N -5.42 3.93 0.24 -0.43 3.02 -1.26 -3.50 115.26 111.84 3aez n ASN 204 Ca 0.04 -3.06 0.16 0.00 -0.03 0.00 0.00 54.58 51.70 3aez n ASN 204 Cb 0.32 -0.56 0.74 0.00 -0.61 0.00 0.00 39.78 39.68 3aez n ASN 204 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 3aez h VAL 205 N 1.89 0.00 -0.18 2.41 -1.51 -1.87 -0.61 116.25 116.37 3aez h VAL 205 Ca 0.02 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 3aez h VAL 205 Cb 1.50 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.75 3aez h VAL 205 CO 0.26 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.78 3aez n LEU 206 N -2.73 2.10 -4.62 4.19 4.77 -1.26 -3.54 117.00 115.90 3aez n LEU 206 Ca -0.00 -0.85 -0.38 0.00 -0.03 0.00 0.00 56.01 54.75 3aez n LEU 206 Cb 0.19 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.22 3aez n LEU 206 CO 0.21 0.42 0.57 0.00 -1.33 0.00 0.00 177.39 177.26 3aez n GLN 207 N 0.61 0.95 -4.50 3.23 6.02 -0.24 -4.88 117.38 118.57 3aez n GLN 207 Ca 0.17 0.37 -0.24 0.00 -0.01 0.00 0.00 57.00 57.29 3aez n GLN 207 Cb 0.41 -2.19 -0.11 0.00 1.02 0.00 0.00 30.24 29.38 3aez n GLN 207 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3aez s THR 208 N -1.49 1.66 -0.02 5.09 -1.32 -1.26 -4.42 115.64 113.88 3aez s THR 208 Ca 0.75 -2.05 0.00 0.00 -1.21 0.00 0.00 61.69 59.18 3aez s THR 208 Cb -0.42 -2.75 0.00 0.00 -1.51 0.00 0.00 72.50 67.82 3aez s THR 208 CO 0.47 -0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.39 3aez n GLY 209 N -0.76 -1.19 0.00 6.08 0.00 -1.26 -4.98 105.19 103.09 3aez n GLY 209 Ca -0.04 -0.87 0.10 0.00 0.00 0.00 0.00 46.02 45.21 3aez n GLY 209 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3aez n PRO 210 N -0.00 0.94 -4.27 1.61 -0.04 -1.26 -4.68 135.00 127.30 3aez n PRO 210 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 3aez n PRO 210 Cb 0.00 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.02 3aez n PRO 210 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 3aez s THR 211 N -2.00 0.85 0.29 0.52 -1.32 -1.26 -5.11 115.64 107.61 3aez s THR 211 Ca 0.30 -2.01 -0.30 0.00 -1.21 0.00 0.00 61.69 58.48 3aez s THR 211 Cb 0.14 -2.14 -0.11 0.00 -1.51 0.00 0.00 72.50 68.88 3aez s THR 211 CO 0.23 -0.47 1.47 -0.22 -2.21 0.00 0.00 174.62 173.42 3aez s LEU 212 N -3.21 4.37 0.27 9.08 2.96 -1.26 -5.01 118.68 125.89 3aez s LEU 212 Ca 0.24 2.80 0.03 0.00 -0.22 0.00 0.00 54.13 56.98 3aez s LEU 212 Cb 0.05 -3.64 -0.06 0.00 0.50 0.00 0.00 46.19 43.05 3aez s LEU 212 CO 0.05 -0.76 0.04 -0.04 -1.32 0.00 0.00 176.35 174.31 3aez s MET 213 N -0.80 1.48 0.49 1.98 -1.94 -1.26 -5.03 119.30 114.22 3aez s MET 213 Ca 0.58 -1.79 0.24 0.00 -1.71 0.00 0.00 55.69 53.01 3aez s MET 213 Cb -0.44 -0.65 1.30 0.00 2.01 0.00 0.00 34.83 37.05 3aez s MET 213 CO 0.48 -0.17 1.94 -0.39 -0.01 0.00 0.00 175.02 176.87 3aez h VAL 214 N 2.32 0.70 0.00 -6.03 -1.51 -1.88 0.13 116.25 109.98 3aez h VAL 214 Ca -0.39 -0.05 -0.03 0.00 -1.23 0.00 0.00 66.70 64.99 3aez h VAL 214 Cb 1.24 0.54 -0.00 0.00 -2.13 0.00 0.00 31.29 30.93 3aez h VAL 214 CO 0.66 0.03 -0.16 0.77 -1.23 0.00 0.00 177.57 177.63 3aez h SER 215 N 0.15 0.00 1.05 4.19 4.64 -1.77 0.25 113.55 122.06 3aez h SER 215 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3aez h SER 215 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3aez h SER 215 CO -0.05 0.16 0.00 0.44 -0.87 0.00 0.00 176.83 176.51 3aez h ASP 216 N 0.00 0.00 -0.15 4.97 5.19 -1.03 -2.87 116.42 122.53 3aez h ASP 216 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3aez h ASP 216 Cb 0.36 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.87 3aez h ASP 216 CO 0.02 0.00 0.00 0.18 -3.12 0.00 0.00 179.24 176.32 3aez n LEU 217 N -2.69 2.71 -4.73 1.55 4.77 0.86 -4.98 117.00 114.50 3aez n LEU 217 Ca 0.02 -1.02 -0.41 0.00 -0.03 0.00 0.00 56.01 54.56 3aez n LEU 217 Cb 0.31 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 3aez n LEU 217 CO 