#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mhy s LYS 2 N 0.00 0.36 -0.35 0.03 -0.14 -0.03 -1.03 119.74 118.58 3mhy s LYS 2 Ca 0.00 -0.12 -0.13 0.00 -1.36 0.00 0.00 55.97 54.37 3mhy s LYS 2 Cb 0.00 -0.38 -0.00 0.00 -1.68 0.00 0.00 37.83 35.77 3mhy s LYS 2 CO 0.00 0.05 0.24 -1.17 -0.76 0.00 0.00 175.35 173.71 3mhy s LEU 3 N 0.11 4.61 -0.27 3.17 2.96 0.12 -1.01 118.68 128.37 3mhy s LEU 3 Ca -0.01 -0.61 -0.19 0.00 -0.22 0.00 0.00 54.13 53.11 3mhy s LEU 3 Cb -0.04 -2.11 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 3mhy s LEU 3 CO -0.00 -0.29 0.55 -0.69 -1.32 0.00 0.00 176.35 174.59 3mhy s VAL 4 N 1.68 5.04 -0.24 1.68 1.01 0.09 -1.08 120.40 128.58 3mhy s VAL 4 Ca 0.05 0.92 0.01 0.00 0.00 0.00 0.00 61.98 62.96 3mhy s VAL 4 Cb -0.18 -3.87 0.04 0.00 0.00 0.00 0.00 36.38 32.37 3mhy s VAL 4 CO 0.09 0.04 -0.12 -0.32 0.00 0.00 0.00 175.10 174.80 3mhy s MET 5 N 2.38 2.62 -0.09 2.72 1.75 0.46 -0.91 119.30 128.24 3mhy s MET 5 Ca 0.23 -1.10 0.03 0.00 -1.25 0.00 0.00 55.69 53.59 3mhy s MET 5 Cb -0.16 -2.83 -0.02 0.00 2.84 0.00 0.00 34.83 34.66 3mhy s MET 5 CO 0.09 -0.42 -0.16 0.00 -0.65 0.00 0.00 175.02 173.88 3mhy s ALA 6 N 1.22 2.53 -0.29 4.11 0.00 0.43 -0.26 121.76 129.50 3mhy s ALA 6 Ca -0.02 -0.95 -0.06 0.00 0.00 0.00 0.00 51.96 50.92 3mhy s ALA 6 Cb -0.17 -1.01 0.01 0.00 0.00 0.00 0.00 23.12 21.95 3mhy s ALA 6 CO -0.07 0.39 0.06 0.42 0.00 0.00 0.00 175.76 176.56 3mhy s ILE 7 N -0.13 3.84 0.24 0.00 -1.09 -0.10 -0.17 121.20 123.79 3mhy s ILE 7 Ca -0.02 -0.73 0.05 0.00 -2.23 0.00 0.00 60.65 57.71 3mhy s ILE 7 Cb -0.14 -2.98 -0.05 0.00 -1.58 0.00 0.00 42.46 37.71 3mhy s ILE 7 CO 0.04 0.09 -0.03 0.27 -1.23 0.00 0.00 174.94 174.08 3mhy s ILE 8 N 1.48 1.24 0.29 2.92 -4.36 -0.35 -2.28 121.20 120.13 3mhy s ILE 8 Ca 0.02 -2.06 -0.29 0.00 -0.26 0.00 0.00 60.65 58.05 3mhy s ILE 8 Cb -0.17 -2.35 -0.10 0.00 1.25 0.00 0.00 42.46 41.08 3mhy s ILE 8 CO 0.02 -0.34 1.42 -0.54 0.24 0.00 0.00 174.94 175.74 3mhy s LYS 9 N -3.81 4.26 0.33 0.37 1.02 -1.26 -1.25 119.74 119.40 3mhy s LYS 9 Ca 0.28 2.33 0.06 0.00 0.02 0.00 0.00 55.97 58.67 3mhy s LYS 9 Cb 0.05 -3.08 0.73 0.00 -0.52 0.00 0.00 37.83 35.01 3mhy s LYS 9 CO 0.09 -0.39 1.85 -1.35 -0.92 0.00 0.00 175.35 174.63 3mhy h PRO 10 N 4.39 0.77 0.00 -1.68 0.11 -1.89 -1.45 132.00 132.25 3mhy h PRO 10 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3mhy h PRO 10 Cb 1.22 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3mhy h PRO 10 CO 0.73 0.51 0.00 0.27 -0.21 0.00 0.00 178.00 179.30 3mhy h PHE 11 N 0.79 0.00 -0.01 0.65 -5.15 -1.98 -2.29 116.94 108.96 3mhy h PHE 11 Ca 0.48 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.25 3mhy h PHE 11 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.85 3mhy h PHE 11 CO -0.00 0.00 -0.12 1.63 -2.00 0.00 0.00 178.31 177.82 3mhy n LYS 12 N -2.49 0.92 -0.15 6.09 4.76 -0.54 -4.37 118.16 122.37 3mhy n LYS 12 Ca 0.01 -0.40 -0.03 0.00 -2.87 0.00 0.00 58.31 55.02 3mhy n LYS 12 Cb 0.22 -1.49 0.05 0.00 -1.84 0.00 0.00 35.03 31.97 3mhy n LYS 12 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3mhy h LEU 13 N 0.98 0.09 -0.62 -0.35 5.85 -1.52 -1.34 115.31 118.40 3mhy h LEU 13 Ca 0.00 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 3mhy h LEU 13 Cb 0.39 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 3mhy h LEU 13 CO 0.00 0.08 0.09 0.44 -0.34 0.00 0.00 178.44 178.71 3mhy h ASP 14 N 0.28 0.99 -0.28 1.25 3.32 -1.83 0.74 116.42 120.89 3mhy h ASP 14 Ca 0.23 -0.27 -0.14 0.00 0.02 0.00 0.00 57.03 56.87 3mhy h ASP 14 Cb 0.27 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3mhy h ASP 14 CO -0.27 1.01 -0.35 -0.08 -1.72 0.00 0.00 179.24 177.83 3mhy h GLU 15 N 0.94 0.81 -0.33 3.56 4.81 -1.77 -1.08 114.58 121.52 3mhy h GLU 15 Ca 0.19 -0.40 -0.08 0.00 -0.13 0.00 0.00 