#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a9s s SER 2 N 0.00 6.48 -0.07 6.12 0.15 -1.26 -5.00 113.70 120.12 2a9s s SER 2 Ca 0.00 0.53 -0.04 0.00 0.70 0.00 0.00 55.95 57.14 2a9s s SER 2 Cb 0.00 -2.08 -0.03 0.00 -1.71 0.00 0.00 66.02 62.20 2a9s s SER 2 CO 0.00 0.24 -0.10 -0.11 1.20 0.00 0.00 173.24 174.47 2a9s n LEU 3 N 1.00 0.61 -4.91 3.45 7.94 -1.26 -5.07 117.00 118.76 2a9s n LEU 3 Ca -0.10 0.10 -0.27 0.00 -1.11 0.00 0.00 56.01 54.63 2a9s n LEU 3 Cb 0.53 -0.25 -0.00 0.00 0.53 0.00 0.00 43.42 44.23 2a9s n LEU 3 CO 0.42 0.11 0.39 -0.36 -1.11 0.00 0.00 177.39 176.84 2a9s s PHE 4 N -2.15 3.54 0.32 1.96 0.08 -1.26 -5.05 117.98 115.43 2a9s s PHE 4 Ca -0.11 0.71 -0.27 0.00 0.12 0.00 0.00 56.93 57.38 2a9s s PHE 4 Cb 0.04 -2.22 -0.13 0.00 -0.57 0.00 0.00 43.02 40.14 2a9s s PHE 4 CO 0.14 -0.20 1.06 -2.30 -0.10 0.00 0.00 175.22 173.82 2a9s n PRO 5 N -2.16 1.51 -0.31 0.24 -0.02 -1.26 -4.69 135.00 128.31 2a9s n PRO 5 Ca -0.01 0.53 0.15 0.00 -2.02 0.00 0.00 63.50 62.15 2a9s n PRO 5 Cb 0.55 -1.97 0.33 0.00 -0.02 0.00 0.00 33.50 32.40 2a9s n PRO 5 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2a9s h GLY 6 N 2.03 1.61 1.50 -1.23 0.00 -1.99 -0.23 103.07 104.76 2a9s h GLY 6 Ca -0.42 -0.17 -0.13 0.00 0.00 0.00 0.00 47.33 46.62 2a9s h GLY 6 CO 0.60 -0.31 -0.40 1.29 0.00 0.00 0.00 176.54 177.72 2a9s h ASP 7 N 0.37 0.58 -0.16 0.19 2.03 -1.99 0.81 116.42 118.26 2a9s h ASP 7 Ca 0.59 -0.26 -0.01 0.00 -0.73 0.00 0.00 57.03 56.62 2a9s h ASP 7 Cb 1.17 -0.16 -0.01 0.00 -0.83 0.00 0.00 39.33 39.50 2a9s h ASP 7 CO -0.56 0.92 0.04 0.40 -1.03 0.00 0.00 179.24 179.01 2a9s h ILE 8 N 0.45 1.20 -0.75 4.15 2.04 -1.43 -0.40 117.51 122.78 2a9s h ILE 8 Ca 0.04 -0.63 0.07 0.00 1.00 0.00 0.00 64.86 65.34 2a9s h ILE 8 Cb 0.90 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 38.24 2a9s h ILE 8 CO 0.08 0.19 0.43 -0.08 0.00 0.00 0.00 178.15 178.76 2a9s h GLU 9 N 0.06 0.74 -0.52 2.37 4.81 -1.21 -0.30 114.58 120.52 2a9s h GLU 9 Ca 0.05 -0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 2a9s h GLU 9 Cb 0.26 -0.17 -0.06 0.00 0.63 0.00 0.00 28.75 29.41 2a9s h GLU 9 CO 0.00 0.49 0.21 1.49 -0.73 0.00 0.00 179.01 180.47 2a9s h GLU 10 N 0.76 0.40 -0.31 1.92 4.81 -0.58 0.75 114.58 122.33 2a9s h GLU 10 Ca 0.34 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.51 2a9s h GLU 10 Cb 0.23 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2a9s h GLU 10 CO -0.20 0.26 0.05 -0.07 -0.73 0.00 0.00 179.01 178.32 2a9s h LEU 11 N 0.41 0.49 -0.75 1.64 3.38 -0.40 -0.31 115.31 119.76 2a9s h LEU 11 Ca 0.25 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.99 2a9s h LEU 11 Cb 0.24 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2a9s h LEU 11 CO -0.23 0.63 0.47 0.00 0.09 0.00 0.00 178.44 179.40 2a9s h ALA 12 N 0.88 1.00 -0.80 1.53 0.00 -0.83 -1.56 119.26 119.48 2a9s h ALA 12 Ca 0.09 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2a9s h ALA 12 Cb 0.35 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2a9s h ALA 12 CO 0.01 0.25 0.32 -0.09 0.00 0.00 0.00 179.25 179.74 2a9s h ARG 13 N 0.91 1.19 -0.58 0.00 2.43 -0.52 -1.45 114.38 116.36 2a9s h ARG 13 Ca 0.31 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2a9s h ARG 13 Cb 0.05 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 2a9s h ARG 13 CO -0.12 0.96 0.32 -0.09 -1.51 0.00 0.00 179.97 179.52 2a9s h ARG 14 N 1.16 0.81 -0.14 0.20 2.43 -0.42 -0.06 114.38 118.36 2a9s h ARG 14 Ca 0.27 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2a9s h ARG 14 Cb 0.21 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2a9s h ARG 14 CO -0.02 0.62 0.06 0.82 -1.51 0.00 0.00 179.97 179.94 2a9s h ILE 15 N 0.79 1.13 -0.58 1.20 2.04 -0.82 0.72 117.51 121.99 2a9s h ILE 15 Ca 0.20 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 2a9s h ILE 15 Cb 0.04 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 2a9s h ILE 15 CO -0.03 0.12 0.20 0.40 0.00 0.00 0.00 178.15 178.84 2a9s h ILE 16 N 0.09 1.23 -0.48 -0.67 1.08 -1.09 0.44 117.51 118.11 2a9s h ILE 16 Ca 0.05 -0.77 -0.04 0.00 -0.39 0.00 0.00 64.86 63.71 2a9s h ILE 16 Cb 0.13 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.51 2a9s h ILE 16 CO -0.01 0.29 0.13 0.74 -0.69 0.00 0.00 178.15 178.61 2a9s h THR 17 N 0.80 1.23 -0.08 -0.27 2.02 -0.73 -2.32 112.91 113.57 2a9s h THR 17 Ca 0.19 -0.81 -0.10 0.00 0.77 0.00 0.00 66.41 66.46 2a9s h THR 17 Cb 0.25 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 2a9s h THR 17 CO -0.01 0.29 -0.35 0.44 0.37 0.00 0.00 175.52 176.26 2a9s h ASP 18 N 0.65 0.44 0.88 4.18 3.32 -0.72 -3.34 116.42 121.83 2a9s h ASP 18 Ca 0.15 -0.64 -0.13 0.00 0.02 0.00 0.00 57.03 56.43 2a9s h ASP 18 Cb 0.31 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 2a9s h ASP 18 CO -0.00 1.01 -0.61 -0.26 -1.72 0.00 0.00 179.24 177.66 2a9s h PHE 19 N -0.10 0.00 0.68 4.55 -1.00 -0.90 -3.22 116.94 116.95 2a9s h PHE 19 Ca -0.02 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 2a9s h PHE 19 Cb 1.