0.25 0.51 0.72 -0.36 -1.33 0.00 0.00 177.39 177.18 3aez s PHE 218 N -1.82 3.72 -0.98 -1.77 2.99 -1.08 -4.63 117.98 114.40 3aez s PHE 218 Ca 0.33 1.71 0.26 0.00 0.00 0.00 0.00 56.93 59.23 3aez s PHE 218 Cb 0.21 -3.15 0.62 0.00 0.00 0.00 0.00 43.02 40.70 3aez s PHE 218 CO 0.31 -0.14 1.50 -0.25 -0.00 0.00 0.00 175.22 176.64 3aez n ASP 219 N 2.77 0.42 -3.62 1.36 8.00 0.27 -4.94 116.55 120.83 3aez n ASP 219 Ca 0.03 -0.10 -0.09 0.00 0.71 0.00 0.00 54.79 55.34 3aez n ASP 219 Cb 0.48 0.11 -0.06 0.00 -0.02 0.00 0.00 41.12 41.63 3aez n ASP 219 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3aez s PHE 220 N -3.01 -0.40 0.02 1.24 5.36 -1.08 -4.99 117.98 115.12 3aez s PHE 220 Ca 0.11 0.86 -0.01 0.00 -0.96 0.00 0.00 56.93 56.94 3aez s PHE 220 Cb 0.18 0.41 -0.02 0.00 -0.34 0.00 0.00 43.02 43.25 3aez s PHE 220 CO 0.67 -0.25 -0.01 -1.54 -1.46 0.00 0.00 175.22 172.62 3aez s SER 221 N -0.32 0.20 -0.01 6.13 1.04 -1.26 -0.90 113.70 118.57 3aez s SER 221 Ca 0.02 -0.42 0.02 0.00 0.48 0.00 0.00 55.95 56.05 3aez s SER 221 Cb -0.03 0.10 -0.03 0.00 0.10 0.00 0.00 66.02 66.15 3aez s SER 221 CO -0.04 -0.27 -0.05 -0.76 0.98 0.00 0.00 173.24 173.10 3aez s LEU 222 N -1.28 3.27 -0.16 2.42 1.43 0.61 -1.39 118.68 123.58 3aez s LEU 222 Ca -0.14 -0.08 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 3aez s LEU 222 Cb -0.09 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.30 3aez s LEU 222 CO -0.01 0.30 -0.19 -0.47 0.23 0.00 0.00 176.35 176.21 3aez s TYR 223 N -0.99 2.75 -0.40 0.29 5.04 0.05 -0.51 117.35 123.59 3aez s TYR 223 Ca 0.17 -1.39 -0.20 0.00 -2.44 0.00 0.00 57.07 53.20 3aez s TYR 223 Cb -0.11 -1.89 0.01 0.00 0.35 0.00 0.00 41.96 40.32 3aez s TYR 223 CO 0.07 -0.67 0.61 0.08 -1.34 0.00 0.00 175.55 174.30 3aez s VAL 224 N 1.06 4.89 0.30 3.14 1.01 0.09 -1.24 120.40 129.64 3aez s VAL 224 Ca -0.01 0.27 0.10 0.00 0.00 0.00 0.00 61.98 62.34 3aez s VAL 224 Cb -0.14 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 3aez s VAL 224 CO -0.06 -0.44 -0.01 -0.62 0.00 0.00 0.00 175.10 173.97 3aez s ASP 225 N 1.89 4.31 0.12 3.32 2.15 0.13 -4.33 116.67 124.25 3aez s ASP 225 Ca 0.22 -0.82 -0.26 0.00 0.43 0.00 0.00 52.55 52.12 3aez s ASP 225 Cb -0.15 -0.66 0.08 0.00 -0.30 0.00 0.00 42.92 41.90 3aez s ASP 225 CO 0.16 -0.10 1.06 0.00 -0.17 0.00 0.00 175.17 176.12 3aez s ALA 226 N -2.42 -1.79 0.44 3.66 0.00 -1.26 -1.66 121.76 118.71 3aez s ALA 226 Ca 0.33 0.17 -0.25 0.00 0.00 0.00 0.00 51.96 52.21 3aez s ALA 226 Cb -0.04 0.60 -0.08 0.00 0.00 0.00 0.00 23.12 23.60 3aez s ALA 226 CO 0.19 -1.05 1.30 1.03 0.00 0.00 0.00 175.76 177.23 3aez s ARG 227 N -2.88 3.80 0.25 0.00 0.52 -1.26 -4.85 118.95 114.53 3aez s ARG 227 Ca 0.15 2.13 -0.06 0.00 -0.52 0.00 0.00 55.73 57.43 3aez s ARG 227 Cb -0.00 -2.63 0.27 0.00 0.52 0.00 0.00 34.95 33.12 3aez s ARG 227 CO 0.01 -0.63 1.92 0.97 0.02 0.00 0.00 175.30 177.60 3aez h ILE 228 N 2.22 1.25 -0.89 1.52 2.10 -2.00 -1.41 117.51 120.30 3aez h ILE 228 Ca -0.50 -0.49 -0.01 0.00 1.08 0.00 0.00 64.86 64.94 3aez h ILE 228 Cb 1.26 -0.15 -0.04 0.00 -1.09 0.00 0.00 36.82 36.79 3aez h ILE 228 CO 0.61 0.25 0.53 -0.33 -1.08 0.00 0.00 178.15 178.14 3aez h GLU 229 N 1.32 1.20 -0.23 2.19 3.07 -2.00 -1.34 114.58 118.80 3aez h GLU 229 Ca 0.35 -0.11 -0.04 0.00 -0.50 0.00 0.00 59.36 59.06 3aez h GLU 229 Cb -0.12 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 27.53 3aez h GLU 229 CO -0.07 0.84 -0.02 -0.44 -1.40 0.00 0.00 179.01 177.92 3aez h ASP 230 N 1.22 0.42 -0.79 1.42 3.32 -1.67 -2.02 116.42 118.33 3aez h ASP 230 Ca 0.32 -0.34 0.01 0.00 0.02 0.00 0.00 57.03 57.05 3aez h ASP 230 Cb -0.05 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 3aez h ASP 230 CO -0.06 0.65 0.52 0.40 -1.72 0.00 0.00 179.24 179.04 3aez h ILE 231 N 0.17 1.18 -0.53 0.35 2.04 -0.93 0.25 117.51 120.05 3aez h ILE 231 Ca 0.06 -0.36 -0.05 0.00 1.00 0.00 0.00 64.86 