59.36 58.94 3mhy h GLU 15 Cb 0.45 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 3mhy h GLU 15 CO 0.01 1.03 -0.10 0.28 -0.73 0.00 0.00 179.01 179.50 3mhy h VAL 16 N 0.67 1.28 -0.29 0.32 2.07 -1.07 -1.47 116.25 117.76 3mhy h VAL 16 Ca 0.06 -1.18 0.04 0.00 0.82 0.00 0.00 66.70 66.45 3mhy h VAL 16 Cb 0.91 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 3mhy h VAL 16 CO 0.08 0.38 0.06 -0.09 0.02 0.00 0.00 177.57 178.03 3mhy h ARG 17 N 0.44 0.16 -0.47 1.57 1.12 -0.73 -1.37 114.38 115.09 3mhy h ARG 17 Ca 0.08 -0.01 -0.08 0.00 -1.11 0.00 0.00 59.98 58.86 3mhy h ARG 17 Cb 0.61 -0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.52 3mhy h ARG 17 CO 0.04 0.11 -0.04 1.49 -3.11 0.00 0.00 179.97 178.45 3mhy h GLU 18 N 0.17 0.81 -0.71 0.20 4.81 -1.11 -0.18 114.58 118.56 3mhy h GLU 18 Ca 0.13 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 3mhy h GLU 18 Cb 0.14 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 3mhy h GLU 18 CO -0.17 0.84 0.42 0.00 -0.73 0.00 0.00 179.01 179.37 3mhy h ALA 19 N 1.21 0.91 -0.16 2.92 0.00 -0.86 -0.98 119.26 122.29 3mhy h ALA 19 Ca 0.14 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 3mhy h ALA 19 Cb 0.51 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3mhy h ALA 19 CO 0.03 0.39 -0.71 -0.07 0.00 0.00 0.00 179.25 178.88 3mhy h LEU 20 N 0.97 0.82 -0.66 0.00 3.38 -0.69 -1.66 115.31 117.47 3mhy h LEU 20 Ca 0.26 -0.51 -0.12 0.00 0.09 0.00 0.00 57.88 57.59 3mhy h LEU 20 Cb -0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3mhy h LEU 20 CO -0.05 1.29 -0.22 0.71 0.09 0.00 0.00 178.44 180.26 3mhy h THR 21 N 0.49 1.27 -0.49 0.22 1.35 -0.91 -0.58 112.91 114.27 3mhy h THR 21 Ca -0.03 -1.34 -0.05 0.00 -0.55 0.00 0.00 66.41 64.43 3mhy h THR 21 Cb 1.32 1.19 -0.02 0.00 -1.73 0.00 0.00 68.15 68.91 3mhy h THR 21 CO 0.14 0.45 0.08 0.28 -0.25 0.00 0.00 175.52 176.22 3mhy h SER 22 N 0.71 0.71 0.01 5.36 0.02 -1.12 -1.67 113.55 117.57 3mhy h SER 22 Ca 0.10 -0.14 -0.08 0.00 -0.84 0.00 0.00 61.79 60.83 3mhy h SER 22 Cb 0.74 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 3mhy h SER 22 CO 0.06 0.73 -0.23 0.25 -1.14 0.00 0.00 176.83 176.50 3mhy h LEU 23 N 0.72 0.36 0.00 5.07 5.85 -0.90 -3.47 115.31 122.94 3mhy h LEU 23 Ca 0.16 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3mhy h LEU 23 Cb 0.33 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.26 3mhy h LEU 23 CO 0.00 0.60 0.00 0.61 -0.34 0.00 0.00 178.44 179.32 3mhy n GLY 24 N -0.51 1.80 3.73 3.75 0.00 -0.31 -5.09 105.19 108.56 3mhy n GLY 24 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3mhy n GLY 24 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mhy s ILE 25 N -2.00 2.08 -0.20 -0.61 -4.36 -0.69 -4.93 121.20 110.50 3mhy s ILE 25 Ca 0.00 0.05 0.16 0.00 -0.26 0.00 0.00 60.65 60.60 3mhy s ILE 25 Cb 0.00 -3.02 0.36 0.00 1.25 0.00 0.00 42.46 41.05 3mhy s ILE 25 CO 0.00 -0.01 1.25 0.00 0.24 0.00 0.00 174.94 176.42 3mhy n GLN 26 N -1.86 2.19 -3.64 0.37 3.00 -1.26 -4.79 117.38 111.39 3mhy n GLN 26 Ca 0.16 -2.54 -0.02 0.00 -0.01 0.00 0.00 57.00 54.58 3mhy n GLN 26 Cb 0.48 -1.57 -0.04 0.00 0.00 0.00 0.00 30.24 29.11 3mhy n GLN 26 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 3mhy s GLY 27 N -2.20 0.03 -0.28 1.08 0.00 -1.26 -5.11 107.32 99.58 3mhy s GLY 27 Ca 0.32 2.64 -0.20 0.00 0.00 0.00 0.00 44.72 47.49 3mhy s GLY 27 CO 0.06 1.02 0.86 -2.27 0.00 0.00 0.00 173.10 172.76 3mhy s LEU 28 N -1.20 -0.67 -0.05 0.66 2.96 -1.26 -4.71 118.68 114.41 3mhy s LEU 28 Ca 0.09 1.16 0.05 0.00 -0.22 0.00 0.00 54.13 55.22 3mhy s LEU 28 Cb -0.01 2.11 -0.01 0.00 0.50 0.00 0.00 46.19 48.78 3mhy s LEU 28 CO -0.07 -0.19 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.67 3mhy s THR 29 N 0.97 1.78 0.04 3.68 2.01 -0.49 -5.00 115.64 118.64 3mhy s THR 29 Ca -0.05 -0.92 0.05 0.00 0.31 0.00 0.00 61.69 61.09 3mhy s THR 29 Cb -0.05 -1.51 -0.02 0.00 0.01 0.00 0.00 72.50 70.93 3mhy s THR 29 CO -0.11 0.50 -0.15 0.68 -0.69 0.00 0.00 174.62 174.85 3mhy s VAL 30 N -0.13 1.20 0.07 3.82 -7.23 -1.26 -0.33 120.40 116.53 3mhy s VAL 30 Ca -0.02 -1.07 -0.05 0.00 -1.81 0.00 0.00 61.98 59.03 3mhy s VAL 30 Cb -0.12 -1.08 -0.02 0.00 0.56 0.00 0.00 36.38 35.71 3mhy s VAL 30 CO 0.03 0.00 0.07 -0.94 -0.31 0.00 0.00 175.10 173.95 3mhy s SER 31 N -1.22 0.31 -0.04 4.85 1.04 -0.41 -4.98 113.70 113.24 3mhy s SER 31 Ca 0.02 -0.82 -0.21 0.00 0.48 0.00 0.00 55.95 55.42 3mhy s SER 31 Cb -0.08 0.26 -0.05 0.00 0.10 0.00 0.00 66.02 66.25 3mhy s SER 31 CO 0.01 -0.65 0.60 -1.61 0.98 0.00 0.00 173.24 172.57 3mhy s GLU 32 N -3.80 4.35 0.29 4.02 2.02 -1.26 -0.86 118.70 123.45 3mhy s GLU 32 Ca 0.05 0.71 0.04 0.00 0.02 0.00 0.00 54.97 55.79 3mhy s GLU 32 Cb 0.06 -3.39 -0.04 0.00 0.10 0.00 0.00 34.13 30.87 3mhy s GLU 32 CO -0.10 0.25 0.19 0.14 0.02 0.00 0.00 175.26 175.76 3mhy s VAL 33 N 0.22 0.11 0.18 2.63 -7.23 -0.79 -4.91 120.40 110.61 3mhy s VAL 33 Ca 0.32 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.55 3mhy s VAL 33 Cb -0.17 -2.50 -0.05 0.00 0.56 0.00 0.00 36.38 34.22 3mhy s VAL 33 CO 0.16 0.00 -0.13 -0.54 -0.31 0.00 0.00 175.10 174.28 3mhy s LYS 34 N -3.78 1.24 -0.00 4.82 1.02 -1.26 -1.21 119.74 120.57 3mhy s LYS 34 Ca 0.38 -1.53 -0.29 0.00 0.02 0.00 0.00 55.97 54.56 3mhy s LYS 34 Cb 0.05 -0.97 0.11 0.00 -0.52 0.00 0.00 37.83 36.49 3mhy s LYS 34 CO 0.20 0.15 1.27 0.20 -0.92 0.00 0.00 175.35 176.25 3mhy s GLY 35 N -3.22 -0.24 0.08 -3.33 0.00 -0.28 -4.87 107.32 95.46 3mhy s GLY 35 Ca 0.20 0.30 -0.01 0.00 0.00 0.00 0.00 44.72 45.21 3mhy s GLY 35 CO 0.05 2.91 0.00 -0.11 0.00 0.00 0.00 173.10 175.95 3mhy s PHE 36 N -2.22 0.64 0.00 1.90 -0.12 -1.26 -0.93 117.98 115.99 3mhy s PHE 36 Ca 0.22 -1.12 0.00 0.00 -0.05 0.00 0.00 56.93 55.98 3mhy s PHE 36 Cb 0.02 -0.42 0.00 0.00 -0.63 0.00 0.00 43.02 41.99 3mhy s PHE 36 CO -0.02 -0.43 0.00 0.41 -0.05 0.00 0.00 175.22 175.13 3mhy n GLY 37 N 0.04 4.25 0.00 1.99 0.00 -1.26 -4.92 105.19 105.29 3mhy n GLY 37 Ca -0.11 -1.75 0.10 0.00 0.00 0.00 0.00 46.02 44.26 3mhy n GLY 37 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3mhy n ARG 38 N 0.00 0.12 -0.09 1.61 1.85 -1.26 -1.62 116.66 117.27 3mhy n ARG 38 Ca 0.00 0.13 0.12 0.00 -1.00 0.00 0.00 57.85 57.10 3mhy n ARG 38 Cb 0.00 -1.50 0.25 0.00 -1.05 0.00 0.00 32.46 30.16 3mhy n ARG 38 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 3mhy n GLN 39 N -1.42 2.22 -2.59 2.89 3.00 -1.26 -4.97 117.38 115.25 3mhy n GLN 39 Ca 0.07 -1.81 -0.21 0.00 -0.01 0.00 0.00 57.00 55.04 3mhy n GLN 39 Cb 0.21 -1.47 0.01 0.00 0.00 0.00 0.00 30.24 28.98 3mhy n GLN 39 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 3mhy n LYS 40 N 1.08 -2.66 -0.99 -1.09 4.01 -0.64 -2.00 118.16 115.87 3mhy n LYS 40 Ca 0.17 0.95 0.00 0.00 -0.51 0.00 0.00 58.31 58.92 3mhy n LYS 40 Cb 0.52 -5.63 0.00 0.00 -0.51 0.00 0.00 35.03 29.41 3mhy n LYS 40 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3mhy n GLY 41 N -1.18 0.63 3.69 0.72 0.00 -1.24 -1.06 105.19 106.74 3mhy n GLY 41 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3mhy n GLY 41 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3mhy s GLN 42 N -0.08 4.23 0.00 1.61 0.74 -0.85 -4.57 119.66 120.73 3mhy s GLN 42 Ca 0.00 2.20 0.00 0.00 0.05 0.00 0.00 55.36 57.61 3mhy s GLN 42 Cb 0.00 -3.59 0.00 0.00 1.10 0.00 0.00 33.01 30.52 3mhy s GLN 42 CO 0.00 -0.68 0.22 0.25 -0.55 0.00 0.00 175.29 174.53 3mhy n THR 43 N 4.70 0.00 -4.34 -0.34 -2.24 -1.26 -5.04 114.28 105.77 3mhy n THR 43 Ca 0.15 -0.29 -0.23 0.00 -2.27 0.00 0.00 64.05 61.40 3mhy n THR 43 Cb 0.42 1.31 -0.08 0.00 -2.10 0.00 0.00 70.33 69.88 3mhy n THR 43 