#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8s s SER 2 N 0.00 5.57 0.04 1.61 0.01 -1.26 -5.07 113.70 114.60 2d8s s SER 2 Ca 0.00 -2.67 -0.14 0.00 1.31 0.00 0.00 55.95 54.45 2d8s s SER 2 Cb 0.00 -1.93 -0.06 0.00 0.21 0.00 0.00 66.02 64.24 2d8s s SER 2 CO 0.00 -0.45 0.45 -0.55 0.41 0.00 0.00 173.24 173.09 2d8s s SER 3 N 1.25 6.82 0.00 2.44 0.15 -1.26 -5.02 113.70 118.08 2d8s s SER 3 Ca 0.15 0.99 0.00 0.00 0.70 0.00 0.00 55.95 57.79 2d8s s SER 3 Cb -0.19 -2.26 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 2d8s s SER 3 CO -0.04 0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.27 2d8s n GLY 4 N 1.51 4.37 3.33 9.45 0.00 -1.26 -5.17 105.19 117.41 2d8s n GLY 4 Ca -0.11 -1.39 -0.20 0.00 0.00 0.00 0.00 46.02 44.32 2d8s n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d8s s SER 5 N 0.00 1.69 -0.45 1.61 0.01 -1.26 -5.09 113.70 110.21 2d8s s SER 5 Ca 0.00 -1.66 -0.27 0.00 1.31 0.00 0.00 55.95 55.32 2d8s s SER 5 Cb 0.00 0.49 -0.03 0.00 0.21 0.00 0.00 66.02 66.70 2d8s s SER 5 CO 0.00 -0.98 1.92 -0.94 0.41 0.00 0.00 173.24 173.65 2d8s s SER 6 N -3.39 5.45 0.00 2.44 1.04 -1.26 -4.94 113.70 113.04 2d8s s SER 6 Ca 0.36 0.94 0.00 0.00 0.48 0.00 0.00 55.95 57.74 2d8s s SER 6 Cb 0.03 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2d8s s SER 6 CO 0.21 -2.12 0.00 0.61 0.98 0.00 0.00 173.24 172.92 2d8s n GLY 7 N 5.62 2.10 3.28 7.32 0.00 -1.26 -5.15 105.19 117.09 2d8s n GLY 7 Ca 0.24 -1.88 -0.14 0.00 0.00 0.00 0.00 46.02 44.25 2d8s n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2d8s s THR 8 N 3.19 0.03 -0.21 2.61 -4.23 -1.26 -5.14 115.64 110.62 2d8s s THR 8 Ca 0.00 -0.25 -0.05 0.00 -1.18 0.00 0.00 61.69 60.22 2d8s s THR 8 Cb 0.00 -0.63 0.08 0.00 1.34 0.00 0.00 72.50 73.29 2d8s s THR 8 CO 0.00 -0.14 0.11 -0.44 -0.54 0.00 0.00 174.62 173.62 2d8s s SER 9 N -0.72 2.65 0.28 3.99 0.01 -1.26 -5.13 113.70 113.52 2d8s s SER 9 Ca -0.08 -0.81 -0.29 0.00 1.31 0.00 0.00 55.95 56.09 2d8s s SER 9 Cb -0.04 -0.22 -0.14 0.00 0.21 0.00 0.00 66.02 65.83 2d8s s SER 9 CO 0.03 -0.38 1.08 0.00 0.41 0.00 0.00 173.24 174.38 2d8s n ILE 10 N 5.27 1.80 -3.87 1.44 0.13 -1.26 -5.00 119.36 117.88 2d8s n ILE 10 Ca -0.06 -0.45 -0.14 0.00 -1.10 0.00 0.00 62.75 61.00 2d8s n ILE 10 Cb 0.47 -1.06 -0.15 0.00 -0.84 0.00 0.00 39.64 38.06 2d8s n ILE 10 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2d8s