65.51 3aez h ILE 231 Cb 0.45 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 3aez h ILE 231 CO 0.02 0.19 0.13 -0.08 0.00 0.00 0.00 178.15 178.41 3aez h GLU 232 N 1.04 0.84 -0.57 2.37 4.81 -1.18 0.11 114.58 122.01 3aez h GLU 232 Ca 0.29 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 3aez h GLU 232 Cb -0.08 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.16 3aez h GLU 232 CO -0.07 0.80 0.33 0.37 -0.73 0.00 0.00 179.01 179.72 3aez h GLN 233 N 0.74 0.78 -0.85 1.92 5.75 -0.17 0.19 115.11 123.47 3aez h GLN 233 Ca 0.17 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.57 3aez h GLN 233 Cb 0.34 -0.16 -0.04 0.00 1.07 0.00 0.00 27.48 28.69 3aez h GLN 233 CO 0.00 0.57 0.46 -1.49 -2.65 0.00 0.00 178.83 175.72 3aez h TRP 234 N 0.76 1.16 -0.13 3.99 6.55 0.00 -0.57 115.95 127.72 3aez h TRP 234 Ca 0.20 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 60.00 3aez h TRP 234 Cb -0.00 -0.37 -0.01 0.00 -0.86 0.00 0.00 29.16 27.92 3aez h TRP 234 CO -0.02 0.81 0.04 -0.92 -1.05 0.00 0.00 178.44 177.29 3aez h TYR 235 N 1.19 0.21 -0.49 0.49 3.20 0.13 -0.84 116.97 120.86 3aez h TYR 235 Ca 0.30 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.08 3aez h TYR 235 Cb 0.03 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 3aez h TYR 235 CO 0.01 0.34 0.04 0.28 -1.64 0.00 0.00 178.16 177.19 3aez h VAL 236 N 0.02 1.26 -0.34 1.81 2.07 -0.85 -0.70 116.25 119.51 3aez h VAL 236 Ca 0.04 -1.00 -0.09 0.00 0.82 0.00 0.00 66.70 66.47 3aez h VAL 236 Cb 0.23 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3aez h VAL 236 CO -0.00 0.35 -0.16 -1.28 0.02 0.00 0.00 177.57 176.50 3aez h SER 237 N 0.71 0.60 0.08 0.57 0.87 -1.05 -0.21 113.55 115.11 3aez h SER 237 Ca 0.14 -0.18 -0.15 0.00 -1.23 0.00 0.00 61.79 60.38 3aez h SER 237 Cb 0.45 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 3aez h SER 237 CO 0.02 0.77 -0.51 -0.09 -0.53 0.00 0.00 176.83 176.49 3aez h ARG 238 N 0.55 0.49 -0.12 2.24 2.43 -0.95 -1.04 114.38 117.98 3aez h ARG 238 Ca 0.09 -0.29 0.01 0.00 -0.81 0.00 0.00 59.98 58.98 3aez h ARG 238 Cb 0.59 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 3aez h ARG 238 CO 0.04 0.88 0.04 0.35 -1.51 0.00 0.00 179.97 179.77 3aez h PHE 239 N 0.38 0.07 -0.97 2.20 3.57 -0.17 -0.55 116.94 121.48 3aez h PHE 239 Ca 0.01 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.53 3aez h PHE 239 Cb 1.03 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.71 3aez h PHE 239 CO 0.04 0.04 0.63 -0.07 -2.23 0.00 0.00 178.31 176.71 3aez h LEU 240 N 0.10 1.13 -1.50 0.59 4.07 -0.87 -2.13 115.31 116.69 3aez h LEU 240 Ca 0.05 -0.04 -0.05 0.00 0.08 0.00 0.00 57.88 57.92 3aez h LEU 240 Cb 0.03 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.48 3aez h LEU 240 CO -0.05 0.83 -0.23 0.00 -1.08 0.00 0.00 178.44 177.90 3aez h ALA 241 N 1.37 1.26 0.00 1.53 0.00 -0.80 -2.81 119.26 119.80 3aez h ALA 241 Ca 0.35 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3aez h ALA 241 Cb -0.13 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3aez h ALA 241 CO -0.07 0.29 0.00 -1.33 0.00 0.00 0.00 179.25 178.14 3aez n MET 242 N -3.74 0.13 -0.16 0.00 2.81 -0.25 -2.93 117.12 112.97 3aez n MET 242 Ca -0.01 0.11 0.21 0.00 -1.81 0.00 0.00 57.70 56.19 3aez n MET 242 Cb 0.34 -1.65 0.59 0.00 -0.71 0.00 0.00 33.22 31.79 3aez n MET 242 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3aez h ARG 243 N 0.00 0.23 -0.01 0.03 3.08 -1.46 0.33 114.38 116.58 3aez h ARG 243 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3aez h ARG 243 Cb 0.61 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.61 3aez h ARG 243 CO 0.00 0.15 -0.02 0.25 -1.07 0.00 0.00 179.97 179.28 3aez n THR 244 N -4.42 0.00 0.00 2.04 -2.24 -1.15 -3.33 114.28 105.18 3aez n THR 244 Ca 0.16 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 3aez n THR 244 Cb 0.70 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 