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3mhy s GLU 44 N -0.15 2.14 -0.04 -0.78 2.02 -1.26 -5.06 118.70 115.57 3mhy s GLU 44 Ca 0.00 -1.52 0.06 0.00 0.02 0.00 0.00 54.97 53.53 3mhy s GLU 44 Cb 0.00 -2.06 0.09 0.00 0.10 0.00 0.00 34.13 32.26 3mhy s GLU 44 CO 0.00 0.34 0.98 0.44 0.02 0.00 0.00 175.26 177.04 3mhy n ILE 45 N -0.84 1.06 -0.96 -1.63 -5.35 -1.26 -4.84 119.36 105.55 3mhy n ILE 45 Ca -0.06 -1.18 -0.31 0.00 -0.27 0.00 0.00 62.75 60.93 3mhy n ILE 45 Cb 0.59 0.34 0.13 0.00 -1.74 0.00 0.00 39.64 38.97 3mhy n ILE 45 CO 0.00 0.00 0.00 -0.72 -1.76 0.00 0.00 176.55 174.07 3mhy s TYR 46 N -1.36 2.06 0.03 4.28 -0.85 -1.26 -4.88 117.35 115.37 3mhy s TYR 46 Ca 0.10 1.66 -0.30 0.00 -0.52 0.00 0.00 57.07 58.01 3mhy s TYR 46 Cb 0.09 -3.20 -0.08 0.00 0.38 0.00 0.00 41.96 39.14 3mhy s TYR 46 CO 0.01 -2.38 1.83 0.50 -1.52 0.00 0.00 175.55 173.99 3mhy s ARG 47 N -4.77 4.16 0.00 -3.49 3.52 -1.26 -1.73 118.95 115.38 3mhy s ARG 47 Ca 0.64 2.47 0.00 0.00 -0.13 0.00 0.00 55.73 58.71 3mhy s ARG 47 Cb -0.20 -3.95 0.00 0.00 -1.56 0.00 0.00 34.95 29.24 3mhy s ARG 47 CO 0.57 -0.88 0.00 0.41 -0.81 0.00 0.00 175.30 174.59 3mhy n GLY 48 N 4.32 0.34 0.33 8.12 0.00 -1.26 -4.92 105.19 112.11 3mhy n GLY 48 Ca 0.18 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.40 3mhy n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mhy h ALA 49 N 0.00 1.22 0.00 4.61 0.00 -1.67 -1.77 119.26 121.65 3mhy h ALA 49 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3mhy h ALA 49 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3mhy h ALA 49 CO 0.00 -0.07 0.00 -0.85 0.00 0.00 0.00 179.25 178.33 3mhy n GLU 50 N -3.26 0.43 -0.03 0.00 0.28 -1.26 -2.40 120.64 114.40 3mhy n GLU 50 Ca -0.02 0.06 0.10 0.00 -0.16 0.00 0.00 57.16 57.13 3mhy n GLU 50 Cb 0.14 -1.50 0.10 0.00 1.43 0.00 0.00 31.44 31.61 3mhy n GLU 50 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3mhy n TYR 51 N -1.19 0.07 -3.86 -1.84 4.01 -0.66 -4.99 117.16 108.70 3mhy n TYR 51 Ca 0.12 -0.05 -0.24 0.00 -0.16 0.00 0.00 57.90 57.58 3mhy n TYR 51 Cb 0.14 -0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.14 3mhy n TYR 51 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3mhy s SER 52 N -1.58 6.33 -0.08 7.72 0.15 -1.01 -5.11 113.70 120.13 3mhy s SER 52 Ca 0.25 0.19 0.01 0.00 0.70 0.00 0.00 55.95 57.10 3mhy s SER 52 Cb 0.17 -1.92 0.02 0.00 -1.71 0.00 0.00 66.02 62.58 3mhy s SER 52 CO 0.25 -0.05 -0.11 -0.69 1.20 0.00 0.00 173.24 173.84 3mhy s VAL 53 N -1.92 1.09 0.07 4.45 1.01 -1.26 -4.74 120.40 119.11 3mhy s VAL 53 Ca 0.35 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.96 3mhy s VAL 53 Cb -0.10 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 3mhy s VAL 53 CO 0.30 0.36 -0.11 -0.44 0.00 0.00 0.00 175.10 175.20 3mhy s SER 54 N 1.01 1.36 -0.13 3.32 0.01 -0.23 -5.00 113.70 114.04 3mhy s SER 54 Ca -0.08 -0.64 -0.12 0.00 1.31 0.00 0.00 55.95 56.41 3mhy s SER 54 Cb -0.15 -0.01 -0.05 0.00 0.21 0.00 0.00 66.02 66.03 3mhy s SER 54 CO -0.00 -0.16 0.27 -0.36 0.41 0.00 0.00 173.24 173.40 3mhy s PHE 55 N -1.59 3.53 0.04 2.43 0.40 -1.26 -3.73 117.98 117.80 3mhy s PHE 55 Ca -0.03 0.63 0.06 0.00 -0.60 0.00 0.00 56.93 56.99 3mhy s PHE 55 Cb -0.08 -2.25 -0.03 0.00 0.51 0.00 0.00 43.02 41.17 3mhy s PHE 55 CO 0.01 0.40 -0.15 -0.51 0.70 0.00 0.00 175.22 175.67 3mhy s LEU 56 N -0.06 2.77 0.30 -0.37 1.43 -0.10 -4.80 118.68 117.84 3mhy s LEU 56 Ca 0.17 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.61 3mhy s LEU 56 Cb -0.13 -1.61 -0.10 0.00 0.03 0.00 0.00 46.19 44.37 3mhy s LEU 56 CO 0.05 0.25 1.37 -2.16 0.23 0.00 0.00 176.35 176.10 3mhy s PRO 57 N -1.51 4.30 0.17 1.29 0.04 -1.26 -1.13 135.00 136.90 3mhy s PRO 57 Ca 0.16 2.27 -0.02 0.00 0.04 0.00 0.00 61.00 63.45 3mhy s PRO 57 Cb -0.11 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 