s THR 11 N -0.89 0.03 -1.09 9.51 -4.23 -1.26 -5.08 115.64 112.63 2d8s s THR 11 Ca 0.61 0.05 -0.23 0.00 -1.18 0.00 0.00 61.69 60.94 2d8s s THR 11 Cb -0.70 -0.08 -0.07 0.00 1.34 0.00 0.00 72.50 72.98 2d8s s THR 11 CO 0.59 0.05 1.94 -2.16 -0.54 0.00 0.00 174.62 174.49 2d8s s PRO 12 N 0.38 2.51 -0.64 3.99 0.04 -1.26 -4.88 135.00 135.14 2d8s s PRO 12 Ca -0.03 -0.87 -0.06 0.00 0.04 0.00 0.00 61.00 60.08 2d8s s PRO 12 Cb -0.05 -5.18 0.17 0.00 0.04 0.00 0.00 34.50 29.48 2d8s s PRO 12 CO -0.01 -3.78 0.49 -1.12 0.04 0.00 0.00 177.00 172.61 2d8s s SER 13 N 7.03 5.58 0.94 6.66 0.01 -1.26 -5.08 113.70 127.58 2d8s s SER 13 Ca 0.69 -2.70 -0.12 0.00 1.31 0.00 0.00 55.95 55.13 2d8s s SER 13 Cb -0.03 -1.94 0.16 0.00 0.21 0.00 0.00 66.02 64.42 2d8s s SER 13 CO 0.08 -0.45 1.11 -0.44 0.41 0.00 0.00 173.24 173.96 2d8s s SER 14 N 1.21 3.15 -0.30 2.44 0.01 -1.26 -4.95 113.70 114.00 2d8s s SER 14 Ca 0.16 1.11 -0.29 0.00 1.31 0.00 0.00 55.95 58.24 2d8s s SER 14 Cb -0.19 -1.74 -0.01 0.00 0.21 0.00 0.00 66.02 64.29 2d8s s SER 14 CO -0.04 -2.79 1.47 -1.10 0.41 0.00 0.00 173.24 171.18 2d8s s GLN 15 N -5.11 3.75 -0.57 12.44 -0.21 -1.26 -4.96 119.66 123.74 2d8s s GLN 15 Ca 0.64 1.32 -0.27 0.00 0.02 0.00 0.00 55.36 57.07 2d8s s GLN 15 Cb -0.17 -3.99 0.03 0.00 1.00 0.00 0.00 33.01 29.89 2d8s s GLN 15 CO 0.55 -1.34 1.10 -0.51 -2.12 0.00 0.00 175.29 172.97 2d8s s ASP 16 N 3.79 6.41 0.15 5.90 1.11 -1.26 -5.00 116.67 127.77 2d8s s ASP 16 Ca 0.64 -0.06 0.02 0.00 0.18 0.00 0.00 52.55 53.33 2d8s s ASP 16 Cb -0.19 -2.51 -0.04 0.00 1.07 0.00 0.00 42.92 41.25 2d8s s ASP 16 CO 0.28 -1.39 -0.03 0.27 1.18 0.00 0.00 175.17 175.49 2d8s s ILE 17 N 4.59 0.72 0.77 0.77 -5.25 -1.26 -4.83 121.20 116.72 2d8s s ILE 17 Ca 0.38 -1.97 -0.15 0.00 -0.99 0.00 0.00 60.65 57.92 2d8s s ILE 17 Cb -0.09 -1.96 -0.13 0.00 2.95 0.00 0.00 42.46 43.22 2d8s s ILE 17 CO 0.23 -0.62 -0.57 0.00 -1.79 0.00 0.00 174.94 172.19 2d8s n ARG 19 N 1.98 2.91 -0.07 0.00 1.85 -1.22 -3.54 116.66 118.58 2d8s n ARG 19 Ca 0.00 -0.02 -0.22 0.00 -1.00 0.00 0.00 57.85 56.61 2d8s n ARG 19 Cb 0.47 -0.93 -0.12 0.00 -1.05 0.00 0.00 32.46 30.82 2d8s n ARG 19 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 2d8s n ILE 20 N -1.39 1.63 -0.02 8.89 5.41 -1.26 -4.60 119.36 128.03 2d8s n ILE 20 Ca 0.00 -0.48 0.04 0.00 1.00 0.00 0.00 62.75 63.31 2d8s n ILE 20 Cb 0.12 -1.74 -0.10 0.00 -0.71 0.00 0.00 39.64 37.21 2d8s n ILE 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2d8s n HIS 22 N -2.04 -1.99 -4.14 0.00 8.25 -1.23 -5.03 115.22 109.03 2d8s n HIS 22 Ca -0.06 0.77 -0.12 0.00 -0.26 0.00 0.00 57.72 58.05 2d8s n HIS 22 Cb 0.44 -4.26 -0.11 0.00 1.12 0.00 0.00 29.99 27.19 2d8s n HIS 22 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2d8s n GLU 24 N 0.50 0.79 -2.12 0.00 1.02 -1.26 -3.05 120.64 116.51 2d8s n GLU 24 Ca -0.16 0.29 -0.42 0.00 -0.02 0.00 0.00 57.16 56.85 2d8s n GLU 24 Cb 0.58 -1.77 -0.03 0.00 -0.02 0.00 0.00 31.44 30.20 2d8s n GLU 24 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2d8s s GLY 25 N -0.99 1.83 0.48 0.62 0.00 -1.26 -4.89 107.32 103.12 2d8s s GLY 25 Ca 0.66 1.08 -0.05 0.00 0.00 0.00 0.00 44.72 46.42 2d8s s GLY 25 CO 0.55 2.52 0.78 0.99 0.00 0.00 0.00 173.10 177.94 2d8s s ASP 26 N 1.59 6.14 0.13 1.64 1.01 -0.99 -4.81 116.67 121.38 2d8s s ASP 26 Ca 0.66 0.82 -0.19 0.00 0.71 0.00 0.00 52.55 54.56 2d8s s ASP 26 Cb -0.36 -2.11 -0.03 0.00 1.01 0.00 0.00 42.92 41.42 2d8s s ASP 26 CO 0.29 -0.63 1.78 -2.24 0.21 0.00 0.00 175.17 174.58 2d8s h ASP 27 N 0.22 0.23 0.93 0.27 3.04 -1.97 0.49 116.42 119.63 2d8s h ASP 27 Ca -0.47 0.00 -0.16 0.00 -3.24 0.00 0.00 57.03 53.17 2d8s h ASP 27 Cb 1.22 -0.05 -0.03 0.00 -1.04 0.00 0.00 39.33 39.43 2d8s h ASP 27 CO 0.61 0.17 -1.15 -0.33 -2.04 0.00 0.00 179.24 176.51 2d8s h GLU 28 N 0.30 0.00 -1.77 4.15 5.08 -2.03 -3.36 114.58 116.95 2d8s h GLU 28 Ca 0.10 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.87 2d8s h GLU 28 Cb 0.00 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 28.83 2d8s h GLU 28 CO -0.05 0.39 -0.67 0.43 -1.00 0.00 0.00 179.01 178.11 2d8s n SER 29 N -3.01 4.70 -4.37 1.42 7.64 -1.11 -4.76 113.62 114.13 2d8s n SER 29 Ca -0.06 -3.71 -0.29 0.00 1.01 0.00 0.00 58.87 55.82 2d8s n SER 29 Cb 0.82 -0.50 0.20 0.00 -1.01 0.00 0.00 64.21 63.72 2d8s n SER 29 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2d8s s PRO 30 N -3.53 -0.25 -0.52 1.43 0.04 0.17 -2.36 135.00 129.98 2d8s s PRO 30 Ca 0.48 0.29 -0.27 0.00 0.04 0.00 0.00 61.00 61.54 2d8s s PRO 30 Cb 0.36 -1.68 0.03 0.00 0.04 0.00 0.00 34.50 33.26 2d8s s PRO 30 CO -0.18 -3.14 1.05 -0.51 0.04 0.00 0.00 177.00 174.27 2d8s s LEU 31 N -6.66 3.79 0.09 -3.56 1.43 -1.26 -3.65 118.68 108.86 2d8s s LEU 31 Ca 0.67 