70.18 3aez n THR 244 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3aez n THR 245 N 0.60 0.00 -0.19 4.28 -2.24 -0.70 -4.74 114.28 111.29 3aez n THR 245 Ca 0.07 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.81 3aez n THR 245 Cb 0.30 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.59 3aez n THR 245 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3aez h ALA 246 N -1.70 0.73 0.00 6.98 0.00 -1.85 -2.67 119.26 120.75 3aez h ALA 246 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3aez h ALA 246 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3aez h ALA 246 CO 0.00 -0.05 0.00 0.74 0.00 0.00 0.00 179.25 179.94 3aez h PHE 247 N 0.56 0.00 0.00 0.00 0.04 -1.21 -2.55 116.94 113.78 3aez h PHE 247 Ca 0.25 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.98 3aez h PHE 247 Cb 0.15 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 3aez h PHE 247 CO -0.10 0.00 -0.19 0.00 -0.60 0.00 0.00 178.31 177.43 3aez h ALA 248 N 2.04 1.24 -2.43 2.45 0.00 -1.47 -3.35 119.26 117.74 3aez h ALA 248 Ca 0.00 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.21 3aez h ALA 248 Cb 0.48 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.27 3aez h ALA 248 CO 0.00 0.24 1.17 -3.47 0.00 0.00 0.00 179.25 177.19 3aez n ASP 249 N -3.66 4.12 0.27 0.00 -0.08 -0.96 -4.88 116.55 111.36 3aez n ASP 249 Ca -0.01 0.95 0.12 0.00 -1.51 0.00 0.00 54.79 54.34 3aez n ASP 249 Cb 0.31 -1.54 0.80 0.00 2.34 0.00 0.00 41.12 43.03 3aez n ASP 249 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3aez h PRO 250 N 9.52 0.00 0.00 -0.67 0.11 -1.89 0.37 132.00 139.44 3aez h PRO 250 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3aez h PRO 250 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3aez h PRO 250 CO 0.95 0.00 0.00 1.49 -0.21 0.00 0.00 178.00 180.23 3aez h GLU 251 N 0.00 0.00 -6.90 1.05 4.81 -1.94 -3.46 114.58 108.14 3aez h GLU 251 Ca 0.01 0.00 -0.55 0.00 -0.13 0.00 0.00 59.36 58.69 3aez h GLU 251 Cb 0.05 0.00 0.12 0.00 0.63 0.00 0.00 28.75 29.55 3aez h GLU 251 CO -0.00 0.00 0.62 0.45 -0.73 0.00 0.00 179.01 179.35 3aez n SER 252 N -2.88 3.06 0.21 1.04 2.88 0.12 -4.73 113.62 113.31 3aez n SER 252 Ca 0.02 1.14 0.05 0.00 -1.33 0.00 0.00 58.87 58.75 3aez n SER 252 Cb 0.38 -1.56 0.47 0.00 -0.75 0.00 0.00 64.21 62.75 3aez n SER 252 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 3aez h HIS 253 N 2.32 0.00 -0.60 0.66 2.76 -1.46 -2.05 115.15 116.79 3aez h HIS 253 Ca -0.49 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 57.36 3aez h HIS 253 Cb 1.28 0.00 -0.19 0.00 1.55 0.00 0.00 27.41 30.05 3aez h HIS 253 CO 0.49 0.25 0.20 1.19 -1.30 0.00 0.00 177.93 178.77 3aez n PHE 254 N -4.15 1.86 -0.14 5.26 3.01 -1.26 -4.68 117.46 117.36 3aez n PHE 254 Ca -0.02 -1.71 0.18 0.00 1.01 0.00 0.00 57.45 56.91 3aez n PHE 254 Cb 0.31 -0.67 0.56 0.00 -0.01 0.00 0.00 39.48 39.67 3aez n PHE 254 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 3aez h HIS 255 N 1.01 0.36 0.00 1.38 2.76 -1.49 0.91 115.15 120.07 3aez h HIS 255 Ca 0.39 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.57 3aez h HIS 255 Cb 2.14 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 30.98 3aez h HIS 255 CO 1.27 0.13 0.00 1.12 -1.30 0.00 0.00 177.93 179.15 3aez h HIS 256 N 0.30 0.00 0.00 5.26 2.07 -1.84 -1.65 115.15 119.29 3aez h HIS 256 Ca 0.36 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.88 3aez h HIS 256 Cb 0.98 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.96 3aez h HIS 256 CO -0.00 0.00 -0.35 1.88 -3.07 0.00 0.00 177.93 176.39 3aez h TYR 257 N 0.00 0.00 -1.01 6.12 0.99 -1.13 -3.33 116.97 118.61 3aez h TYR 257 Ca 0.00 0.00 0.25 0.00 2.00 0.00 0.00 58.73 60.98 3aez h TYR 257 Cb 0.10 0.00 -0.08 0.00 1.00 0.00 0.00 36.73 37.74 3aez h TYR 257 CO 0.00 0.00 0.66 0.00 -0.00 0.00 0.00 178.16 178.82 3aez h ALA 258 N 2.30 