3mhy s PRO 57 CO 0.07 -0.31 0.11 0.15 0.04 0.00 0.00 177.00 177.06 3mhy s LYS 58 N -1.18 1.08 -0.08 4.56 -0.14 -0.35 -4.53 119.74 119.10 3mhy s LYS 58 Ca 0.54 -1.51 0.03 0.00 -1.36 0.00 0.00 55.97 53.66 3mhy s LYS 58 Cb -0.41 0.27 -0.02 0.00 -1.68 0.00 0.00 37.83 35.99 3mhy s LYS 58 CO 0.49 -0.34 -0.17 0.08 -0.76 0.00 0.00 175.35 174.65 3mhy s VAL 59 N -4.10 2.76 -0.27 3.17 1.01 -0.38 -1.89 120.40 120.71 3mhy s VAL 59 Ca 0.31 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.38 3mhy s VAL 59 Cb 0.07 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.31 3mhy s VAL 59 CO 0.07 0.56 0.18 -0.75 0.00 0.00 0.00 175.10 175.16 3mhy s LYS 60 N -0.18 3.99 -0.16 2.72 2.20 -0.04 -1.21 119.74 127.06 3mhy s LYS 60 Ca -0.01 -0.31 -0.05 0.00 -0.36 0.00 0.00 55.97 55.25 3mhy s LYS 60 Cb -0.13 -3.62 -0.03 0.00 -1.51 0.00 0.00 37.83 32.53 3mhy s LYS 60 CO 0.03 -0.11 -0.01 0.08 -0.36 0.00 0.00 175.35 174.99 3mhy s VAL 61 N 1.54 4.13 -0.10 4.02 1.01 0.76 -1.29 120.40 130.46 3mhy s VAL 61 Ca 0.07 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3mhy s VAL 61 Cb -0.15 -2.82 0.02 0.00 0.00 0.00 0.00 36.38 33.42 3mhy s VAL 61 CO 0.09 0.49 -0.12 -1.61 0.00 0.00 0.00 175.10 173.94 3mhy s GLU 62 N 0.36 1.93 -0.13 2.72 2.02 0.55 -0.43 118.70 125.72 3mhy s GLU 62 Ca -0.02 -0.45 -0.00 0.00 0.02 0.00 0.00 54.97 54.52 3mhy s GLU 62 Cb -0.14 -1.73 0.03 0.00 0.10 0.00 0.00 34.13 32.40 3mhy s GLU 62 CO 0.02 -0.12 -0.07 0.08 0.02 0.00 0.00 175.26 175.19 3mhy s VAL 63 N 1.16 1.07 -0.12 2.63 1.01 -0.08 -1.39 120.40 124.68 3mhy s VAL 63 Ca -0.04 -0.40 -0.22 0.00 0.00 0.00 0.00 61.98 61.33 3mhy s VAL 63 Cb -0.14 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 3mhy s VAL 63 CO -0.03 0.30 0.64 0.00 0.00 0.00 0.00 175.10 176.02 3mhy s ALA 64 N 1.68 3.44 0.15 5.51 0.00 -1.26 -0.73 121.76 130.54 3mhy s ALA 64 Ca 0.04 -0.05 -0.10 0.00 0.00 0.00 0.00 51.96 51.85 3mhy s ALA 64 Cb -0.13 -2.92 -0.00 0.00 0.00 0.00 0.00 23.12 20.07 3mhy s ALA 64 CO -0.08 -0.25 0.29 0.14 0.00 0.00 0.00 175.76 175.86 3mhy s VAL 65 N 1.17 0.08 0.74 0.00 -7.23 -0.18 -4.92 120.40 110.07 3mhy s VAL 65 Ca 0.33 -1.26 -0.11 0.00 -1.81 0.00 0.00 61.98 59.12 3mhy s VAL 65 Cb -0.17 -1.69 0.04 0.00 0.56 0.00 0.00 36.38 35.12 3mhy s VAL 65 CO 0.14 -0.35 1.08 -0.94 -0.31 0.00 0.00 175.10 174.71 3mhy s SER 66 N -2.93 4.96 0.32 4.85 1.04 -1.26 -0.85 113.70 119.83 3mhy s SER 66 Ca 0.13 1.44 0.03 0.00 0.48 0.00 0.00 55.95 58.03 3mhy s SER 66 Cb 0.03 -2.25 0.61 0.00 0.10 0.00 0.00 66.02 64.51 3mhy s SER 66 CO -0.03 -1.69 1.90 0.44 0.98 0.00 0.00 173.24 174.84 3mhy h ASP 67 N -0.89 0.83 -0.05 7.02 3.32 -1.95 -1.54 116.42 123.17 3mhy h ASP 67 Ca -0.45 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.61 3mhy h ASP 67 Cb 1.24 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.63 3mhy h ASP 67 CO 0.58 0.51 0.00 -0.90 -1.72 0.00 0.00 179.24 177.71 3mhy n ASP 68 N -4.52 0.50 0.00 6.45 5.75 -1.26 -3.67 116.55 119.81 3mhy n ASP 68 Ca 0.15 -1.48 0.00 0.00 -0.01 0.00 0.00 54.79 53.45 3mhy n ASP 68 Cb 0.27 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 3mhy n ASP 68 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3mhy n GLN 69 N -0.47 4.31 0.05 0.11 6.02 -0.64 -4.82 117.38 121.94 3mhy n GLN 69 Ca 0.15 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.10 3mhy n GLN 69 Cb 0.15 -0.55 0.16 0.00 1.02 0.00 0.00 30.24 31.02 3mhy n GLN 69 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 177.06 176.15 3mhy h TYR 70 N 0.00 0.45 -0.73 1.08 -0.00 -1.48 -2.60 116.97 113.69 3mhy h TYR 70 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 58.73 58.54 3mhy h TYR 70 Cb 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 36.73 36.60 3mhy h TYR 70 CO 0.00 0.75 0.25 0.93 -0.00 0.00 0.00 178.16 180.10 3mhy