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.56 2a9s h PHE 19 CO 0.12 0.61 -0.34 1.15 -1.61 0.00 0.00 178.31 178.24 2a9s h THR 20 N 0.00 0.30 0.00 -1.55 2.02 -1.53 -0.54 112.91 111.61 2a9s h THR 20 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 2a9s h THR 20 Cb 1.22 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 2a9s h THR 20 CO 0.08 0.00 -0.06 1.55 0.37 0.00 0.00 175.52 177.45 2a9s h PRO 21 N -0.93 0.00 0.00 6.66 0.13 -1.73 -1.58 132.00 134.54 2a9s h PRO 21 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 2a9s h PRO 21 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2a9s h PRO 21 CO 0.14 0.06 0.00 1.28 -0.23 0.00 0.00 178.00 179.26 2a9s n LEU 22 N -3.28 0.23 -1.51 1.56 4.77 -1.04 -4.94 117.00 112.80 2a9s n LEU 22 Ca -0.01 0.53 -0.12 0.00 -0.03 0.00 0.00 56.01 56.37 2a9s n LEU 22 Cb 0.26 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2a9s n LEU 22 CO 0.27 -0.09 -0.12 0.61 -1.33 0.00 0.00 177.39 176.74 2a9s n GLY 23 N 1.27 -0.10 3.83 -0.72 0.00 -0.33 -5.02 105.19 104.12 2a9s n GLY 23 Ca 0.06 -0.34 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 2a9s n GLY 23 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a9s s LEU 24 N -3.66 4.01 0.17 0.99 1.43 -0.52 -5.01 118.68 116.09 2a9s s LEU 24 Ca 0.05 0.11 0.06 0.00 -1.03 0.00 0.00 54.13 53.32 2a9s s LEU 24 Cb -0.02 -2.63 -0.04 0.00 0.03 0.00 0.00 46.19 43.53 2a9s s LEU 24 CO 0.06 0.18 -0.13 -0.04 0.23 0.00 0.00 176.35 176.65 2a9s s MET 25 N -2.35 1.17 0.09 1.70 -1.94 -1.26 -4.61 119.30 112.10 2a9s s MET 25 Ca 0.30 -1.47 0.05 0.00 -1.71 0.00 0.00 55.69 52.87 2a9s s MET 25 Cb -0.12 -0.90 -0.03 0.00 2.01 0.00 0.00 34.83 35.79 2a9s s MET 25 CO 0.23 0.14 -0.14 0.14 -0.01 0.00 0.00 175.02 175.38 2a9s s VAL 26 N -2.93 1.20 0.14 -6.03 -7.23 0.34 -1.27 120.40 104.61 2a9s s VAL 26 Ca 0.18 -1.50 0.07 0.00 -1.81 0.00 0.00 61.98 58.92 2a9s s VAL 26 Cb -0.00 -1.29 -0.04 0.00 0.56 0.00 0.00 36.38 35.61 2a9s s VAL 26 CO 0.04 -0.32 -0.16 -0.44 -0.31 0.00 0.00 175.10 173.90 2a9s s SER 27 N -2.08 2.30 0.09 4.85 0.01 -0.44 -0.71 113.70 117.72 2a9s s SER 27 Ca 0.03 -0.81 0.07 0.00 1.31 0.00 0.00 55.95 56.55 2a9s s SER 27 Cb -0.07 -0.11 -0.03 0.00 0.21 0.00 0.00 66.02 66.02 2a9s s SER 27 CO 0.02 -0.08 -0.19 0.42 0.41 0.00 0.00 173.24 173.82 2a9s s THR 28 N -1.99 1.56 -0.12 1.44 -4.23 -0.97 -1.72 115.64 109.60 2a9s s THR 28 Ca 0.11 -1.43 -0.01 0.00 -1.18 0.00 0.00 61.69 59.18 2a9s s THR 28 Cb -0.06 -1.42 0.04 0.00 1.34 0.00 0.00 72.50 72.40 2a9s s THR 28 CO 0.04 -0.06 -0.01 0.00 -0.54 0.00 0.00 174.62 174.06 2a9s s ALA 29 N -1.12 0.96 -0.07 3.99 0.00 0.02 -0.61 121.76 124.92 2a9s s ALA 29 Ca 0.05 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 51.62 2a9s s ALA 29 Cb -0.10 -0.92 0.02 0.00 0.00 0.00 0.00 23.12 22.12 2a9s s ALA 29 CO 0.03 -0.66 -0.11 -1.21 0.00 0.00 0.00 175.76 173.81 2a9s s GLU 30 N 1.87 1.62 0.00 0.00 2.02 0.64 -1.77 118.70 123.08 2a9s s GLU 30 Ca 0.03 -0.37 0.00 0.00 0.02 0.00 0.00 54.97 54.65 2a9s s GLU 30 Cb -0.14 -1.39 0.00 0.00 0.10 0.00 0.00 34.13 32.71 2a9s s GLU 30 CO -0.07 -0.02 0.00 0.45 0.02 0.00 0.00 175.26 175.65 2a9s n SER 31 N 3.96 0.00 0.23 -0.19 2.88 -0.72 -0.59 113.62 119.19 2a9s n SER 31 Ca -0.22 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.39 2a9s n SER 31 Cb 0.51 0.00 0.54 0.00 -0.75 0.00 0.00 64.21 64.52 2a9s n SER 31 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2a9s n THR 33 N -4.19 0.09 -1.66 0.00 -2.24 -1.26 -4.87 114.28 100.15 2a9s n THR 33 Ca -0.02 -0.05 -0.21 0.00 -2.27 0.00 0.00 64.05 61.50 2a9s n THR 33 Cb 0.25 -0.29 -0.08 0.00 -2.10 0.00 0.00 70.33 68.10 2a9s n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a9s n GLY 34 N 1.47 1.78 0.00 3.38 0.00 -0.67 -1.64 105.19 109.51 2a9s n GLY 34 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2a9s n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a9s n GLY 35 N -0.43 0.93 0.28 -0.02 0.00 -1.26 -5.00 105.19 99.70 2a9s n GLY 35 Ca -0.21 0.00 0.17 0.00 0.00 0.00 0.00 46.02 45.98 2a9s n GLY 35 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2a9s h LEU 36 N 0.00 0.00 0.15 0.99 3.38 -1.73 0.86 115.31 118.97 2a9s h LEU 36 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2a9s h LEU 36 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2a9s h LEU 36 CO 0.00 0.03 -0.07 0.40 0.09 0.00 0.00 178.44 178.89 2a9s h ILE 37 N 0.00 0.97 -0.96 1.22 2.04 -1.95 0.14 117.51 118.98 2a9s h ILE 37 Ca -0.00 -1.06 0.10 0.00 1.00 0.00 0.00 64.86 64.91 2a9s h ILE 37 Cb 0.41 1.56 -0.07 0.00 -0.74 0.00 0.00 36.82 37.97 2a9s h ILE 37 CO 0.00 0.23 0.61 0.00 0.00 0.00 0.00 178.15 178.99 2a9s h ALA 38 N -0.09 1.56 -0.14 1.87 0.00 -1.95 -1.72 119.26 118.80 2a9s h ALA 38 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2a9s h ALA 38 Cb 0.53 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2a9s h ALA 38 CO 0.03 0.23 0.00 0.78 0.00 0.00 0.00 179.25 180.30 2a9s h GLY 39 N 0.97 0.13 0.96 0.00 0.00 -0.66 -1.05 103.07 103.42 2a9s h GLY 39 Ca 0.45 0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 2a9s h GLY 39 CO -0.21 -0.02 0.16 0.00 0.00 0.00 0.00 176.54 176.47 2a9s h ALA 40 N 1.11 0.37 -0.65 3.60 0.00 -0.34 -2.27 119.26 121.08 2a9s h ALA 40 Ca 0.06 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2a9s h ALA 40 Cb 0.07 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2a9s h ALA 40 CO -0.10 -0.11 0.43 -0.07 0.00 0.00 0.00 179.25 179.40 2a9s h LEU 41 N 0.35 0.75 -0.97 0.00 3.38 -1.12 -2.58 115.31 115.12 2a9s h LEU 41 Ca 0.10 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2a9s h LEU 41 Cb 0.05 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2a9s h LEU 41 CO -0.02 0.55 0.00 0.35 0.09 0.00 0.00 178.44 179.41 2a9s n THR 42 N -4.43 0.12 0.28 0.22 -2.24 -0.42 -2.80 114.28 105.02 2a9s n THR 42 Ca 0.07 -0.29 0.17 0.00 -2.27 0.00 0.00 64.05 61.73 2a9s n THR 42 Cb 0.04 0.36 0.81 0.00 -2.10 0.00 0.00 70.33 69.44 2a9s n THR 42 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2a9s h GLU 43 N 2.10 0.00 -5.68 -0.78 4.39 -0.99 -3.44 114.58 110.18 2a9s h GLU 43 Ca 0.00 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.11 2a9s h GLU 43 Cb 0.45 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.01 2a9s h GLU 43 CO 0.00 0.05 0.17 0.42 -1.16 0.00 0.00 179.01 178.49 2a9s s ILE 44 N -3.92 4.99 0.25 3.13 -1.09 -1.12 -5.03 