2.25 -0.02 3.88 0.00 -1.40 -2.18 119.26 124.10 3aez h ALA 258 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3aez h ALA 258 Cb 0.85 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3aez h ALA 258 CO 0.00 -0.62 -0.23 0.00 0.00 0.00 0.00 179.25 178.40 3aez n ALA 259 N -2.50 3.03 -1.75 0.00 0.00 -1.25 -4.83 120.51 113.21 3aez n ALA 259 Ca 0.23 -0.53 -0.38 0.00 0.00 0.00 0.00 53.44 52.77 3aez n ALA 259 Cb 0.83 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 19.33 3aez n ALA 259 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3aez s PHE 260 N -2.32 2.42 0.81 0.00 0.40 -0.82 -5.02 117.98 113.46 3aez s PHE 260 Ca 0.26 1.44 -0.11 0.00 -0.60 0.00 0.00 56.93 57.91 3aez s PHE 260 Cb 0.19 -3.66 0.08 0.00 0.51 0.00 0.00 43.02 40.14 3aez s PHE 260 CO 0.47 -2.50 1.09 -1.54 0.70 0.00 0.00 175.22 173.44 3aez s SER 261 N -1.15 4.26 0.28 1.36 1.04 -1.26 -4.79 113.70 113.44 3aez s SER 261 Ca 0.71 1.51 -0.01 0.00 0.48 0.00 0.00 55.95 58.64 3aez s SER 261 Cb -0.36 -2.24 0.62 0.00 0.10 0.00 0.00 66.02 64.14 3aez s SER 261 CO 0.42 -2.14 1.64 0.44 0.98 0.00 0.00 173.24 174.58 3aez h ASP 262 N -1.21 -0.14 0.17 7.02 5.19 -1.99 0.26 116.42 125.72 3aez h ASP 262 Ca -0.47 0.20 -0.29 0.00 -0.62 0.00 0.00 57.03 55.85 3aez h ASP 262 Cb 1.26 0.31 0.03 0.00 0.18 0.00 0.00 39.33 41.10 3aez h ASP 262 CO 0.56 -0.17 -1.21 -1.28 -3.12 0.00 0.00 179.24 174.01 3aez h SER 263 N 0.16 0.83 -0.69 6.45 0.87 -2.00 -1.18 113.55 118.00 3aez h SER 263 Ca 0.51 -0.75 0.02 0.00 -1.23 0.00 0.00 61.79 60.34 3aez h SER 263 Cb 0.99 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.65 3aez h SER 263 CO -0.67 1.56 0.46 1.56 -0.53 0.00 0.00 176.83 179.20 3aez h GLN 264 N 0.27 0.85 -0.12 2.24 4.20 -1.83 -2.47 115.11 118.24 3aez h GLN 264 Ca -0.17 -0.05 -0.23 0.00 0.06 0.00 0.00 58.65 58.26 3aez h GLN 264 Cb 1.88 -0.19 0.01 0.00 0.30 0.00 0.00 27.48 29.48 3aez h GLN 264 CO 0.23 0.56 -0.81 0.00 -0.67 0.00 0.00 178.83 178.14 3aez h ALA 265 N 1.59 0.26 -0.66 3.87 0.00 -0.59 -1.60 119.26 122.12 3aez h ALA 265 Ca 0.27 -0.61 0.04 0.00 0.00 0.00 0.00 54.91 54.61 3aez h ALA 265 Cb -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3aez h ALA 265 CO -0.07 0.66 0.39 0.28 0.00 0.00 0.00 179.25 180.51 3aez h VAL 266 N 0.48 1.04 0.09 0.00 2.07 -1.15 0.15 116.25 118.93 3aez h VAL 266 Ca -0.07 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.20 3aez h VAL 266 Cb 1.45 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3aez h VAL 266 CO 0.17 0.14 -0.08 0.58 0.02 0.00 0.00 177.57 178.39 3aez h VAL 267 N 0.75 0.81 -0.68 2.57 2.07 -1.27 -1.26 116.25 119.24 3aez h VAL 267 Ca 0.28 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.82 3aez h VAL 267 Cb 0.09 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 3aez h VAL 267 CO -0.14 0.00 0.43 0.00 0.02 0.00 0.00 177.57 177.89 3aez h ALA 268 N 0.71 0.88 -0.08 1.67 0.00 -0.89 -2.37 119.26 119.18 3aez h ALA 268 Ca 0.00 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 3aez h ALA 268 Cb 0.18 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.74 3aez h ALA 268 CO -0.02 0.23 -0.87 0.00 0.00 0.00 0.00 179.25 178.59 3aez h ALA 269 N 1.28 0.31 -0.08 0.00 0.00 -0.77 -2.50 119.26 117.51 3aez h ALA 269 Ca 0.26 -0.64 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 3aez h ALA 269 Cb -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3aez h ALA 269 CO -0.09 0.71 -0.21 0.00 0.00 0.00 0.00 179.25 179.67 3aez h ARG 270 N 0.42 0.13 -0.19 0.00 3.08 -1.18 -0.78 114.38 115.86 3aez h ARG 270 Ca -0.07 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.83 3aez h ARG 270 Cb 1.49 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.53 3aez h ARG 270 CO 0.17 0.34 -0.33 1.49 -1.07 0.00 0.00 179.97 180.57 3aez h GLU 271 N 0.12 0.57 -0.80 0.04 4.57 -1.19 0.13 114.58 118.03 3aez h GLU 271 Ca 0.02 -0.35 0.03 0.00 -1.18 0.00 0.00 