#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s6o n GLU 2 N 0.00 1.52 -4.50 1.61 0.28 -1.26 -4.78 120.64 113.52 1s6o n GLU 2 Ca 0.00 0.54 -0.33 0.00 -0.16 0.00 0.00 57.16 57.20 1s6o n GLU 2 Cb 0.00 -2.03 -0.14 0.00 1.43 0.00 0.00 31.44 30.70 1s6o n GLU 2 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1s6o s VAL 3 N -0.58 3.02 -0.20 3.84 1.01 0.33 -4.85 120.40 122.98 1s6o s VAL 3 Ca 0.65 -0.65 -0.29 0.00 0.00 0.00 0.00 61.98 61.69 1s6o s VAL 3 Cb -0.72 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1s6o s VAL 3 CO 0.56 0.50 1.10 -0.69 0.00 0.00 0.00 175.10 176.56 1s6o s VAL 4 N 0.73 4.58 0.18 2.92 1.01 -1.26 -1.50 120.40 127.06 1s6o s VAL 4 Ca -0.05 1.90 0.09 0.00 0.00 0.00 0.00 61.98 63.92 1s6o s VAL 4 Cb -0.15 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 1s6o s VAL 4 CO 0.02 -0.15 -0.19 -1.48 0.00 0.00 0.00 175.10 173.30 1s6o s LEU 5 N 3.15 2.46 -0.24 3.92 -0.00 0.09 -4.99 118.68 123.07 1s6o s LEU 5 Ca 0.47 -0.90 -0.09 0.00 -0.00 0.00 0.00 54.13 53.61 1s6o s LEU 5 Cb -0.17 -0.89 -0.04 0.00 -0.00 0.00 0.00 46.19 45.08 1s6o s LEU 5 CO 0.09 -0.02 0.13 -0.75 -0.00 0.00 0.00 176.35 175.81 1s6o s LYS 6 N -2.93 3.90 0.21 1.48 2.47 -1.26 -2.16 119.74 121.46 1s6o s LYS 6 Ca 0.19 -0.35 0.06 0.00 -1.56 0.00 0.00 55.97 54.30 1s6o s LYS 6 Cb -0.05 -3.46 -0.04 0.00 -1.46 0.00 0.00 37.83 32.82 1s6o s LYS 6 CO 0.08 -0.04 0.16 -1.64 0.16 0.00 0.00 175.35 174.07 1s6o s MET 7 N 1.29 2.90 -0.17 4.03 -1.94 0.24 -1.83 119.30 123.81 1s6o s MET 7 Ca 0.06 -0.98 -0.04 0.00 -1.71 0.00 0.00 55.69 53.02 1s6o s MET 7 Cb -0.14 -2.59 -0.02 0.00 2.01 0.00 0.00 34.83 34.08 1s6o s MET 7 CO 0.05 0.44 -0.04 0.15 -0.01 0.00 0.00 175.02 175.61 1s6o s LYS 8 N -3.51 3.58 -0.76 2.03 -0.14 0.19 -0.45 119.74 120.68 1s6o s LYS 8 Ca 0.32 -0.56 0.03 0.00 -1.36 0.00 0.00 55.97 54.40 1s6o s LYS 8 Cb -0.09 -2.94 0.24 0.00 -1.68 0.00 0.00 37.83 33.36 1s6o s LYS 8 CO 0.24 0.12 0.82 0.28 -0.76 0.00 0.00 175.35 176.05 1s6o n VAL 9 N 3.90 2.79 -1.53 3.17 0.31 -0.13 -1.04 118.33 125.80 1s6o n VAL 9 Ca -0.17 -5.25 -0.29 0.00 -0.01 0.00 0.00 64.34 58.62 1s6o n VAL 9 Cb 0.52 -2.16 0.13 0.00 -0.91 0.00 0.00 33.84 31.43 1s6o n VAL 9 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1s6o s GLU 10 N -2.17 1.16 0.00 5.55 0.41 -1.22 -4.26 118.70 118.16 1s6o s GLU 10 Ca 0.34 0.30 0.00 0.00 -0.41 0.00 0.00 54.97 55.20 1s6o s GLU 10 Cb 0.06 -1.84 0.00 0.00 -1.78 0.00 0.00 34.13 30.57 1s6o s GLU 10 CO -0.04 -2.19 0.00 0.41 -0.49 0.00 0.00 175.26 172.95 1s6o n GLY 11 N -2.19 0.92 3.58 -1.39 0.00 -1.26 -4.47 105.19 100.37 1s6o n GLY 11 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 1s6o n GLY 11 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s6o n MET 12 N 0.00 0.10 -0.01 1.61 2.81 -1.26 -4.64 117.12 115.74 1s6o n MET 12 Ca 0.00 -1.67 -0.20 0.00 -1.81 0.00 0.00 57.70 54.02 1s6o n MET 12 Cb 0.00 -3.93 -0.14 0.00 -0.71 0.00 0.00 33.22 28.44 1s6o n MET 12 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1s6o n THR 13 N 9.10 1.74 -1.74 2.03 -2.24 -1.26 -4.88 114.28 117.03 1s6o n THR 13 Ca 0.41 -0.67 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 1s6o n THR 13 Cb 0.47 -1.62 -0.02 0.00 -2.10 0.00 0.00 70.33 67.06 1s6o n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s6o n HIS 15 N 2.49 0.00 -2.79 0.00 1.44 -1.26 -4.01 115.22 111.09 1s6o n HIS 15 Ca 0.10 -1.03 -0.01 0.00 -2.01 0.00 0.00 57.72 54.77 1s6o n HIS 15 Cb 0.37 -0.75 0.01 0.00 0.12 0.00 0.00 29.99 29.74 1s6o n HIS 15 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1s6o s SER 16 N 2.02 -0.59 -0.44 4.39 0.15 -1.26 -5.05 113.70 112.92 1s6o s SER 16 Ca 0.16 -0.48 0.07 0.00 0.70 0.00 0.00 55.95 56.40 1s6o s SER 16 Cb 0.08 0.76 0.34 0.00 -1.71 0.00 0.00 66.02 65.49 1s6o s SER 16 CO 0.00 -0.05 1.19 0.00 1.20 0.00 0.00 173.24 175.58 1s6o n THR 18 N 0.09 0.00 -0.34 0.00 -2.24 -1.26 -4.78 114.28 105.76 1s6o n THR 18 Ca 0.03 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.92 1s6o n THR 18 Cb 0.74 -0.23 0.31 0.00 -2.10 0.00 0.00 70.33 69.05 1s6o n THR 18 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1s6o h SER 19 N 0.00 0.81 -0.36 3.42 0.87 -1.95 0.66 113.55 117.00 1s6o h SER 19 Ca 0.00 0.07 0.04 0.00 -1.23 0.00 0.00 61.79 60.67 1s6o h SER 19 Cb 0.00 -0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 61.80 1s6o h SER 19 CO 0.00 0.37 -0.48 0.74 -0.53 0.00 0.00 176.83 176.92 1s6o h THR 20 N 0.83 0.00 -0.24 2.23 2.02 -1.97 0.18 112.91 115.98 1s6o h THR 20 Ca 0.52 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.74 1s6o h THR 20 Cb 0.72 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1s6o h THR 20 CO -0.30 0.00 0.02 0.40 0.37 0.00 0.00 175.52 176.01 1s6o h ILE 21 N -0.34 0.86 0.27 3.11 5.03 -0.14 0.09 117.51 126.39 1s6o h ILE 21 Ca 0.06 -0.03 -0.01 0.00 -0.12 0.00 0.00 64.86 64.76 1s6o h ILE 21 Cb 0.51 0.75 -0.01 0.00 -3.03 0.00 0.00 36.82 35.05 1s6o h ILE 21 CO -0.52 0.02 -0.21 -0.33 -0.68 0.00 0.00 178.15 176.43 1s6o h GLU 22 N 0.10 -0.44 -0.55 2.37 5.08 -0.31 0.15 114.58 120.99 1s6o h GLU 22 Ca 0.11 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.60 1s6o