0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.94 2d8s s LEU 31 Cb -0.16 -3.18 -0.03 0.00 0.03 0.00 0.00 46.19 42.85 2d8s s LEU 31 CO 0.57 -1.26 -0.22 0.27 0.23 0.00 0.00 176.35 175.94 2d8s s ILE 32 N 4.30 1.80 -0.40 -0.59 -4.36 -1.16 -4.95 121.20 115.84 2d8s s ILE 32 Ca 0.40 -1.51 -0.29 0.00 -0.26 0.00 0.00 60.65 58.99 2d8s s ILE 32 Cb -0.09 -1.61 0.02 0.00 1.25 0.00 0.00 42.46 42.02 2d8s s ILE 32 CO 0.26 0.03 1.25 0.42 0.24 0.00 0.00 174.94 177.13 2d8s s THR 33 N -1.06 4.14 0.16 8.37 -4.23 -1.26 -3.51 115.64 118.24 2d8s s THR 33 Ca 0.08 1.22 -0.09 0.00 -1.18 0.00 0.00 61.69 61.72 2d8s s THR 33 Cb -0.10 -4.36 -0.04 0.00 1.34 0.00 0.00 72.50 69.35 2d8s s THR 33 CO 0.04 -0.74 1.49 1.55 -0.54 0.00 0.00 174.62 176.42 2d8s h PRO 34 N 9.52 0.88 0.00 3.99 0.13 -1.91 -3.47 132.00 141.14 2d8s h PRO 34 Ca -0.25 -0.46 -0.18 0.00 -0.87 0.00 0.00 66.00 64.24 2d8s h PRO 34 Cb 1.08 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.18 2d8s h PRO 34 CO 1.08 1.11 -0.12 0.00 -0.23 0.00 0.00 178.00 179.84 2d8s h HIS 36 N 1.54 0.75 0.00 0.00 3.86 -1.96 -3.43 115.15 115.91 2d8s h HIS 36 Ca -0.14 -0.09 -0.42 0.00 -1.16 0.00 0.00 60.37 58.57 2d8s h HIS 36 Cb 0.63 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.85 2d8s h HIS 36 CO 0.00 0.68 0.96 0.00 0.86 0.00 0.00 177.93 180.43 2d8s n THR 38 N 4.40 1.90 0.00 0.00 -2.24 -1.26 -4.78 114.28 112.30 2d8s n THR 38 Ca 0.38 -4.96 0.00 0.00 -2.27 0.00 0.00 64.05 57.20 2d8s n THR 38 Cb -0.01 -2.19 0.00 0.00 -2.10 0.00 0.00 70.33 66.03 2d8s n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2d8s n GLY 39 N 1.80 0.63 1.23 3.38 0.00 -1.26 -5.04 105.19 105.93 2d8s n GLY 39 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2d8s n GLY 39 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d8s n SER 40 N 0.00 0.38 -2.89 1.61 7.64 -1.26 -4.88 113.62 114.23 2d8s n SER 40 Ca 0.00 0.10 -0.37 0.00 1.01 0.00 0.00 58.87 59.61 2d8s n SER 40 Cb 0.00 -0.08 0.03 0.00 -1.01 0.00 0.00 64.21 63.15 2d8s n SER 40 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2d8s n LEU 41 N -2.95 6.81 -1.72 -3.43 7.99 -1.26 -4.79 117.00 117.65 2d8s n LEU 41 Ca 0.00 -5.00 -0.09 0.00 -0.01 0.00 0.00 56.01 50.92 2d8s n LEU 41 Cb 0.00 -0.93 0.01 0.00 -0.11 0.00 0.00 43.42 42.39 2d8s n LEU 41 CO 0.00 1.91 1.14 0.00 -1.51 0.00 0.00 177.39 178.93 2d8s n HIS 42 N -0.48 0.72 -3.62 -1.77 1.44 -1.26 -4.43 115.22 105.82 2d8s n HIS 42 Ca 0.49 -1.47 -0.29 0.00 -2.01 0.00 0.00 57.72 54.44 2d8s n HIS 42 Cb 0.33 -0.77 -0.12 0.00 0.12 0.00 0.00 29.99 29.55 2d8s n HIS 42 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2d8s s PHE 43 N -0.81 1.56 0.38 -1.40 0.08 -1.26 -4.43 117.98 112.10 2d8s s PHE 43 Ca 0.18 -2.19 0.01 0.00 0.12 0.00 0.00 56.93 55.05 2d8s s PHE 43 Cb 0.13 -1.53 -0.02 0.00 -0.57 0.00 0.00 43.02 41.02 2d8s s PHE 43 CO -0.01 -0.79 0.58 0.14 -0.10 0.00 0.00 175.22 175.04 2d8s s VAL 44 N 0.51 4.75 0.02 -0.44 -7.23 -1.23 -3.42 120.40 113.37 2d8s s VAL 44 Ca 0.19 -0.49 -0.29 0.00 -1.81 0.00 0.00 61.98 59.57 2d8s s VAL 44 Cb -0.21 -3.74 -0.04 0.00 0.56 0.00 0.00 36.38 32.95 2d8s s VAL 44 CO -0.01 -0.48 0.95 -1.00 -0.31 0.00 0.00 175.10 174.24 2d8s s HIS 45 N -2.38 3.69 0.38 2.82 3.76 -1.26 -3.00 115.29 119.31 2d8s s HIS 45 Ca 0.43 1.68 0.23 0.00 -0.15 0.00 0.00 55.06 57.25 2d8s s HIS 45 Cb -0.10 -3.07 1.38 0.00 1.11 0.00 0.00 32.58 31.90 2d8s s HIS 45 CO 0.36 0.06 1.58 0.37 -0.85 0.00 0.00 174.74 176.27 2d8s h GLN 46 N 6.45 0.00 0.12 1.40 4.15 -1.77 0.12 115.11 125.58 2d8s h GLN 46 Ca -0.42 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.00 2d8s h GLN 46 Cb 1.22 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.91 2d8s h GLN 46 CO 0.74 0.00 -0.06 0.00 -1.93 0.00 0.00 178.83 177.59 2d8s h ALA 47 N 1.93 -0.16 -0.93 3.38 0.00 -1.89 -3.33 119.26 118.27 2d8s h ALA 47 Ca 0.86 -0.14 0.27 0.00 0.00 0.00 0.00 54.91 55.90 2d8s h ALA 47 Cb 2.35 0.06 -0.15 0.00 0.00 0.00 0.00 17.79 20.05 2d8s h ALA 47 CO -0.72 -0.17 0.31 0.00 0.00 0.00 0.00 179.25 178.68 2d8s h LEU 49 N 0.20 0.44 -0.81 0.00 5.85 -0.97 0.58 115.31 120.60 2d8s h LEU 49 Ca 0.62 0.21 0.12 0.00 0.84 0.00 0.00 57.88 59.67 2d8s h LEU 49 Cb 1.34 0.17 -0.08 0.00 0.37 0.00 0.00 40.66 42.47 2d8s h LEU 49 CO -0.68 -0.20 0.42 1.56 -0.34 0.00 0.00 178.44 179.20 2d8s h GLN 50 N 0.25 0.64 -0.52 1.25 4.20 -0.39 0.19 115.11 120.74 2d8s h GLN 50 Ca 0.75 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 59.40 2d8s h GLN 50 Cb 1.75 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 29.36 2d8s h GLN 50 CO -0.64 0.43 0.25 0.37 -0.67 0.00 0.00 178.83 178.56 2d8s h GLN 51 N 0.66 0.76 -0.34 1.46 5.75 0.07 0.16 115.11 123.62 2d8s h GLN 51 Ca 0.42 -0.11 -0.11 0.00 -0.15 0.00 0.00 58.65 58.70 2d8s h GLN 