59.36 57.88 3aez h GLU 271 Cb 0.44 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 29.02 3aez h GLU 271 CO 0.03 0.96 0.52 0.82 -1.18 0.00 0.00 179.01 180.15 3aez h ILE 272 N 0.23 1.14 -0.30 2.32 2.04 -1.24 0.12 117.51 121.81 3aez h ILE 272 Ca 0.01 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 3aez h ILE 272 Cb 0.92 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3aez h ILE 272 CO 0.08 0.18 0.15 -0.25 0.00 0.00 0.00 178.15 178.31 3aez h TRP 273 N 1.01 0.44 -0.56 1.37 2.91 -0.99 -0.35 115.95 119.77 3aez h TRP 273 Ca 0.32 -0.02 -0.11 0.00 1.13 0.00 0.00 58.89 60.21 3aez h TRP 273 Cb -0.01 -0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 28.48 3aez h TRP 273 CO -0.03 0.39 -0.06 -0.09 -1.03 0.00 0.00 178.44 177.62 3aez h ARG 274 N 0.36 1.03 0.00 2.65 2.43 -0.61 0.62 114.38 120.86 3aez h ARG 274 Ca 0.10 -0.35 -0.10 0.00 -0.81 0.00 0.00 59.98 58.82 3aez h ARG 274 Cb 0.12 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 3aez h ARG 274 CO -0.01 1.04 -1.51 0.25 -1.51 0.00 0.00 179.97 178.23 3aez n THR 275 N -4.16 0.80 0.00 0.20 -2.24 -0.00 -4.36 114.28 104.52 3aez n THR 275 Ca 0.02 -0.63 -0.00 0.00 -2.27 0.00 0.00 64.05 61.17 3aez n THR 275 Cb 0.38 -0.45 -0.00 0.00 -2.10 0.00 0.00 70.33 68.16 3aez n THR 275 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3aez n ILE 276 N -2.69 0.13 -0.06 2.28 5.41 -0.16 -4.79 119.36 119.48 3aez n ILE 276 Ca -0.08 0.07 -0.10 0.00 1.00 0.00 0.00 62.75 63.65 3aez n ILE 276 Cb 0.73 -1.10 0.05 0.00 -0.71 0.00 0.00 39.64 38.62 3aez n ILE 276 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 3aez h ASN 277 N -0.01 0.78 0.06 4.38 2.35 -1.38 -2.25 115.58 119.51 3aez h ASN 277 Ca 0.00 -0.35 -0.00 0.00 -0.55 0.00 0.00 56.30 55.40 3aez h ASN 277 Cb 0.01 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.16 3aez h ASN 277 CO 0.00 1.07 -0.03 -0.09 -1.65 0.00 0.00 177.43 176.73 3aez h ARG 278 N 0.61 -0.08 -0.88 0.81 2.43 0.00 -1.51 114.38 115.76 3aez h ARG 278 Ca 0.05 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.33 3aez h ARG 278 Cb 0.92 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.42 3aez h ARG 278 CO 0.08 0.23 0.57 -1.35 -1.51 0.00 0.00 179.97 177.99 3aez h PRO 279 N -0.38 0.84 -0.36 0.20 0.11 -1.76 -0.78 132.00 129.87 3aez h PRO 279 Ca -0.01 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.91 3aez h PRO 279 Cb 0.34 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 3aez h PRO 279 CO 0.01 0.56 -0.35 -0.97 -0.21 0.00 0.00 178.00 177.04 3aez h ASN 280 N 0.86 0.87 -0.15 -2.05 -1.24 -1.33 -0.03 115.58 112.51 3aez h ASN 280 Ca 0.41 -0.37 -0.01 0.00 0.71 0.00 0.00 56.30 57.04 3aez h ASN 280 Cb 0.43 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.23 3aez h ASN 280 CO -0.18 1.13 0.05 0.25 -1.29 0.00 0.00 177.43 177.40 3aez h LEU 281 N 0.68 0.21 -0.22 0.34 5.85 -0.44 0.65 115.31 122.38 3aez h LEU 281 Ca 0.07 -0.18 -0.17 0.00 0.84 0.00 0.00 57.88 58.43 3aez h LEU 281 Cb 0.91 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.89 3aez h LEU 281 CO 0.08 0.33 -0.54 0.58 -0.34 0.00 0.00 178.44 178.56 3aez h VAL 282 N 0.07 1.30 0.08 1.05 2.07 -1.05 0.13 116.25 119.91 3aez h VAL 282 Ca 0.05 -1.75 -0.29 0.00 0.82 0.00 0.00 66.70 65.53 3aez h VAL 282 Cb 0.19 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 3aez h VAL 282 CO -0.00 0.56 -1.48 -0.33 0.02 0.00 0.00 177.57 176.34 3aez h GLU 283 N 0.47 0.17 0.00 1.57 5.08 -0.99 -3.41 114.58 117.47 3aez h GLU 283 Ca -0.01 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 3aez h GLU 283 Cb 1.15 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.51 3aez h GLU 283 CO 0.12 1.01 -0.93 0.09 -1.00 0.00 0.00 179.01 178.29 3aez n ASN 284 N -3.38 3.84 -0.07 1.42 3.02 0.16 -4.72 115.26 115.53 3aez n ASN 284 Ca -0.14 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.30 3aez n ASN 284 Cb 1.03 0.05 -0.08 