121.20 118.41 2a9s s ILE 44 Ca -0.01 1.24 -0.31 0.00 -2.23 0.00 0.00 60.65 59.34 2a9s s ILE 44 Cb 0.11 -3.97 -0.11 0.00 -1.58 0.00 0.00 42.46 36.91 2a9s s ILE 44 CO 0.53 0.08 1.60 0.00 -1.23 0.00 0.00 174.94 175.93 2a9s s ALA 45 N 2.05 3.78 0.00 9.38 0.00 -1.26 -1.07 121.76 134.64 2a9s s ALA 45 Ca 0.30 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.78 2a9s s ALA 45 Cb -0.16 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2a9s s ALA 45 CO 0.10 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.36 2a9s n GLY 46 N 2.82 0.79 0.32 0.00 0.00 -1.26 -4.96 105.19 102.89 2a9s n GLY 46 Ca 0.11 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.31 2a9s n GLY 46 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2a9s h SER 47 N 0.00 0.00 0.04 1.61 4.64 -1.39 -2.00 113.55 116.45 2a9s h SER 47 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a9s h SER 47 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2a9s h SER 47 CO 0.00 0.00 -0.01 0.77 -0.87 0.00 0.00 176.83 176.72 2a9s h SER 48 N 0.00 0.00 1.21 4.97 4.64 -1.88 0.60 113.55 123.09 2a9s h SER 48 Ca 0.01 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 2a9s h SER 48 Cb 0.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2a9s h SER 48 CO -0.00 0.01 -0.04 0.00 -0.87 0.00 0.00 176.83 175.92 2a9s h ALA 49 N 1.99 1.00 0.00 5.18 0.00 -1.78 -3.37 119.26 122.28 2a9s h ALA 49 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2a9s h ALA 49 Cb 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2a9s h ALA 49 CO 0.00 0.05 -1.13 0.28 0.00 0.00 0.00 179.25 178.45 2a9s n VAL 50 N -3.14 0.13 -2.96 0.00 0.31 -0.16 -4.81 118.33 107.71 2a9s n VAL 50 Ca 0.01 -0.06 -0.42 0.00 -0.01 0.00 0.00 64.34 63.86 2a9s n VAL 50 Cb 0.38 -0.67 -0.05 0.00 -0.91 0.00 0.00 33.84 32.58 2a9s n VAL 50 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2a9s s VAL 51 N -2.05 4.76 -0.09 2.52 1.01 0.02 -0.50 120.40 126.07 2a9s s VAL 51 Ca -0.03 0.99 -0.03 0.00 0.00 0.00 0.00 61.98 62.91 2a9s s VAL 51 Cb 0.01 -4.18 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 2a9s s VAL 51 CO 0.06 -0.35 -0.07 -0.78 0.00 0.00 0.00 175.10 173.96 2a9s h ASP 52 N 8.33 0.00 -5.02 3.32 3.58 -1.25 -3.46 116.42 121.92 2a9s h ASP 52 Ca -0.25 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.26 2a9s h ASP 52 Cb 1.10 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.09 2a9s h ASP 52 CO 0.90 0.48 0.20 0.00 -2.88 0.00 0.00 179.24 177.94 2a9s s ARG 53 N -1.69 1.73 0.01 0.28 1.70 -1.25 -5.05 118.95 114.68 2a9s s ARG 53 Ca -0.06 -0.97 0.00 0.00 -0.47 0.00 0.00 55.73 54.24 2a9s s ARG 53 Cb 0.01 0.60 -0.01 0.00 -0.57 0.00 0.00 34.95 34.97 2a9s s ARG 53 CO 0.08 -0.78 -0.02 0.20 -1.08 0.00 0.00 175.30 173.70 2a9s s GLY 54 N -2.91 0.14 -0.15 3.88 0.00 -1.26 -2.29 107.32 104.74 2a9s s GLY 54 Ca 0.11 -0.32 0.02 0.00 0.00 0.00 0.00 44.72 44.53 2a9s s GLY 54 CO 0.05 -0.35 -0.21 -1.36 0.00 0.00 0.00 173.10 171.23 2a9s s PHE 55 N -0.75 2.64 -0.38 1.90 0.08 0.22 -4.96 117.98 116.72 2a9s s PHE 55 Ca -0.08 -1.39 -0.08 0.00 0.12 0.00 0.00 56.93 55.50 2a9s s PHE 55 Cb -0.05 -1.81 0.06 0.00 -0.57 0.00 0.00 43.02 40.65 2a9s s PHE 55 CO -0.00 -0.65 0.19 0.08 -0.10 0.00 0.00 175.22 174.74 2a9s s VAL 56 N 0.95 4.04 -0.80 -0.44 1.01 -1.26 -0.26 120.40 123.64 2a9s s VAL 56 Ca -0.04 -1.29 0.02 0.00 0.00 0.00 0.00 61.98 60.67 2a9s s VAL 56 Cb -0.15 -3.40 0.24 0.00 0.00 0.00 0.00 36.38 33.07 2a9s s VAL 56 CO -0.05 -0.37 0.85 0.35 0.00 0.00 0.00 175.10 175.88 2a9s n THR 57 N 4.87 2.95 0.13 3.92 -2.24 0.24 -4.86 114.28 119.29 2a9s n THR 57 Ca -0.11 -5.27 -0.01 0.00 -2.27 0.00 0.00 64.05 56.40 2a9s n THR 57 Cb 0.44 -2.19 0.15 0.00 -2.10 0.00 0.00 70.33 66.63 2a9s n THR 57 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2a9s h TYR 58 N 5.07 0.00 -1.99 4.78 3.20 -1.85 -3.41 116.97 122.77 2a9s h TYR 58 Ca 0.18 0.00 -0.48 0.00 3.14 0.00 0.00 58.73 61.57 2a9s h TYR 58 Cb 0.71 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.95 2a9s h TYR 58 CO 0.77 0.64 -0.45 0.95 -1.64 0.00 0.00 178.16 178.42 2a9s s THR 59 N -3.51 4.11 0.29 1.81 -4.23 -1.26 -4.99 115.64 107.86 2a9s s THR 59 Ca -0.01 -1.27 -0.01 0.00 -1.18 0.00 0.00 61.69 59.22 2a9s s THR 59 Cb 0.12 -3.37 0.20 0.00 1.34 0.00 0.00 72.50 70.79 2a9s s THR 59 CO 0.76 -0.24 1.89 0.78 -0.54 0.00 0.00 174.62 177.26 2a9s h ASN 60 N 1.25 0.82 -0.26 3.99 4.21 -2.00 -2.20 115.58 121.39 2a9s h ASN 60 Ca -0.47 -0.09 0.05 0.00 1.21 0.00 0.00 56.30 57.00 2a9s h ASN 60 Cb 1.25 -0.21 -0.05 0.00 -1.12 0.00 0.00 38.32 38.18 2a9s h ASN 60 CO 0.58 0.72 -0.08 0.44 -1.29 0.00 0.00 177.43 177.80 2a9s h ASP 61 N 0.90 -0.28 -0.79 5.81 3.32 -1.96 -2.10 116.42 121.31 2a9s h ASP 61 Ca 0.22 0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.38 2a9s h ASP 61 Cb 0.13 0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.81 2a9s h ASP 61 CO -0.02 -0.10 0.51 0.00 -1.72 0.00 0.00 179.24 177.90 2a9s h ALA 62 N 1.24 1.03 -0.43 3.45 0.00 -1.82 -0.06 119.26 122.67 2a9s h ALA 62 Ca 0.13 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2a9s h ALA 62 Cb 0.21 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2a9s h ALA 62 CO -0.28 0.34 0.25 0.87 0.00 0.00 0.00 179.25 180.43 2a9s h LYS 63 N 1.01 0.49 0.78 0.00 1.57 -1.14 0.69 116.57 119.96 2a9s h LYS 63 Ca 0.31 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 59.02 2a9s h LYS 63 Cb -0.03 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.18 2a9s h LYS 63 CO -0.10 0.33 -0.39 0.00 -0.57 0.00 0.00 179.45 178.72 2a9s h ARG 64 N 0.51 -1.03 0.08 3.15 3.08 -1.04 -2.04 114.38 117.09 2a9s h ARG 64 Ca 0.17 0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.29 2a9s h