h GLU 22 Cb 0.13 0.10 -0.11 0.00 0.50 0.00 0.00 28.75 29.37 1s6o h GLU 22 CO -0.17 -0.30 -0.27 0.78 -1.00 0.00 0.00 179.01 178.05 1s6o h GLY 23 N -0.46 0.04 0.83 -3.84 0.00 -0.67 0.19 103.07 99.16 1s6o h GLY 23 Ca -0.04 0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.64 1s6o h GLY 23 CO 0.01 -0.22 -0.28 1.70 0.00 0.00 0.00 176.54 177.75 1s6o h LYS 24 N -0.14 -0.65 -0.01 4.80 3.64 -0.81 -2.57 116.57 120.84 1s6o h LYS 24 Ca 0.24 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.66 1s6o h LYS 24 Cb 0.52 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1s6o h LYS 24 CO -0.63 -0.43 -0.03 0.82 -2.27 0.00 0.00 179.45 176.91 1s6o h ILE 25 N -0.68 1.02 0.00 2.00 1.08 -0.28 -0.70 117.51 119.96 1s6o h ILE 25 Ca -0.04 -0.10 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1s6o h ILE 25 Cb 0.57 1.05 0.00 0.00 -3.07 0.00 0.00 36.82 35.36 1s6o h ILE 25 CO 0.02 0.03 0.35 1.23 -0.69 0.00 0.00 178.15 179.09 1s6o h GLY 26 N 0.10 0.00 0.95 5.37 0.00 -0.20 0.13 103.07 109.42 1s6o h GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1s6o h GLY 26 CO 0.00 0.00 -0.71 0.28 0.00 0.00 0.00 176.54 176.11 1s6o n LYS 27 N -2.80 0.21 -2.12 4.80 4.76 -0.27 -4.92 118.16 117.83 1s6o n LYS 27 Ca -0.02 0.04 -0.41 0.00 -2.87 0.00 0.00 58.31 55.05 1s6o n LYS 27 Cb 0.39 -1.61 -0.03 0.00 -1.84 0.00 0.00 35.03 31.94 1s6o n LYS 27 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1s6o s LEU 28 N -3.82 4.40 -0.26 -0.35 2.01 0.45 -4.90 118.68 116.21 1s6o s LEU 28 Ca 0.07 2.51 -0.32 0.00 0.01 0.00 0.00 54.13 56.40 1s6o s LEU 28 Cb 0.15 -3.61 -0.08 0.00 0.01 0.00 0.00 46.19 42.65 1s6o s LEU 28 CO 0.74 -0.62 2.18 0.00 1.01 0.00 0.00 176.35 179.66 1s6o n GLN 29 N 2.71 1.59 0.00 1.70 10.64 -1.26 -1.64 117.38 131.12 1s6o n GLN 29 Ca 0.07 0.45 0.00 0.00 -1.83 0.00 0.00 57.00 55.69 1s6o n GLN 29 Cb 0.41 -2.84 0.00 0.00 -0.86 0.00 0.00 30.24 26.95 1s6o n GLN 29 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1s6o n GLY 30 N 6.01 1.40 3.74 2.61 0.00 -1.26 -3.89 105.19 113.79 1s6o n GLY 30 Ca 0.34 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.96 1s6o n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s6o s VAL 31 N -1.58 4.45 -0.24 1.61 1.01 -0.65 -3.85 120.40 121.15 1s6o s VAL 31 Ca 0.00 1.96 -0.02 0.00 0.00 0.00 0.00 61.98 63.91 1s6o s VAL 31 Cb 0.00 -4.27 -0.14 0.00 0.00 0.00 0.00 36.38 31.97 1s6o s VAL 31 CO 0.00 0.38 -0.24 0.00 0.00 0.00 0.00 175.10 175.23 1s6o n GLN 32 N 2.45 0.58 -3.67 2.72 1.13 0.34 -4.87 117.38 116.06 1s6o n GLN 32 Ca -0.00 0.17 -0.10 0.00 -1.94 0.00 