51 Cb 0.50 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 2d8s h GLN 51 CO -0.31 0.63 -0.23 2.35 -2.65 0.00 0.00 178.83 178.62 2d8s h TRP 52 N 0.70 0.76 -0.24 3.99 7.01 -1.04 -1.04 115.95 126.09 2d8s h TRP 52 Ca 0.18 -0.17 -0.16 0.00 2.11 0.00 0.00 58.89 60.85 2d8s h TRP 52 Cb 0.12 -0.18 0.00 0.00 -2.10 0.00 0.00 29.16 27.00 2d8s h TRP 52 CO -0.00 0.85 -0.47 0.82 -2.79 0.00 0.00 178.44 176.84 2d8s h ILE 53 N 0.59 1.30 -0.50 2.65 2.04 -0.35 0.44 117.51 123.69 2d8s h ILE 53 Ca 0.08 -1.68 -0.12 0.00 1.00 0.00 0.00 64.86 64.15 2d8s h ILE 53 Cb 0.71 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 2d8s h ILE 53 CO 0.05 0.53 -0.15 0.50 0.00 0.00 0.00 178.15 179.09 2d8s h LYS 54 N 0.48 0.96 0.01 2.37 3.64 -0.60 -0.36 116.57 123.07 2d8s h LYS 54 Ca 0.01 -0.36 -0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2d8s h LYS 54 Cb 1.08 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2d8s h LYS 54 CO 0.11 1.03 -0.00 1.03 -2.27 0.00 0.00 179.45 179.34 2d8s h SER 55 N 0.84 -0.01 -0.00 4.20 0.87 -1.19 -3.29 113.55 114.97 2d8s h SER 55 Ca 0.13 -0.81 0.00 0.00 -1.23 0.00 0.00 61.79 59.88 2d8s h SER 55 Cb 0.70 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.66 2d8s h SER 55 CO 0.05 0.87 0.00 -1.28 -0.53 0.00 0.00 176.83 175.95 2d8s h SER 56 N -0.96 0.00 -4.32 6.23 0.87 -0.17 -3.46 113.55 111.73 2d8s h SER 56 Ca -0.00 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.31 2d8s h SER 56 Cb 0.81 0.00 0.10 0.00 -0.44 0.00 0.00 62.40 62.88 2d8s h SER 56 CO 0.00 0.00 -0.48 -0.67 -0.53 0.00 0.00 176.83 175.15 2d8s n ASP 57 N -4.02 -3.57 -3.59 6.23 -0.08 -0.16 -5.02 116.55 106.33 2d8s n ASP 57 Ca -0.03 -0.38 -0.02 0.00 -1.51 0.00 0.00 54.79 52.84 2d8s n ASP 57 Cb 0.09 -3.55 -0.06 0.00 2.34 0.00 0.00 41.12 39.94 2d8s n ASP 57 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2d8s s THR 58 N -3.23 -0.32 0.20 5.18 -1.32 -1.12 -5.03 115.64 110.00 2d8s s THR 58 Ca 0.21 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.79 2d8s s THR 58 Cb -0.09 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 69.82 2d8s s THR 58 CO 0.49 0.00 1.50 0.03 -2.21 0.00 0.00 174.62 174.43 2d8s h ARG 59 N 7.02 0.00 -6.74 7.08 3.08 -1.96 -3.43 114.38 119.44 2d8s h ARG 59 Ca -0.24 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.38 2d8s h ARG 59 Cb 1.17 0.00 0.04 0.00 0.08 0.00 0.00 29.97 