ARG 64 Cb 0.01 0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2a9s h ARG 64 CO -0.08 -0.68 -0.04 -0.44 -1.07 0.00 0.00 179.97 177.66 2a9s h ASP 65 N -1.06 -0.09 0.33 7.04 3.32 -0.88 -1.04 116.42 124.03 2a9s h ASP 65 Ca -0.11 -0.29 -0.26 0.00 0.02 0.00 0.00 57.03 56.39 2a9s h ASP 65 Cb 0.82 0.02 0.01 0.00 0.22 0.00 0.00 39.33 40.41 2a9s h ASP 65 CO 0.17 0.25 -1.10 0.24 -1.72 0.00 0.00 179.24 177.08 2a9s h MET 66 N -0.44 0.45 0.00 3.56 2.86 -1.01 -3.39 114.93 116.96 2a9s h MET 66 Ca -0.01 -0.57 0.00 0.00 -2.06 0.00 0.00 59.70 57.06 2a9s h MET 66 Cb 0.38 0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.22 2a9s h MET 66 CO 0.02 1.22 -0.23 1.28 1.06 0.00 0.00 176.91 180.25 2a9s n LEU 67 N -3.72 0.21 -0.79 1.22 4.77 -0.79 -4.90 117.00 113.00 2a9s n LEU 67 Ca -0.09 -0.49 -0.08 0.00 -0.03 0.00 0.00 56.01 55.32 2a9s n LEU 67 Cb 0.92 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.99 2a9s n LEU 67 CO 0.54 0.05 -0.09 0.61 -1.33 0.00 0.00 177.39 177.17 2a9s n GLY 68 N 1.13 0.47 3.74 -0.72 0.00 -0.39 -4.01 105.19 105.40 2a9s n GLY 68 Ca 0.01 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 45.01 2a9s n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a9s s VAL 69 N -2.36 2.84 0.26 1.61 1.01 -1.06 -4.96 120.40 117.74 2a9s s VAL 69 Ca 0.00 0.70 -0.29 0.00 0.00 0.00 0.00 61.98 62.38 2a9s s VAL 69 Cb 0.00 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.84 2a9s s VAL 69 CO 0.00 0.11 1.16 -0.83 0.00 0.00 0.00 175.10 175.54 2a9s s GLY 70 N 0.39 2.94 0.52 4.51 0.00 -1.26 -4.20 107.32 110.22 2a9s s GLY 70 Ca 0.59 0.97 0.21 0.00 0.00 0.00 0.00 44.72 46.49 2a9s s GLY 70 CO 0.41 1.67 2.04 -0.84 0.00 0.00 0.00 173.10 176.38 2a9s h THR 71 N 3.29 0.83 -0.16 0.90 2.02 -1.99 -1.08 112.91 116.72 2a9s h THR 71 Ca -0.46 -0.01 -0.17 0.00 0.77 0.00 0.00 66.41 66.53 2a9s h THR 71 Cb 1.21 0.80 -0.00 0.00 -1.74 0.00 0.00 68.15 68.42 2a9s h THR 71 CO 0.69 0.01 -0.60 -0.08 0.37 0.00 0.00 175.52 175.90 2a9s h GLU 72 N 0.03 0.55 -0.33 6.66 4.22 -1.99 -1.62 114.58 122.10 2a9s h GLU 72 Ca 0.17 -0.37 -0.16 0.00 0.08 0.00 0.00 59.36 59.08 2a9s h GLU 72 Cb 0.65 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2a9s h GLU 72 CO -0.01 0.99 -0.43 1.15 -2.18 0.00 0.00 179.01 178.53 2a9s h THR 73 N 0.41 1.28 -0.09 0.32 2.02 -1.68 -3.00 112.91 112.16 2a9s h THR 73 Ca -0.00 -1.61 -0.21 0.00 0.77 0.00 0.00 66.41 65.36 2a9s h THR 73 Cb 1.16 1.47 0.01 0.00 -1.74 0.00 0.00 68.15 69.06 2a9s h THR 73 CO 0.11 0.53 -0.74 -0.07 0.37 0.00 0.00 175.52 175.72 2a9s h LEU 74 N 0.68 0.82 -0.19 2.58 3.38 -1.07 0.80 115.31 122.31 2a9s h LEU 74 Ca 0.05 -0.67 -0.19 0.00 0.09 0.00 0.00 57.88 57.16 2a9s h LEU 74 Cb 1.01 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 2a9s h LEU 74 CO 0.10 1.36 -0.90 0.71 0.09 0.00 0.00 178.44 179.80 2a9s h THR 75 N 0.34 1.64 0.00 0.22 1.35 -1.44 -1.75 112.91 113.27 2a9s h THR 75 Ca -0.07 -3.09 -0.03 0.00 -0.55 0.00 0.00 66.41 62.67 2a9s h THR 75 Cb 1.39 2.67 -0.00 0.00 -1.73 0.00 0.00 68.15 70.48 2a9s h THR 75 CO 0.15 0.88 -0.14 0.74 -0.25 0.00 0.00 175.52 176.90 2a9s h THR 76 N 0.00 1.57 0.00 6.82 2.02 -1.50 -3.40 112.91 118.41 2a9s h THR 76 Ca -0.01 -2.23 -0.04 0.00 0.77 0.00 0.00 66.41 64.91 2a9s h THR 76 Cb 1.60 3.02 -0.01 0.00 -1.74 0.00 0.00 68.15 71.02 2a9s h THR 76 CO 0.12 0.53 -2.00 0.49 0.37 0.00 0.00 175.52 175.03 2a9s n PHE 77 N -4.60 0.04 0.00 3.16 3.72 0.27 -5.10 117.46 114.95 2a9s n PHE 77 Ca -0.12 0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 2a9s n PHE 77 Cb 0.47 -0.57 0.00 0.00 -0.94 0.00 0.00 39.48 38.44 2a9s n PHE 77 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2a9s n GLY 78 N 1.30 0.78 0.29 1.37 0.00 -0.66 -4.56 105.19 103.72 2a9s n GLY 78 Ca -0.07 -1.81 -0.05 0.00 0.00 0.00 0.00 46.02 44.09 2a9s n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a9s h ALA 79 N 0.00 1.05 -2.27 4.61 0.00 -1.89 -3.36 119.26 117.41 2a9s h ALA 79 Ca 0.00 -0.28 -0.73 0.00 0.00 0.00 0.00 54.91 53.90 2a9s h ALA 79 Cb 0.00 -0.20 -0.21 0.00 0.00 0.00 0.00 17.79 17.38 2a9s h ALA 79 CO 0.00 0.59 0.35 0.08 0.00 0.00 0.00 179.25 180.27 2a9s s VAL 80 N -4.96 5.10 0.08 0.00 1.01 -1.26 -4.71 120.40 115.66 2a9s s VAL 80 Ca -0.10 -1.77 -0.26 0.00 0.00 0.00 0.00 61.98 59.85 2a9s s VAL 80 Cb 0.14 -4.58 0.08 0.00 0.00 0.00 0.00 36.38 32.02 2a9s s VAL 80 CO 0.82 -1.22 0.70 -0.94 0.00 0.00 0.00 175.10 174.46 2a9s s SER 81 N 3.07 -0.52 0.21 3.32 1.04 -1.26 -5.03 113.70 114.53 2a9s s SER 81 Ca 0.21 0.08 -0.10 0.00 0.48 0.00 0.00 55.95 56.63 2a9s s SER 81 Cb -0.12 0.53 0.24 0.00 0.10 0.00 0.00 66.02 66.77 2a9s s SER 81 CO -0.05 -0.82 1.79 -0.09 0.98 0.00 0.00 173.24 175.05 2a9s h ARG 82 N 2.11 0.59 -0.44 4.02 2.43 -1.93 -1.94 114.38 119.23 2a9s h ARG 82 Ca -0.30 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.83 2a9s h ARG 82 Cb 1.27 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 2a9s h ARG 82 CO 0.36 0.39 0.24 1.96 -1.51 0.00 0.00 179.97 181.41 2a9s h GLN 83 N 0.61 0.61 -0.63 0.20 7.50 -1.95 -0.69 115.11 120.75 2a9s h GLN 83 Ca 0.30 -0.07 -0.04 0.00 0.50 0.00 0.00 58.65 59.33 2a9s h GLN 83 Cb 0.23 -0.12 -0.03 0.00 0.05 0.00 0.00 27.48 27.61 2a9s h GLN 83 CO -0.21 0.49 0.23 1.15 -1.50 0.00 0.00 178.83 178.99 2a9s h THR 84 N 0.57 1.24 -0.18 -0.54 2.02 -1.77 -1.96 112.91 112.29 2a9s h THR 84 Ca 0.15 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.55 2a9s h THR 84 Cb 0.06 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 2a9s h THR 84 CO -0.02 0.30 0.11 0.00 0.37 0.00 0.00 175.52 176.28 2a9s h ALA 85 N 1.09 0.22 -0.53 6.16 0.00 -0.89 -0.23 119.26 125.08 2a9s h ALA 85 Ca 0.21 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2a9s