h GLU 71 N 0.31 1.12 -0.71 0.10 5.08 -1.88 0.07 114.58 118.67 3mhy h GLU 71 Ca 0.02 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 3mhy h GLU 71 Cb 0.90 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 3mhy h GLU 71 CO 0.07 0.93 0.24 1.96 -1.00 0.00 0.00 179.01 181.22 3mhy h GLN 72 N 1.08 1.07 -0.27 2.33 4.20 -1.83 -1.57 115.11 120.12 3mhy h GLN 72 Ca 0.24 -0.21 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 3mhy h GLN 72 Cb 0.27 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 3mhy h GLN 72 CO -0.01 0.90 -0.01 0.28 -0.67 0.00 0.00 178.83 179.31 3mhy h VAL 73 N 1.04 1.26 -0.40 -0.54 2.07 -1.03 -1.27 116.25 117.38 3mhy h VAL 73 Ca 0.23 -0.96 0.04 0.00 0.82 0.00 0.00 66.70 66.83 3mhy h VAL 73 Cb 0.26 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 3mhy h VAL 73 CO -0.01 0.30 0.18 0.58 0.02 0.00 0.00 177.57 178.64 3mhy h VAL 74 N 0.26 0.95 -0.20 2.57 2.07 -0.83 -1.69 116.25 119.38 3mhy h VAL 74 Ca 0.07 -0.13 -0.11 0.00 0.82 0.00 0.00 66.70 67.35 3mhy h VAL 74 Cb 0.45 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 3mhy h VAL 74 CO 0.02 0.07 -0.36 -0.33 0.02 0.00 0.00 177.57 176.99 3mhy h GLU 75 N 0.38 0.42 -0.58 1.57 5.08 -1.21 -1.32 114.58 118.92 3mhy h GLU 75 Ca 0.18 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 3mhy h GLU 75 Cb 0.11 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 3mhy h GLU 75 CO -0.14 0.73 0.01 0.00 -1.00 0.00 0.00 179.01 178.60 3mhy h ALA 76 N 1.26 0.78 -0.32 3.43 0.00 -0.91 -0.78 119.26 122.72 3mhy h ALA 76 Ca 0.04 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 3mhy h ALA 76 Cb 0.80 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3mhy h ALA 76 CO 0.06 0.60 0.05 0.82 0.00 0.00 0.00 179.25 180.79 3mhy h ILE 77 N 0.90 1.23 -0.45 0.00 2.04 -1.08 -2.06 117.51 118.10 3mhy h ILE 77 Ca 0.16 -0.81 0.02 0.00 1.00 0.00 0.00 64.86 65.23 3mhy h ILE 77 Cb 0.54 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 3mhy h ILE 77 CO 0.03 0.27 0.26 -0.61 0.00 0.00 0.00 178.15 178.09 3mhy h GLN 78 N 0.36 0.50 -0.44 2.37 4.15 -1.06 -0.80 115.11 120.19 3mhy h GLN 78 Ca 0.10 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.41 3mhy h GLN 78 Cb 0.35 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 3mhy h GLN 78 CO 0.01 0.33 -0.03 -0.22 -1.93 0.00 0.00 178.83 176.99 3mhy h LYS 79 N 0.51 0.72 0.00 1.69 1.63 -1.08 -0.34 116.57 119.71 3mhy h LYS 79 Ca 0.18 -0.20 -0.18 0.00 -0.85 0.00 0.00 60.65 59.60 3mhy h LYS 79 Cb 0.03 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 3mhy h LYS 79 CO -0.09 0.76 -0.84 0.00 -3.45 0.00 0.00 179.45 175.83 3mhy h ALA 80 N 1.29 0.60 0.00 5.00 0.00 -0.94 -3.34 119.26 121.87 3mhy h ALA 80 Ca 0.13 -0.73 -0.16 0.00 0.00 0.00 0.00 54.91 54.15 3mhy h ALA 80 Cb 0.46 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3mhy h ALA 80 CO 0.02 0.97 -1.99 0.00 0.00 0.00 0.00 179.25 178.25 3mhy n ALA 81 N -2.42 2.19 -2.34 0.00 0.00 -0.34 -4.77 120.51 112.83 3mhy n ALA 81 Ca -0.02 -0.80 -0.43 0.00 0.00 0.00 0.00 53.44 52.20 3mhy n ALA 81 Cb 0.79 -0.60 -0.02 0.00 0.00 0.00 0.00 19.45 19.62 3mhy n ALA 81 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3mhy s ASN 82 N -5.11 6.55 -0.01 0.00 2.47 -0.15 -4.81 114.94 113.87 3mhy s ASN 82 Ca -0.08 1.24 0.02 0.00 0.42 0.00 0.00 52.86 54.46 3mhy s ASN 82 Cb 0.10 -2.54 0.02 0.00 -1.45 0.00 0.00 41.25 37.39 3mhy s ASN 82 CO 0.86 -1.18 1.01 0.35 -3.72 0.00 0.00 177.10 174.42 3mhy n THR 83 N 6.40 1.06 -1.16 -5.21 -2.24 -1.26 -4.96 114.28 106.91 3mhy n THR 83 Ca 0.16 -1.09 -0.04 0.00 -2.27 0.00 0.00 64.05 60.81 3mhy n THR 83 Cb 0.46 0.44 -0.02 0.00 -2.10 0.00 0.00 70.33 69.12 3mhy n THR 83 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mhy n GLY 84 N -0.57 0.66 3.42 3.38 0.00 -1.26 -5.03 105.19 105.79 3mhy n GLY 84 