0.00 -0.61 0.00 0.00 39.78 40.17 3aez n ASN 284 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3aez h ILE 285 N 0.00 0.99 -0.28 2.41 2.04 -1.07 -3.36 117.51 118.23 3aez h ILE 285 Ca 0.00 -1.83 -0.01 0.00 1.00 0.00 0.00 64.86 64.02 3aez h ILE 285 Cb 0.93 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.95 3aez h ILE 285 CO 0.00 0.33 0.12 -0.07 0.00 0.00 0.00 178.15 178.53 3aez h LEU 286 N -1.00 0.34 0.00 1.44 3.38 -0.99 0.78 115.31 119.26 3aez h LEU 286 Ca -0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3aez h LEU 286 Cb 0.75 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3aez h LEU 286 CO -0.04 0.31 0.00 -2.65 0.09 0.00 0.00 178.44 176.15 3aez n PRO 287 N -4.43 0.09 0.01 1.13 -0.02 -1.26 -1.52 135.00 129.00 3aez n PRO 287 Ca 0.01 0.25 0.11 0.00 -2.02 0.00 0.00 63.50 61.85 3aez n PRO 287 Cb 0.13 -1.50 0.13 0.00 -0.02 0.00 0.00 33.50 32.23 3aez n PRO 287 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3aez n THR 288 N -1.34 0.04 -0.26 3.45 -2.24 0.26 -4.42 114.28 109.77 3aez n THR 288 Ca 0.03 -0.04 0.08 0.00 -2.27 0.00 0.00 64.05 61.85 3aez n THR 288 Cb 0.08 0.41 0.33 0.00 -2.10 0.00 0.00 70.33 69.05 3aez n THR 288 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3aez h ARG 289 N 0.00 0.78 -0.02 -0.78 2.43 -1.31 -2.46 114.38 113.02 3aez h ARG 289 Ca 0.00 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3aez h ARG 289 Cb 0.54 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 3aez h ARG 289 CO 0.00 0.52 0.15 -1.35 -1.51 0.00 0.00 179.97 177.78 3aez h PRO 290 N 0.81 0.00 0.00 0.20 0.11 -1.78 -2.05 132.00 129.29 3aez h PRO 290 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 3aez h PRO 290 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 3aez h PRO 290 CO -0.16 0.00 -0.89 0.54 -0.21 0.00 0.00 178.00 177.28 3aez n ARG 291 N -3.09 0.13 -2.01 1.05 1.74 -0.93 -4.93 116.66 108.62 3aez n ARG 291 Ca -0.02 -0.01 -0.40 0.00 -0.77 0.00 0.00 57.85 56.65 3aez n ARG 291 Cb 0.21 -1.54 -0.01 0.00 -1.02 0.00 0.00 32.46 30.11 3aez n ARG 291 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3aez s ALA 292 N -3.09 3.46 0.29 7.54 0.00 -0.77 -4.89 121.76 124.30 3aez s ALA 292 Ca 0.07 1.35 -0.00 0.00 0.00 0.00 0.00 51.96 53.37 3aez s ALA 292 Cb 0.16 -3.52 0.44 0.00 0.00 0.00 0.00 23.12 20.19 3aez s ALA 292 CO 0.79 -0.81 1.85 1.15 0.00 0.00 0.00 175.76 178.74 3aez h THR 293 N 2.88 1.22 -3.03 0.00 2.02 -1.70 -3.41 112.91 110.88 3aez h THR 293 Ca -0.50 -0.76 -0.31 0.00 0.77 0.00 0.00 66.41 65.62 3aez h THR 293 Cb 1.23 0.64 -0.36 0.00 -1.74 0.00 0.00 68.15 67.93 3aez h THR 293 CO 0.64 0.29 -0.64 -0.22 0.37 0.00 0.00 175.52 175.96 3aez s LEU 294 N -9.36 -0.06 -0.12 2.58 2.96 -0.48 -0.83 118.68 113.36 3aez s LEU 294 Ca -0.10 0.23 -0.23 0.00 -0.22 0.00 0.00 54.13 53.81 3aez s LEU 294 Cb 0.16 0.25 -0.03 0.00 0.50 0.00 0.00 46.19 47.07 3aez s LEU 294 CO 0.79 -0.26 0.72 -0.69 -1.32 0.00 0.00 176.35 175.59 3aez s VAL 295 N 2.29 5.00 -0.39 1.68 1.01 -0.38 -0.77 120.40 128.84 3aez s VAL 295 Ca 0.03 1.43 -0.10 0.00 0.00 0.00 0.00 61.98 63.35 3aez s VAL 295 Cb -0.13 -4.04 0.05 0.00 0.00 0.00 0.00 36.38 32.27 3aez s VAL 295 CO -0.06 0.17 0.23 -0.76 0.00 0.00 0.00 175.10 174.67 3aez s LEU 296 N 1.38 4.90 -0.24 3.92 1.43 -0.38 -1.97 118.68 127.73 3aez s LEU 296 Ca 0.36 -1.25 -0.12 0.00 -1.03 0.00 0.00 54.13 52.09 3aez s LEU 296 Cb -0.17 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 44.01 3aez s LEU 296 CO 0.15 -0.46 0.22 -0.13 0.23 0.00 0.00 176.35 176.37 3aez s ARG 297 N 1.49 4.08 -0.03 1.70 0.52 -0.35 -0.70 118.95 125.66 3aez s ARG 297 Ca 0.02 -0.16 -0.02 0.00 -0.52 0.00 0.00 55.73 55.05 3aez s ARG 297 Cb -0.21 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.66 3aez s ARG 297 CO 0.04 0.00 0.13 0.15 0.02 0.00 0.00 175.30 175.64 3aez s LYS 298 N 1.23 3.27 0.74 3.54 1.02 -0.67 -1.95 119.74 126.91 3aez