h ALA 85 Cb 0.24 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2a9s h ALA 85 CO -0.01 -0.30 0.28 -0.07 0.00 0.00 0.00 179.25 179.14 2a9s h LEU 86 N 0.23 0.41 -0.57 0.00 3.38 -1.06 -1.20 115.31 116.51 2a9s h LEU 86 Ca 0.07 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 2a9s h LEU 86 Cb -0.02 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2a9s h LEU 86 CO -0.02 0.28 -0.09 1.56 0.09 0.00 0.00 178.44 180.26 2a9s h GLN 87 N 0.54 1.04 -0.54 1.13 4.20 -0.95 -1.71 115.11 118.82 2a9s h GLN 87 Ca 0.23 -0.38 0.05 0.00 0.06 0.00 0.00 58.65 58.61 2a9s h GLN 87 Cb 0.12 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.78 2a9s h GLN 87 CO -0.15 1.07 0.27 0.52 -0.67 0.00 0.00 178.83 179.88 2a9s h MET 88 N 0.93 0.50 -0.39 1.46 2.86 -0.86 0.87 114.93 120.29 2a9s h MET 88 Ca 0.15 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.71 2a9s h MET 88 Cb 0.66 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 2a9s h MET 88 CO 0.05 0.33 0.06 0.00 1.06 0.00 0.00 176.91 178.40 2a9s h ALA 89 N 1.30 0.52 -0.07 6.32 0.00 -0.95 0.92 119.26 127.30 2a9s h ALA 89 Ca 0.24 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2a9s h ALA 89 Cb 0.17 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2a9s h ALA 89 CO -0.18 0.24 0.04 1.25 0.00 0.00 0.00 179.25 180.60 2a9s h HIS 90 N 0.50 0.09 -0.64 0.00 6.17 -1.15 -1.72 115.15 118.40 2a9s h HIS 90 Ca 0.12 -0.00 0.05 0.00 0.71 0.00 0.00 60.37 61.25 2a9s h HIS 90 Cb 0.38 -0.03 -0.05 0.00 2.52 0.00 0.00 27.41 30.23 2a9s h HIS 90 CO 0.03 0.14 0.36 0.78 0.71 0.00 0.00 177.93 179.95 2a9s h GLY 91 N 0.02 0.93 2.00 5.26 0.00 -0.60 -1.36 103.07 109.32 2a9s h GLY 91 Ca 0.02 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 47.02 2a9s h GLY 91 CO -0.00 0.16 -0.38 0.00 0.00 0.00 0.00 176.54 176.32 2a9s h ALA 92 N 1.33 1.22 0.07 3.60 0.00 -0.64 -0.75 119.26 124.08 2a9s h ALA 92 Ca 0.28 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2a9s h ALA 92 Cb 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2a9s h ALA 92 CO -0.17 0.47 -0.03 1.25 0.00 0.00 0.00 179.25 180.77 2a9s h LEU 93 N 0.00 -0.08 -0.69 0.00 5.85 -1.01 -3.29 115.31 116.09 2a9s h LEU 93 Ca -0.00 -0.53 -0.09 0.00 0.84 0.00 0.00 57.88 58.10 2a9s h LEU 93 Cb 0.74 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 2a9s h LEU 93 CO 0.05 0.61 0.06 0.22 -0.34 0.00 0.00 178.44 179.04 2a9s h TYR 94 N -0.88 1.15 -0.30 1.25 3.20 -1.21 -2.83 116.97 117.36 2a9s h TYR 94 Ca -0.01 -0.17 -0.15 0.00 3.14 0.00 0.00 58.73 61.53 2a9s h TYR 94 Cb 0.61 -0.31 -0.09 0.00 1.54 0.00 0.00 36.73 38.48 2a9s h TYR 94 CO 0.14 0.99 0.19 0.54 -1.64 0.00 0.00 178.16 178.38 2a9s n ARG 95 N -4.20 1.40 -4.07 1.82 1.74 -0.29 -4.83 116.66 108.23 2a9s n ARG 95 Ca 0.04 -0.91 -0.14 0.00 -0.77 0.00 0.00 57.85 56.07 2a9s n ARG 95 Cb 0.31 -1.36 -0.03 0.00 -1.02 0.00 0.00 32.46 30.36 2a9s n ARG 95 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2a9s s SER 96 N 0.29 0.88 -0.12 0.55 1.04 -1.07 -4.98 113.70 110.29 2a9s s SER 96 Ca 0.17 -1.47 0.17 0.00 0.48 0.00 0.00 55.95 55.30 2a9s s SER 96 Cb 0.14 0.69 0.68 0.00 0.10 0.00 0.00 66.02 67.63 2a9s s SER 96 CO 0.03 -1.34 1.59 0.54 0.98 0.00 0.00 173.24 175.04 2a9s n ARG 97 N -0.57 3.71 -2.20 4.02 1.74 -1.26 -4.96 116.66 117.13 2a9s n ARG 97 Ca 0.00 -2.85 -0.32 0.00 -0.77 0.00 0.00 57.85 53.91 2a9s n ARG 97 Cb 0.61 -1.88 -0.01 0.00 -1.02 0.00 0.00 32.46 30.16 2a9s n ARG 97 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2a9s s ALA 98 N -1.99 2.98 0.11 7.54 0.00 -1.26 -4.87 121.76 124.27 2a9s s ALA 98 Ca 0.48 0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.64 2a9s s ALA 98 Cb 0.32 -3.14 -0.19 0.00 0.00 0.00 0.00 23.12 20.11 2a9s s ALA 98 CO 0.21 -0.48 1.24 -0.91 0.00 0.00 0.00 175.76 175.83 2a9s h ASN 99 N 0.55 0.24 -4.38 0.00 4.21 -1.56 -3.47 115.58 111.16 2a9s h ASN 99 Ca -0.46 -0.24 -0.42 0.00 1.21 0.00 0.00 56.30 56.39 2a9s h ASN 99 Cb 1.19 -0.08 -0.24 0.00 -1.12 0.00 0.00 38.32 38.08 2a9s h ASN 99 CO 0.60 1.15 -0.79 -0.36 -1.29 0.00 0.00 177.43 176.75 2a9s s PHE 100 N -2.80 1.19 0.04 1.19 0.08 -0.93 -2.59 117.98 114.15 2a9s s PHE 100 Ca -0.02 -0.39 0.06 0.00 0.12 0.00 0.00 56.93 56.70 2a9s s PHE 100 Cb 0.09 -0.69 -0.02 0.00 -0.57 0.00 0.00 43.02 41.82 2a9s s PHE 100 CO 0.85 0.04 -0.17 0.00 -0.10 0.00 0.00 175.22 175.83 2a9s s ALA 101 N -0.99 1.46 -0.04 5.36 0.00 -0.51 -1.33 121.76 125.71 2a9s s ALA 101 Ca -0.00 -0.95 0.06 0.00 0.00 0.00 0.00 51.96 51.08 2a9s s ALA 101 Cb -0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 2a9s s ALA 101 CO 0.01 0.30 -0.24 0.54 0.00 0.00 0.00 175.76 176.38 2a9s s VAL 102 N -0.84 1.91 -0.02 0.00 0.11 -0.70 -1.12 120.40 119.74 2a9s s VAL 102 Ca 0.04 -1.00 0.04 0.00 -2.93 0.00 0.00 61.98 58.13 2a9s s VAL 102 Cb -0.08 -1.61 -0.01 0.00 -1.53 0.00 0.00 36.38 33.15 2a9s s VAL 102 CO 0.02 0.54 -0.14 0.00 -3.33 0.00 0.00 175.10 172.18 2a9s s ALA 103 N -0.27 1.22 -0.01 1.54 0.00 0.61 -0.80 121.76 124.05 2a9s s ALA 103 Ca 0.01 -0.60 0.02 0.00 0.00 0.00 0.00 51.96 51.38 2a9s s ALA 103 Cb -0.12 -0.34 -0.00 0.00 0.00 0.00 0.00 23.12 22.66 2a9s s ALA 103 CO 0.02 0.28 -0.07 0.14 0.00 0.00 0.00 175.76 176.13 2a9s s VAL 104 N -0.23 0.58 -0.07 0.00 -7.23 -0.73 -1.20 120.40 111.53 2a9s s VAL 104 Ca 0.03 -0.29 -0.03 0.00 -1.81 0.00 0.00 61.98 59.89 2a9s s VAL 104 Cb -0.07 -0.51 0.04 0.00 0.56 0.00 0.00 36.38 36.40 2a9s s VAL 104 CO -0.00 0.18 0.14 0.28 -0.31 0.00 0.00 175.10 175.39 2a9s s THR 105 N 0.01 -0.18 0.08 5.32 -1.32 -0.46 -1.75 115.64 117.35 2a9s s THR 105 Ca 0.00 0.31 -0.04 0.00 -1.21 0.00 0.00 61.69 60.75 2a9s s THR 105 Cb -0.05 -0.26 0.01 0.00 -1.51 0.00 0.00 72.50 