Ca 0.01 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 3mhy n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mhy s ARG 85 N -2.42 1.82 0.49 1.61 0.52 -1.26 -5.10 118.95 114.61 3mhy s ARG 85 Ca 0.00 -1.12 -0.24 0.00 -0.52 0.00 0.00 55.73 53.85 3mhy s ARG 85 Cb 0.00 -2.07 -0.07 0.00 0.52 0.00 0.00 34.95 33.33 3mhy s ARG 85 CO 0.00 0.50 1.42 0.44 0.02 0.00 0.00 175.30 177.68 3mhy n ILE 86 N 1.34 3.21 -0.57 1.52 -5.35 -1.26 -2.35 119.36 115.90 3mhy n ILE 86 Ca -0.17 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.81 3mhy n ILE 86 Cb 0.52 -1.80 0.00 0.00 -1.74 0.00 0.00 39.64 36.63 3mhy n ILE 86 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3mhy n GLY 87 N 0.63 0.77 0.13 3.28 0.00 -1.26 -4.92 105.19 103.83 3mhy n GLY 87 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.20 3mhy n GLY 87 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3mhy n ASP 88 N 0.00 0.62 0.00 1.61 8.00 -0.99 -4.39 116.55 121.40 3mhy n ASP 88 Ca 0.00 0.68 0.00 0.00 0.71 0.00 0.00 54.79 56.18 3mhy n ASP 88 Cb 0.00 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 3mhy n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mhy n GLY 89 N -0.33 3.14 2.92 0.44 0.00 -1.26 -4.56 105.19 105.55 3mhy n GLY 89 Ca 0.01 -1.79 -0.15 0.00 0.00 0.00 0.00 46.02 44.10 3mhy n GLY 89 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mhy s LYS 90 N -2.01 0.31 -0.13 1.61 2.47 -0.97 -4.99 119.74 116.03 3mhy s LYS 90 Ca 0.00 -0.12 0.03 0.00 -1.56 0.00 0.00 55.97 54.32 3mhy s LYS 90 Cb 0.00 -0.31 0.00 0.00 -1.46 0.00 0.00 37.83 36.07 3mhy s LYS 90 CO 0.00 0.06 -0.21 0.42 0.16 0.00 0.00 175.35 175.78 3mhy s ILE 91 N -0.01 2.21 -0.07 5.43 1.01 -1.26 -0.93 121.20 127.59 3mhy s ILE 91 Ca 0.01 -0.94 0.04 0.00 0.00 0.00 0.00 60.65 59.75 3mhy s ILE 91 Cb -0.02 -1.88 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 3mhy s ILE 91 CO -0.00 0.55 -0.19 -0.36 0.00 0.00 0.00 174.94 174.94 3mhy s PHE 92 N 0.62 2.60 -0.19 3.97 0.08 0.64 -4.98 117.98 120.73 3mhy s PHE 92 Ca -0.11 -0.48 -0.01 0.00 0.12 0.00 0.00 56.93 56.45 3mhy s PHE 92 Cb -0.16 -1.65 0.00 0.00 -0.57 0.00 0.00 43.02 40.64 3mhy s PHE 92 CO 0.03 -0.05 -0.12 0.08 -0.10 0.00 0.00 175.22 175.05 3mhy s VAL 93 N -0.30 2.77 0.23 -0.44 1.01 -1.26 -0.40 120.40 122.00 3mhy s VAL 93 Ca 0.01 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.37 3mhy s VAL 93 Cb -0.13 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 3mhy s VAL 93 CO 0.03 0.49 0.00 -0.76 0.00 0.00 0.00 175.10 174.86 3mhy s LEU 94 N 1.19 3.25 0.15 3.92 1.02 -0.24 -4.95 118.68 123.03 3mhy s LEU 94 Ca 0.02 -0.54 -0.24 0.00 0.02 0.00 0.00 54.13 53.39 3mhy s LEU 94 Cb -0.14 -1.83 -0.08 0.00 0.02 0.00 0.00 46.19 44.17 3mhy s LEU 94 CO -0.05 0.03 0.73 -1.81 0.02 0.00 0.00 176.35 175.27 3mhy s ASP 95 N -3.41 7.29 -0.24 2.29 1.01 -1.26 0.13 116.67 122.48 3mhy s ASP 95 Ca 0.30 1.54 -0.07 0.00 0.71 0.00 0.00 52.55 55.03 3mhy s ASP 95 Cb -0.08 -2.46 -0.03 0.00 1.01 0.00 0.00 42.92 41.37 3mhy s ASP 95 CO 0.19 0.21 0.05 -0.63 0.21 0.00 0.00 175.17 175.21 3mhy s ILE 96 N -1.17 4.18 0.12 0.77 1.01 -0.20 -4.78 121.20 121.13 3mhy s ILE 96 Ca 0.35 -0.22 -0.06 0.00 0.00 0.00 0.00 60.65 60.72 3mhy s ILE 96 Cb -0.22 -2.95 -0.19 0.00 0.01 0.00 0.00 42.46 39.12 3mhy s ILE 96 CO 0.24 0.36 1.29 0.00 0.00 0.00 0.00 174.94 176.83 3mhy h ALA 97 N 8.16 0.33 -2.38 9.38 0.00 -1.97 -3.33 119.26 129.45 3mhy h ALA 97 Ca -0.39 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 53.74 3mhy h ALA 97 Cb 1.17 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.78 3mhy h ALA 97 CO 0.58 0.78 -0.05 -1.14 0.00 0.00 0.00 179.25 179.43 3mhy s GLN 98 N -3.31 0.91 0.03 0.00 2.00 -1.26 -5.00 119.66 113.02 3mhy s GLN 98 Ca -0.07 -0.12 0.02 0.00 -2.00 0.00 0.00 55.36 53.19 3mhy s GLN 98 Cb 0.08 