s LYS 298 Ca 0.10 -0.36 -0.06 0.00 0.02 0.00 0.00 55.97 55.67 3aez s LYS 298 Cb -0.14 -3.00 0.10 0.00 -0.52 0.00 0.00 37.83 34.27 3aez s LYS 298 CO 0.06 0.68 1.04 -0.51 -0.92 0.00 0.00 175.35 175.70 3aez s ASP 299 N -1.68 4.42 0.65 2.83 1.01 0.46 -4.44 116.67 119.91 3aez s ASP 299 Ca 0.23 0.14 0.21 0.00 0.71 0.00 0.00 52.55 53.84 3aez s ASP 299 Cb -0.12 -0.63 1.06 0.00 1.01 0.00 0.00 42.92 44.24 3aez s ASP 299 CO 0.14 -1.83 1.59 0.00 0.21 0.00 0.00 175.17 175.27 3aez h ALA 300 N -0.70 1.79 -0.56 5.23 0.00 -1.99 0.60 119.26 123.63 3aez h ALA 300 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3aez h ALA 300 Cb 1.29 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3aez h ALA 300 CO 0.50 -0.71 0.00 -0.40 0.00 0.00 0.00 179.25 178.64 3aez n ASP 301 N -2.92 3.67 0.00 0.00 5.75 -1.26 -4.90 116.55 116.89 3aez n ASP 301 Ca 0.02 -2.22 0.00 0.00 -0.01 0.00 0.00 54.79 52.59 3aez n ASP 301 Cb 0.70 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 40.32 3aez n ASP 301 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 3aez n HIS 302 N 1.04 0.00 -2.18 2.11 8.25 0.20 -4.80 115.22 119.84 3aez n HIS 302 Ca 0.21 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.24 3aez n HIS 302 Cb 0.65 -0.39 -0.03 0.00 1.12 0.00 0.00 29.99 31.35 3aez n HIS 302 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3aez s SER 303 N -2.82 6.79 -0.53 0.41 0.15 -1.25 -4.77 113.70 111.68 3aez s SER 303 Ca 0.00 2.04 -0.28 0.00 0.70 0.00 0.00 55.95 58.41 3aez s SER 303 Cb 0.00 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 61.78 3aez s SER 303 CO 0.00 -0.83 1.36 -0.63 1.20 0.00 0.00 173.24 174.35 3aez s ILE 304 N 3.47 3.86 -0.58 6.45 1.01 -1.26 -0.41 121.20 133.75 3aez s ILE 304 Ca 0.65 0.78 0.13 0.00 0.00 0.00 0.00 60.65 62.21 3aez s ILE 304 Cb -0.29 -4.45 -0.14 0.00 0.01 0.00 0.00 42.46 37.58 3aez s ILE 304 CO 0.24 -1.12 0.53 0.59 0.00 0.00 0.00 174.94 175.18 3aez n ASN 305 N 9.18 0.64 -3.89 3.58 3.02 -0.82 -4.87 115.26 122.10 3aez n ASN 305 Ca 0.12 -0.77 -0.11 0.00 -0.03 0.00 0.00 54.58 53.79 3aez n ASN 305 Cb 0.49 1.02 -0.11 0.00 -0.61 0.00 0.00 39.78 40.57 3aez n ASN 305 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3aez s ARG 306 N -2.21 0.38 0.02 3.52 0.52 -1.14 -2.53 118.95 117.50 3aez s ARG 306 Ca 0.04 -0.34 0.02 0.00 -0.52 0.00 0.00 55.73 54.94 3aez s ARG 306 Cb 0.09 0.15 -0.01 0.00 0.52 0.00 0.00 34.95 35.71 3aez s ARG 306 CO 0.52 -0.08 -0.06 -0.51 0.02 0.00 0.00 175.30 175.18 3aez s LEU 307 N -1.12 2.12 -0.22 2.53 1.02 -0.73 -1.21 118.68 121.07 3aez s LEU 307 Ca -0.12 -0.30 0.00 0.00 0.02 0.00 0.00 54.13 53.73 3aez s LEU 307 Cb -0.07 -0.23 0.06 0.00 0.02 0.00 0.00 46.19 45.97 3aez s LEU 307 CO 0.01 -0.05 -0.05 -0.60 0.02 0.00 0.00 176.35 175.68 3aez s ARG 308 N -0.77 1.52 -0.13 1.70 3.52 -0.83 -0.47 118.95 123.49 3aez s ARG 308 Ca -0.03 -0.85 -0.06 0.00 -0.13 0.00 0.00 55.73 54.66 3aez s ARG 308 Cb -0.06 -2.45 -0.04 0.00 -1.56 0.00 0.00 34.95 30.85 3aez s ARG 308 CO 0.00 -0.57 0.07 -1.17 -0.81 0.00 0.00 175.30 172.83 3aez s LEU 309 N 1.48 3.97 -0.21 -0.88 2.96 0.10 -1.25 118.68 124.86 3aez s LEU 309 Ca -0.04 0.26 -0.28 0.00 -0.22 0.00 0.00 54.13 53.84 3aez s LEU 309 Cb -0.18 -1.96 0.00 0.00 0.50 0.00 0.00 46.19 44.55 3aez s LEU 309 CO -0.07 0.33 1.00 -0.13 -1.32 0.00 0.00 176.35 176.16 3aez s ARG 310 N -0.58 4.28 0.01 1.98 0.52 -0.01 -0.15 118.95 124.99 3aez s ARG 310 Ca 0.11 1.30 0.22 0.00 -0.52 0.00 0.00 55.73 56.84 3aez s ARG 310 Cb -0.12 -3.62 -0.27 0.00 0.52 0.00 0.00 34.95 31.46 3aez s ARG 310 CO 0.02 -0.55 0.61 0.36 0.02 0.00 0.00 175.30 175.76 3aez n LYS 311 N 6.02 0.60 0.00 3.54 2.85 0.81 -4.95 118.16 127.03 3aez n LYS 311 Ca 0.10 -0.13 0.00 0.00 -1.05 0.00 0.00 58.31 57.23 3aez n LYS 311 Cb 0.47 -1.57 0.00 0.00 -0.65 0.00 0.00 35.03 33.28 3aez n LYS 311 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63