70.70 2a9s s THR 105 CO -0.00 0.13 0.20 0.61 -2.21 0.00 0.00 174.62 173.34 2a9s n GLY 106 N 4.96 1.62 3.06 6.08 0.00 -1.26 -0.49 105.19 119.15 2a9s n GLY 106 Ca -0.12 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.53 2a9s n GLY 106 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a9s s ILE 107 N -2.71 2.63 -0.54 -0.61 1.01 -0.53 -4.56 121.20 115.88 2a9s s ILE 107 Ca 0.04 -2.17 0.24 0.00 0.00 0.00 0.00 60.65 58.76 2a9s s ILE 107 Cb -0.01 -2.85 0.31 0.00 0.01 0.00 0.00 42.46 39.92 2a9s s ILE 107 CO 0.02 -0.57 1.65 0.00 0.00 0.00 0.00 174.94 176.04 2a9s h ALA 108 N 7.78 0.98 -1.39 9.38 0.00 -1.88 0.14 119.26 134.27 2a9s h ALA 108 Ca -0.09 0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.93 2a9s h ALA 108 Cb 1.03 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2a9s h ALA 108 CO 0.57 0.00 -0.14 0.41 0.00 0.00 0.00 179.25 180.09 2a9s n GLY 109 N 1.17 -1.78 0.21 0.00 0.00 -1.26 -3.76 105.19 99.78 2a9s n GLY 109 Ca 0.04 -1.27 0.08 0.00 0.00 0.00 0.00 46.02 44.87 2a9s n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2a9s h PRO 110 N 0.00 0.00 -6.65 1.61 0.13 -1.96 -3.42 132.00 121.71 2a9s h PRO 110 Ca 0.01 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.67 2a9s h PRO 110 Cb 0.35 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.51 2a9s h PRO 110 CO 0.00 0.29 -0.11 0.20 -0.23 0.00 0.00 178.00 178.15 2a9s s GLY 111 N -4.30 1.44 0.00 1.56 0.00 -1.26 -4.65 107.32 100.11 2a9s s GLY 111 Ca -0.01 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.81 2a9s s GLY 111 CO 0.66 -0.78 0.00 0.61 0.00 0.00 0.00 173.10 173.59 2a9s n GLY 112 N -1.97 0.65 3.80 0.20 0.00 -1.26 -4.85 105.19 101.76 2a9s n GLY 112 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2a9s n GLY 112 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a9s s GLY 113 N -0.76 2.64 0.22 -0.02 0.00 -1.26 -4.85 107.32 103.29 2a9s s GLY 113 Ca 0.00 0.47 -0.03 0.00 0.00 0.00 0.00 44.72 45.16 2a9s s GLY 113 CO 0.00 0.85 0.21 -1.35 0.00 0.00 0.00 173.10 172.81 2a9s s SER 114 N -1.84 0.22 0.21 1.64 1.04 -0.22 -4.88 113.70 109.89 2a9s s SER 114 Ca 0.55 -1.33 -0.09 0.00 0.48 0.00 0.00 55.95 55.56 2a9s s SER 114 Cb -0.15 0.44 0.26 0.00 0.10 0.00 0.00 66.02 66.67 2a9s s SER 114 CO 0.20 -0.92 1.80 0.00 0.98 0.00 0.00 173.24 175.30 2a9s h ALA 115 N 2.51 0.91 -0.02 5.32 0.00 -1.99 -1.30 119.26 124.69 2a9s h ALA 115 Ca -0.33 0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.37 2a9s h ALA 115 Cb 1.25 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.94 2a9s h ALA 115 CO 0.48 0.03 -0.93 0.93 0.00 0.00 0.00 179.25 179.76 2a9s h GLU 116 N 0.67 0.51 -2.72 0.00 3.07 -2.02 -3.38 114.58 110.71 2a9s h GLU 116 Ca 0.31 -0.53 -0.61 0.00 -0.50 0.00 0.00 59.36 58.04 2a9s h GLU 116 Cb 0.22 0.14 -0.40 0.00 -0.84 0.00 0.00 28.75 27.87 2a9s h GLU 116 CO -0.20 1.16 -0.76 1.63 -1.40 0.00 0.00 179.01 179.44 2a9s n LYS 117 N -3.80 1.10 -1.72 2.33 5.02 -0.92 -5.12 118.16 115.06 2a9s n LYS 117 Ca -0.08 -3.89 -0.31 0.00 -2.02 0.00 0.00 58.31 52.01 2a9s n LYS 117 Cb 0.83 -1.99 0.03 0.00 -0.02 0.00 0.00 35.03 33.88 2a9s n LYS 117 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2a9s s PRO 118 N -0.81 3.17 0.20 1.97 0.04 -0.54 -1.05 135.00 137.98 2a9s s PRO 118 Ca 0.29 0.92 -0.32 0.00 0.04 0.00 0.00 61.00 61.94 2a9s s PRO 118 Cb 0.00 -2.02 -0.15 0.00 0.04 0.00 0.00 34.50 32.37 2a9s s PRO 118 CO -0.18 -0.91 1.18 0.28 0.04 0.00 0.00 177.00 177.41 2a9s n VAL 119 N -2.88 1.06 -0.01 -0.36 0.31 -1.26 -1.93 118.33 113.24 2a9s n VAL 119 Ca 0.07 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 2a9s n VAL 119 Cb 0.54 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 2a9s n VAL 119 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2a9s n GLY 120 N 1.93 0.47 3.69 2.92 0.00 0.49 -4.06 105.19 110.64 2a9s n GLY 120 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2a9s n GLY 120 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2a9s s LEU 121 N 0.00 4.28 -0.02 0.99 2.96 -0.81 -0.64 118.68 125.44 2a9s s LEU 121 Ca 0.00 1.74 0.00 0.00 -0.22 0.00 0.00 54.13 55.65 2a9s s LEU 121 Cb 0.00 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.15 2a9s s LEU 121 CO 0.00 -0.52 0.02 -0.69 -1.32 0.00 0.00 176.35 173.84 2a9s s VAL 122 N 2.03 -0.02 -0.20 1.68 1.01 0.05 -1.46 120.40 123.50 2a9s s VAL 122 Ca 0.54 0.14 -0.08 0.00 0.00 0.00 0.00 61.98 62.58 2a9s s VAL 122 Cb -0.23 -0.08 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 2a9s s VAL 122 CO 0.21 0.07 0.07 -1.00 0.00 0.00 0.00 175.10 174.46 2a9s s HIS 123 N 0.76 3.23 0.00 5.22 3.76 0.35 -0.61 115.29 128.01 2a9s s HIS 123 Ca -0.06 0.02 0.07 0.00 -0.15 0.00 0.00 55.06 54.94 2a9s s HIS 123 Cb -0.09 -2.12 -0.02 0.00 1.11 0.00 0.00 32.58 31.45 2a9s s HIS 123 CO -0.02 0.07 -0.23 -0.51 -0.85 0.00 0.00 174.74 173.21 2a9s s LEU 124 N 0.62 2.08 -0.03 0.89 1.02 -0.46 -1.35 118.68 121.45 2a9s s LEU 124 Ca 0.04 -0.45 -0.03 0.00 0.02 0.00 0.00 54.13 53.71 2a9s s LEU 124 Cb -0.13 -1.14 0.01 0.00 0.02 0.00 0.00 46.19 44.96 2a9s s LEU 124 CO 0.01 0.25 0.08 0.00 0.02 0.00 0.00 176.35 176.71 2a9s s ALA 125 N -0.62 -0.18 -0.01 4.21 0.00 -0.34 -1.25 121.76 123.57 2a9s s ALA 125 Ca 0.09 0.25 0.07 0.00 0.00 0.00 0.00 51.96 52.37 2a9s s ALA 125 Cb -0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 2a9s s ALA 125 CO 0.00 -0.05 -0.22 0.95 0.00 0.00 0.00 175.76 176.44 2a9s s THR 126 N 0.16 1.76 0.04 0.00 -4.23 0.21 -0.28 115.64 113.30 2a9s s THR 126 Ca -0.01 -0.99 0.04 0.00 -1.18 0.00 0.00 61.69 59.56 2a9s s THR 126 Cb -0.02 -1.47 -0.02 0.00 1.34 0.00 0.00 72.50 72.33 2a9s s THR 126 CO -0.00 0.47 -0.13 -0.75 -0.54 0.00 0.00 174.62 173.66 2a9s s LYS 