31.25 2d8s h ARG 59 CO 0.14 0.72 -0.09 0.00 -1.07 0.00 0.00 179.97 179.68 2d8s n GLU 62 N -4.88 0.66 -0.07 0.00 4.07 -1.26 -3.39 120.64 115.76 2d8s n GLU 62 Ca 0.03 0.17 -0.08 0.00 -0.06 0.00 0.00 57.16 57.22 2d8s n GLU 62 Cb 0.55 -1.67 -0.03 0.00 -0.06 0.00 0.00 31.44 30.23 2d8s n GLU 62 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2d8s n LEU 63 N -2.94 1.76 0.01 4.31 4.77 -1.26 -4.56 117.00 119.09 2d8s n LEU 63 Ca -0.24 0.29 0.13 0.00 -0.03 0.00 0.00 56.01 56.16 2d8s n LEU 63 Cb 1.10 -0.69 0.56 0.00 -2.33 0.00 0.00 43.42 42.05 2d8s n LEU 63 CO 0.44 -0.33 0.92 0.00 -1.33 0.00 0.00 177.39 177.09 2d8s n LYS 65 N -1.57 -2.77 -3.79 0.00 4.01 -1.22 -4.85 118.16 107.96 2d8s n LYS 65 Ca 0.06 0.33 -0.36 0.00 -0.51 0.00 0.00 58.31 57.84 2d8s n LYS 65 Cb 0.32 -4.46 -0.10 0.00 -0.51 0.00 0.00 35.03 30.28 2d8s n LYS 65 CO 0.00 0.00 0.00 -0.47 -1.11 0.00 0.00 177.40 175.82 2d8s s TYR 66 N -3.90 3.26 0.00 2.13 5.04 -1.26 -4.46 117.35 118.15 2d8s s TYR 66 Ca 0.16 0.08 -0.33 0.00 -2.44 0.00 0.00 57.07 54.53 2d8s s TYR 66 Cb -0.09 -2.20 -0.11 0.00 0.35 0.00 0.00 41.96 39.91 2d8s s TYR 66 CO 0.92 0.03 1.85 -1.91 -1.34 0.00 0.00 175.55 175.10 2d8s n GLU 67 N 4.13 2.41 -1.68 4.97 2.13 -1.26 -1.38 120.64 129.96 2d8s n GLU 67 Ca -0.16 0.88 -0.30 0.00 0.66 0.00 0.00 57.16 58.24 2d8s n GLU 67 Cb 0.52 -2.74 0.07 0.00 0.27 0.00 0.00 31.44 29.56 2d8s n GLU 67 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2d8s s PHE 68 N 3.50 3.04 -0.68 4.31 0.08 -0.99 -4.93 117.98 122.32 2d8s s PHE 68 Ca 0.88 1.14 -0.27 0.00 0.12 0.00 0.00 56.93 58.80 2d8s s PHE 68 Cb -0.61 -3.08 0.03 0.00 -0.57 0.00 0.00 43.02 38.79 2d8s s PHE 68 CO 0.46 -1.51 1.29 0.42 -0.10 0.00 0.00 175.22 175.78 2d8s s ILE 69 N -3.22 3.79 -0.17 0.64 -1.09 -1.26 -4.99 121.20 114.90 2d8s s ILE 69 Ca 0.60 0.56 -0.01 0.00 -2.23 0.00 0.00 60.65 59.56 2d8s s ILE 69 Cb -0.13 -4.79 -0.00 0.00 -1.58 0.00 0.00 42.46 35.96 2d8s s ILE 69 CO 0.53 -1.62 -0.12 -0.32 -1.23 0.00 0.00 174.94 172.18 2d8s s MET 70 N 5.57 3.28 0.19 2.79 -2.45 -1.26 -5.06 119.30 122.36 2d8s s MET 70 Ca 0.40 -0.71 -0.30 0.00 -1.25 0.00 0.00 55.69 53.83 2d8s s MET 70 Cb -0.08 -2.72 -0.08 0.00 1.25 0.00 0.00 34.83 33.20 2d8s s MET 70 CO 0.19 -0.01 1.21 -1.21 1.05 0.00 0.00 175.02 176.25 2d8s s GLU 71 N 0.91 4.48 -0.11 4.11 0.41 -1.26 -4.94 118.70 122.31 2d8s s GLU 71 Ca -0.03 1.90 0.00 0.00 -0.41 0.00 0.00 54.97 56.43 2d8s s GLU 71 Cb -0.15 -3.23 -0.07 0.00 -1.78 0.00 0.00 34.13 28.90 2d8s s GLU 71 CO -0.01 -0.10 -0.10 -2.37 -0.49 0.00 0.00 175.26 172.19 2d8s n THR 72 N 2.49 0.61 -3.70 3.63 5.66 -1.26 -5.03 114.28 116.68 2d8s n THR 72 Ca 0.04 -0.22 -0.11 0.00 -3.05 0.00 0.00 64.05 60.71 2d8s n THR 72 Cb 0.44 -0.96 -0.12 0.00 -1.55 0.00 0.00 70.33 68.14 2d8s n THR 72 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 2d8s s LYS 73 N -2.21 0.29 0.41 1.09 2.47 -1.26 -5.17 119.74 115.36 2d8s s LYS 73 Ca -0.14 0.70 0.04 0.00 -1.56 0.00 0.00 55.97 55.01 2d8s s LYS 73 Cb 0.04 -0.04 -0.05 0.00 -1.46 0.00 0.00 37.83 36.32 2d8s s LYS 73 CO 0.24 -0.18 0.04 -0.48 0.16 0.00 0.00 175.35 175.13 2d8s s LEU 74 N 1.54 2.39 -0.27 5.43 0.05 -1.26 -5.13 118.68 121.43 2d8s s LEU 74 Ca -0.08 -1.49 -0.03 0.00 0.05 0.00 0.00 54.13 52.58 2d8s s LEU 74 Cb -0.10 -0.57 0.02 0.00 -2.05 0.00 0.00 46.19 43.49 2d8s s LEU 74 CO -0.11 -0.67 -0.01 -0.94 -0.55 0.00 0.00 176.35 174.07 2d8s s SER 75 N -3.66 4.62 0.00 1.48 1.04 -1.26 -5.03 113.70 110.89 2d8s s SER 75 Ca 0.27 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.83 2d8s s SER 75 Cb 0.07 -1.73 0.00 0.00 0.10 0.00 0.00 66.02 64.45 2d8s s SER 75 CO 0.13 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.80 2d8s n GLY 76 N 4.72 0.89 3.76 7.32 0.00 -1.26 -5.10 105.19 115.52 2d8s n GLY 76 Ca -0.15 -1.89 -0.41 0.00 0.00 0.00 0.00 46.02 43.57 2d8s n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d8s s PRO 77 N -1.86 4.44 -0.71 1.61 0.04 -1.26 -4.99 135.00 132.28 2d8s s PRO 77 Ca 0.00 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.94 2d8s s PRO 77 Cb 0.00 -3.14 0.17 0.00 0.04 0.00 0.00 34.50 31.57 2d8s s PRO 77 CO 0.00 -0.11 0.69 -1.12 0.04 0.00 0.00 177.00 176.50 2d8s s SER 78 N -0.29 6.49 -0.24 6.66 0.01 -1.26 -4.82 113.70 120.26 2d8s s SER 78 Ca 0.51 -2.20 -0.08 0.00 1.31 0.00 0.00 55.95 55.48 2d8s s SER 78 Cb -0.37 -2.23 -0.12 0.00 0.21 0.00 0.00 66.02 63.52 2d8s s SER 78 CO 0.45 -0.76 -0.28 -1.20 0.41 0.00 0.00 173.24 171.86 2d8s n SER 79 N 4.82 1.84 0.00 2.44 7.64 -1.26 -5.31 113.62 123.79 2d8s n SER 79 Ca 0.02 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.08 2d8s n SER 79 Cb 0.44 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 2d8s n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64