0.41 -0.02 0.00 0.80 0.00 0.00 33.01 34.29 3mhy s GLN 98 CO 0.88 -0.29 -0.06 0.00 -0.50 0.00 0.00 175.29 175.31 3mhy s ALA 99 N -1.80 0.43 -0.02 1.58 0.00 -1.26 -4.97 121.76 115.72 3mhy s ALA 99 Ca -0.09 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.28 3mhy s ALA 99 Cb -0.02 0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.16 3mhy s ALA 99 CO 0.03 -0.02 0.01 0.08 0.00 0.00 0.00 175.76 175.86 3mhy s VAL 100 N -1.10 0.10 -0.30 0.00 1.01 -1.26 -1.54 120.40 117.31 3mhy s VAL 100 Ca -0.08 0.11 -0.24 0.00 0.00 0.00 0.00 61.98 61.77 3mhy s VAL 100 Cb -0.08 -0.20 -0.00 0.00 0.00 0.00 0.00 36.38 36.10 3mhy s VAL 100 CO 0.00 0.12 0.80 -0.60 0.00 0.00 0.00 175.10 175.41 3mhy s ARG 101 N 0.94 4.00 0.24 2.72 3.52 -0.19 -4.97 118.95 125.21 3mhy s ARG 101 Ca -0.09 0.65 -0.05 0.00 -0.13 0.00 0.00 55.73 56.12 3mhy s ARG 101 Cb -0.12 -3.71 0.25 0.00 -1.56 0.00 0.00 34.95 29.81 3mhy s ARG 101 CO -0.02 -0.65 1.78 0.82 -0.81 0.00 0.00 175.30 176.42 3mhy h ILE 102 N 5.57 1.25 -0.69 4.11 2.04 -1.96 0.73 117.51 128.56 3mhy h ILE 102 Ca -0.24 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 64.69 3mhy h ILE 102 Cb 1.10 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 3mhy h ILE 102 CO 0.88 0.34 0.21 -0.09 0.00 0.00 0.00 178.15 179.49 3mhy h ARG 103 N 0.98 1.08 0.00 2.37 2.43 -1.98 -3.34 114.38 115.92 3mhy h ARG 103 Ca 0.21 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3mhy h ARG 103 Cb 0.30 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3mhy h ARG 103 CO -0.00 0.94 -1.51 0.25 -1.51 0.00 0.00 179.97 178.13 3mhy n THR 104 N -4.30 0.00 -0.99 0.20 -2.24 -1.13 -4.99 114.28 100.83 3mhy n THR 104 Ca 0.05 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3mhy n THR 104 Cb 0.23 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 3mhy n THR 104 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mhy n GLY 105 N 1.79 0.71 3.75 3.38 0.00 0.24 -5.02 105.19 110.04 3mhy n GLY 105 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 3mhy n GLY 105 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mhy s GLU 106 N -0.01 3.30 0.32 1.61 2.02 -1.24 -4.78 118.70 119.92 3mhy s GLU 106 Ca 0.00 2.22 0.03 0.00 0.02 0.00 0.00 54.97 57.25 3mhy s GLU 106 Cb 0.00 -2.35 -0.06 0.00 0.10 0.00 0.00 34.13 31.83 3mhy s GLU 106 CO 0.00 -1.06 0.07 0.95 0.02 0.00 0.00 175.26 175.24 3mhy s THR 107 N -1.31 1.01 0.00 3.63 -4.23 -1.26 -1.02 115.64 112.46 3mhy s THR 107 Ca 0.69 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 3mhy s THR 107 Cb -0.40 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 70.73 3mhy s THR 107 CO 0.48 0.00 0.00 -3.20 -0.54 0.00 0.00 174.62 171.36 3mhy n ASN 108 N -0.72 0.00 0.29 3.99 4.05 -0.59 -2.35 115.26 119.93 3mhy n ASN 108 Ca -0.02 0.00 0.18 0.00 0.45 0.00 0.00 54.58 55.19 3mhy n ASN 108 Cb 0.66 0.00 0.83 0.00 1.23 0.00 0.00 39.78 42.50 3mhy n ASN 108 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 3mhy h THR 109 N 0.00 0.07 0.00 -0.44 1.35 -1.98 -1.48 112.91 110.43 3mhy h THR 109 Ca 0.00 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 3mhy h THR 109 Cb 0.00 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 3mhy h THR 109 CO 0.00 0.02 0.00 -0.33 -0.25 0.00 0.00 175.52 174.96 3mhy h GLU 110 N 0.00 0.00 0.00 4.72 4.39 -1.85 -3.10 114.58 118.74 3mhy h GLU 110 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3mhy h GLU 110 Cb 0.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 3mhy h GLU 110 CO 0.00 0.00 -0.82 0.00 -1.16 0.00 0.00 179.01 177.04 3mhy n ALA 111 N -1.92 3.25 1.35 3.43 0.00 -0.56 -4.78 120.51 121.29 3mhy n ALA 111 Ca 0.02 -0.34 0.11 0.00 0.00 0.00 0.00 53.44 53.22 3mhy n ALA 111 Cb 0.28 -1.06 0.64 0.00 0.00 0.00 0.00 19.45 19.31 3mhy n ALA 111 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78