127 N -0.60 0.87 0.23 3.99 2.20 -0.28 -0.99 119.74 125.16 2a9s s LYS 127 Ca 0.09 -0.74 0.10 0.00 -0.36 0.00 0.00 55.97 55.06 2a9s s LYS 127 Cb -0.09 -0.86 -0.04 0.00 -1.51 0.00 0.00 37.83 35.33 2a9s s LYS 127 CO -0.01 0.21 -0.08 0.00 -0.36 0.00 0.00 175.35 175.12 2a9s s ALA 128 N -0.87 3.00 0.54 3.13 0.00 -0.41 -1.42 121.76 125.72 2a9s s ALA 128 Ca 0.01 -1.62 0.23 0.00 0.00 0.00 0.00 51.96 50.58 2a9s s ALA 128 Cb -0.08 -0.67 1.39 0.00 0.00 0.00 0.00 23.12 23.77 2a9s s ALA 128 CO 0.01 0.35 2.05 0.00 0.00 0.00 0.00 175.76 178.17 2a9s h ARG 129 N 2.37 0.00 0.00 0.00 2.47 -1.83 -1.05 114.38 116.34 2a9s h ARG 129 Ca -0.45 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 2a9s h ARG 129 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 2a9s h ARG 129 CO 0.58 0.00 0.00 0.27 0.56 0.00 0.00 179.97 181.38 2a9s n ASN 130 N -4.35 0.00 0.00 7.04 0.23 -1.26 -4.88 115.26 112.04 2a9s n ASN 130 Ca 0.05 -0.88 0.00 0.00 -0.53 0.00 0.00 54.58 53.23 2a9s n ASN 130 Cb 0.44 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.14 2a9s n ASN 130 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2a9s n GLY 131 N 0.54 2.10 3.69 4.83 0.00 -0.40 -5.04 105.19 110.92 2a9s n GLY 131 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 2a9s n GLY 131 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2a9s n ASN 132 N 0.00 3.79 -4.21 1.61 5.15 -1.25 -4.78 115.26 115.57 2a9s n ASN 132 Ca 0.00 1.02 -0.28 0.00 -0.60 0.00 0.00 54.58 54.72 2a9s n ASN 132 Cb 0.00 -1.51 -0.16 0.00 -0.53 0.00 0.00 39.78 37.58 2a9s n ASN 132 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2a9s s VAL 133 N 2.15 1.66 -0.04 3.44 1.01 -1.26 -1.28 120.40 126.08 2a9s s VAL 133 Ca 0.81 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.98 2a9s s VAL 133 Cb -0.55 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 2a9s s VAL 133 CO 0.38 0.47 -0.25 -0.76 0.00 0.00 0.00 175.10 174.93 2a9s s LEU 134 N -0.33 2.07 -0.01 3.92 1.43 -0.17 -4.98 118.68 120.61 2a9s s LEU 134 Ca 0.04 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 2a9s s LEU 134 Cb -0.10 -1.36 -0.00 0.00 0.03 0.00 0.00 46.19 44.76 2a9s s LEU 134 CO 0.00 0.28 -0.09 -2.28 0.23 0.00 0.00 176.35 174.49 2a9s s HIS 135 N -0.39 0.87 -0.03 0.29 5.65 -1.26 -0.62 115.29 119.80 2a9s s HIS 135 Ca 0.03 -0.18 0.02 0.00 0.25 0.00 0.00 55.06 55.19 2a9s s HIS 135 Cb -0.12 -0.58 0.00 0.00 -1.18 0.00 0.00 32.58 30.71 2a9s s HIS 135 CO 0.01 -0.04 -0.09 -1.01 -0.65 0.00 0.00 174.74 172.97 2a9s s HIS 136 N -0.11 0.99 -0.26 3.88 3.76 -0.38 -5.01 115.29 118.16 2a9s s HIS 136 Ca 0.02 -0.26 -0.12 0.00 -0.15 0.00 0.00 55.06 54.55 2a9s s HIS 136 Cb -0.05 -0.71 -0.05 0.00 1.11 0.00 0.00 32.58 32.88 2a9s s HIS 136 CO -0.00 -0.12 0.25 -2.00 -0.85 0.00 0.00 174.74 172.02 2a9s s GLU 137 N 0.26 4.02 0.07 1.40 2.12 -1.26 -1.36 118.70 123.95 2a9s s GLU 137 Ca -0.04 -0.16 0.05 0.00 0.36 0.00 0.00 54.97 55.18 2a9s s GLU 137 Cb -0.09 -3.62 -0.04 0.00 0.26 0.00 0.00 34.13 30.64 2a9s s GLU 137 CO 0.01 -0.13 -0.04 -1.64 -0.54 0.00 0.00 175.26 172.92 2a9s s MET 138 N 1.62 2.47 -0.43 4.30 -1.94 0.22 -4.98 119.30 120.55 2a9s s MET 138 Ca 0.11 -0.84 0.02 0.00 -1.71 0.00 0.00 55.69 53.27 2a9s s MET 138 Cb -0.15 -2.49 0.13 0.00 2.01 0.00 0.00 34.83 34.34 2a9s s MET 138 CO 0.09 0.55 0.23 1.03 -0.01 0.00 0.00 175.02 176.91 2a9s s ARG 139 N -2.01 1.22 0.18 2.03 0.52 -1.26 -0.77 118.95 118.86 2a9s s ARG 139 Ca 0.22 -1.93 0.27 0.00 -0.52 0.00 0.00 55.73 53.77 2a9s s ARG 139 Cb -0.11 -2.25 0.88 0.00 0.52 0.00 0.00 34.95 33.98 2a9s s ARG 139 CO 0.14 -1.16 1.80 0.66 0.02 0.00 0.00 175.30 176.76 2a9s n TYR 140 N 3.62 0.79 0.00 -0.53 4.01 0.19 -4.95 117.16 120.29 2a9s n TYR 140 Ca 0.08 0.23 0.00 0.00 -0.16 0.00 0.00 57.90 58.06 2a9s n TYR 140 Cb 0.35 -0.88 0.00 0.00 -0.31 0.00 0.00 39.34 38.50 2a9s n TYR 140 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2a9s n GLY 141 N 1.32 -0.32 2.80 2.72 0.00 -1.26 -4.62 105.19 105.83 2a9s n GLY 141 Ca 0.06 -1.80 -0.42 0.00 0.00 0.00 0.00 46.02 43.85 2a9s n GLY 141 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2a9s n ASP 142 N -0.82 4.85 -0.69 1.61 2.03 -1.26 -3.98 116.55 118.30 2a9s n ASP 142 Ca 0.00 -3.02 0.08 0.00 0.52 0.00 0.00 54.79 52.37 2a9s n ASP 142 Cb 0.00 -1.53 0.09 0.00 -0.72 0.00 0.00 41.12 38.96 2a9s n ASP 142 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2a9s n ILE 143 N 3.84 0.15 0.00 5.18 -5.35 -1.26 -5.07 119.36 116.85 2a9s n ILE 143 Ca 0.45 -0.58 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 2a9s n ILE 143 Cb 0.36 1.21 0.00 0.00 -1.74 0.00 0.00 39.64 39.47 2a9s n ILE 143 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2a9s n GLY 144 N 0.91 3.34 0.19 3.28 0.00 -1.26 -4.71 105.19 106.94 2a9s n GLY 144 Ca 0.10 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.24 2a9s n GLY 144 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2a9s h ARG 145 N 0.00 -0.38 -0.68 1.61 2.43 -1.82 -0.23 114.38 115.30 2a9s h ARG 145 Ca 0.00 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 2a9s h ARG 145 Cb 0.00 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 2a9s h ARG 145 CO 0.00 -0.11 0.39 1.15 -1.51 0.00 0.00 179.97 179.90 2a9s h THR 146 N -0.64 1.20 -0.52 0.20 2.02 -1.93 -1.71 112.91 111.53 2a9s h THR 146 Ca -0.04 -0.48 0.07 0.00 0.77 0.00 0.00 66.41 66.72 2a9s h THR 146 Cb 0.46 0.28 -0.06 0.00 -1.74 0.00 0.00 68.15 67.09 2a9s h THR 146 CO 0.07 0.22 0.21 -0.33 0.37 0.00 0.00 175.52 176.05 2a9s h GLU 147 N 0.93 0.39 -0.43 6.66 3.07 -1.80 0.73 114.58 124.13 2a9s h GLU 147 Ca 0.24 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 59.01 2a9s h GLU 147 Cb 0.00 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 2a9s h GLU 147 CO -0.04 0.26 -0.01 0.82 -1.40 0.00 0.00 179.01 178.63 2a9s h ILE 148 N 0.40 1.26 -0.48 3.13 2.04 -0.88 -0.64 117.51 122.34 2a9s h ILE 148 Ca 0.25 -1.05 0.01 0.00 1.00 0.00 0.00 64.86 65.06 2a9s h ILE 148 Cb 0.24 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 2a9s h ILE 148 CO -0.23 0.36 0.31 0.03 0.00 0.00 0.00 178.15 178.62 2a9s h ARG 149 N 0.60 0.61 -0.32 2.37 3.08 -0.98 0.28 114.38 120.03 2a9s h ARG 149 Ca 0.12 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 59.97 2a9s h ARG 149 Cb 0.50 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2a9s h ARG 149 CO 0.02 0.41 -0.44 -0.07 -1.07 0.00 0.00 179.97 178.82 2a9s h LEU 150 N 0.63 0.89 -0.99 3.04 3.38 -0.78 -0.90 115.31 120.59 2a9s h LEU 150 Ca 0.18 -0.43 0.03 0.00 0.09 0.00 0.00 57.88 57.76 2a9s h LEU 150 Cb -0.05 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.39 2a9s h LEU 150 CO -0.05 1.20 0.65 0.00 0.09 0.00 0.00 178.44 180.33 2a9s h ALA 151 N 0.83 1.31 -0.40 1.53 0.00 -0.89 -1.09 119.26 120.54 2a9s h ALA 151 Ca 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2a9s h ALA 151 Cb 1.02 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2a9s h ALA 151 CO 0.10 0.55 0.08 1.15 0.00 0.00 0.00 179.25 181.13 2a9s h THR 152 N 1.27 1.24 -0.25 0.00 2.02 -0.60 -1.88 112.91 114.70 2a9s h THR 152 Ca 0.39 -0.84 0.04 0.00 0.77 0.00 0.00 66.41 66.77 2a9s h THR 152 Cb -0.02 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 2a9s h THR 152 CO -0.12 0.29 -0.00 0.58 0.37 0.00 0.00 175.52 176.64 2a9s h VAL 153 N 0.52 0.82 -0.00 3.16 2.07 -0.66 0.56 116.25 122.71 2a9s h VAL 153 Ca 0.12 -0.02 0.03 0.00 0.82 0.00 0.00 66.70 67.65 2a9s h VAL 153 Cb 0.35 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 2a9s h VAL 153 CO 0.01 0.01 -0.32 -0.09 0.02 0.00 0.00 177.57 177.20 2a9s h ARG 154 N 0.07 -0.45 -0.86 1.57 2.43 -1.05 -1.07 114.38 115.03 2a9s h ARG 154 Ca 0.12 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 2a9s h ARG 154 Cb 0.16 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 2a9s h ARG 154 CO -0.20 -0.30 0.50 1.15 -1.51 0.00 0.00 179.97 179.61 2a9s h THR 155 N -0.47 1.24 -0.56 0.20 2.02 -1.01 -0.76 112.91 113.58 2a9s h THR 155 Ca 0.06 -0.56 0.07 0.00 0.77 0.00 0.00 66.41 66.75 2a9s h THR 155 Cb 0.55 0.06 -0.06 0.00 -1.74 0.00 0.00 68.15 66.97 2a9s h THR 155 CO -0.26 0.26 0.25 0.00 0.37 0.00 0.00 175.52 176.13 2a9s h ALA 156 N 1.27 0.72 -0.40 6.16 0.00 -0.50 -0.78 119.26 125.73 2a9s h ALA 156 Ca 0.31 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.15 2a9s h ALA 156 Cb -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2a9s h ALA 156 CO -0.05 -0.13 -0.21 -0.07 0.00 0.00 0.00 179.25 178.79 2a9s h LEU 157 N 0.47 0.88 -0.68 0.00 3.38 -0.62 -1.74 115.31 117.00 2a9s h LEU 157 Ca 0.26 -0.41 0.10 0.00 0.09 0.00 0.00 57.88 57.92 2a9s h LEU 157 Cb 0.24 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.68 2a9s h LEU 157 CO -0.22 1.10 0.31 -0.33 0.09 0.00 0.00 178.44 179.38 2a9s h GLU 158 N 0.66 0.51 -0.52 1.13 5.08 -0.81 -2.24 114.58 118.39 2a9s h GLU 158 Ca 0.09 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.31 2a9s h GLU 158 Cb 0.77 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2a9s h GLU 158 CO 0.06 0.33 -0.08 0.52 -1.00 0.00 0.00 179.01 178.84 2a9s h MET 159 N 0.52 0.97 -0.48 2.33 2.86 -0.90 -1.22 114.93 119.01 2a9s h MET 159 Ca 0.34 -0.35 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 2a9s h MET 159 Cb 0.39 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.94 2a9s h MET 159 CO -0.29 1.02 0.21 -0.07 1.06 0.00 0.00 176.91 178.84 2a9s h LEU 160 N 0.84 0.27 -0.36 1.22 3.38 -1.02 0.16 115.31 119.80 2a9s h LEU 160 Ca 0.14 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.17 2a9s h LEU 160 Cb 0.64 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 2a9s h LEU 160 CO 0.04 0.19 0.18 0.40 0.09 0.00 0.00 178.44 179.34 2a9s h ILE 161 N 0.42 0.98 -0.65 1.22 2.04 -1.20 -1.45 117.51 118.87 2a9s h ILE 161 Ca 0.22 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.92 2a9s h ILE 161 Cb 0.18 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 2a9s h ILE 161 CO -0.19 0.07 0.27 0.00 0.00 0.00 0.00 178.15 178.30 2a9s h ALA 162 N 1.19 0.84 -0.83 1.87 0.00 -0.75 -1.42 119.26 120.16 2a9s h ALA 162 Ca 0.15 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2a9s h ALA 162 Cb 0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2a9s h ALA 162 CO -0.10 0.45 0.38 1.25 0.00 0.00 0.00 179.25 181.23 2a9s h LEU 163 N 0.91 1.11 -0.46 0.00 5.85 -0.50 -1.90 115.31 120.32 2a9s h LEU 163 Ca 0.22 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 2a9s h LEU 163 Cb 0.19 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 2a9s h LEU 163 CO -0.02 0.95 0.11 -1.13 -0.34 0.00 0.00 178.44 178.01 2a9s h ASN 164 N 1.19 0.69 -0.79 1.25 -1.24 -0.91 -3.03 115.58 112.74 2a9s h ASN 164 Ca 0.28 -0.23 0.12 0.00 0.71 0.00 0.00 56.30 57.18 2a9s h ASN 164 Cb 0.15 -0.18 -0.08 0.00 0.73 0.00 0.00 38.32 38.93 2a9s h ASN 164 CO -0.03 0.74 0.40 1.56 -1.29 0.00 0.00 177.43 178.81 2a9s h GLN 165 N 0.61 0.61 0.00 6.67 4.20 -0.95 -0.82 115.11 125.43 2a9s h GLN 165 Ca 0.14 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2a9s h GLN 165 Cb 0.32 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2a9s h GLN 165 CO 0.00 0.40 0.00 0.00 -0.67 0.00 0.00 178.83 178.56 2a9s n ALA 166 N -2.42 2.04 -0.51 3.87 0.00 -0.74 -5.11 120.51 117.63 2a9s n ALA 166 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2a9s n ALA 166 Cb 0.35 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2a9s n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91