0.00 57.00 55.12 1s6o n GLN 32 Cb 0.49 -1.45 -0.04 0.00 0.11 0.00 0.00 30.24 29.34 1s6o n GLN 32 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1s6o s ARG 33 N -2.47 1.15 -0.12 -1.09 3.52 -1.21 -5.00 118.95 113.73 1s6o s ARG 33 Ca -0.33 -0.76 -0.11 0.00 -0.13 0.00 0.00 55.73 54.40 1s6o s ARG 33 Cb 0.10 0.48 0.03 0.00 -1.56 0.00 0.00 34.95 34.00 1s6o s ARG 33 CO 0.52 -0.46 0.33 -1.50 -0.81 0.00 0.00 175.30 173.38 1s6o s ILE 34 N -3.83 -0.00 -0.11 4.11 2.07 -1.26 -1.03 121.20 121.15 1s6o s ILE 34 Ca 0.05 0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 59.26 1s6o s ILE 34 Cb 0.01 -0.46 0.05 0.00 0.13 0.00 0.00 42.46 42.19 1s6o s ILE 34 CO -0.09 0.00 0.07 -0.75 -1.91 0.00 0.00 174.94 172.26 1s6o s LYS 35 N 0.25 0.05 -0.16 3.50 2.36 0.21 -4.97 119.74 120.98 1s6o s LYS 35 Ca -0.01 0.12 -0.01 0.00 -2.55 0.00 0.00 55.97 53.52 1s6o s LYS 35 Cb -0.03 -1.23 -0.01 0.00 -1.05 0.00 0.00 37.83 35.52 1s6o s LYS 35 CO -0.00 -0.50 -0.11 0.08 1.55 0.00 0.00 175.35 176.36 1s6o s VAL 36 N 2.14 3.05 0.77 4.02 1.01 -1.26 -0.34 120.40 129.79 1s6o s VAL 36 Ca 0.03 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 1s6o s VAL 36 Cb -0.14 -2.32 0.10 0.00 0.00 0.00 0.00 36.38 34.02 1s6o s VAL 36 CO -0.06 0.50 1.09 -0.55 0.00 0.00 0.00 175.10 176.07 1s6o s SER 37 N 0.76 4.41 0.03 3.32 0.15 0.35 -4.88 113.70 117.83 1s6o s SER 37 Ca -0.05 0.36 -0.02 0.00 0.70 0.00 0.00 55.95 56.94 1s6o s SER 37 Cb -0.15 -0.84 -0.01 0.00 -1.71 0.00 0.00 66.02 63.31 1s6o s SER 37 CO 0.01 -1.88 -0.05 0.18 1.20 0.00 0.00 173.24 172.71 1s6o n LEU 38 N -3.11 0.86 -0.11 3.45 4.77 -1.26 -4.43 117.00 117.17 1s6o n LEU 38 Ca 0.10 0.12 -0.05 0.00 -0.03 0.00 0.00 56.01 56.15 1s6o n LEU 38 Cb 0.60 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 41.39 1s6o n LEU 38 CO 0.50 -0.61 0.79 0.44 -1.33 0.00 0.00 177.39 177.19 1s6o h ASP 39 N -0.13 -0.34 1.44 -1.43 3.32 -1.96 -0.40 116.42 116.92 1s6o h ASP 39 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1s6o h ASP 39 Cb 0.13 0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1s6o h ASP 39 CO 0.00 -0.12 0.00 -1.13 -1.72 0.00 0.00 179.24 176.27 1s6o h ASN 40 N 0.00 0.00 0.00 6.45 -0.73 -2.00 -3.46 115.58 115.85 1s6o h ASN 40 Ca 0.18 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.35 1s6o h ASN 40 Cb 0.27 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.86 1s6o h ASN 40 CO -0.38 0.00 0.00 0.00 -0.37 0.00 0.00 177.43 176.68 1s6o n GLN 41 N -2.79 -0.82 -4.12 6.67 6.02 -0.16 -4.94 117.38 117.24 1s6o n GLN 41 Ca 0.03 0.21 -0.28 0.00 -0.01 0.00 0.00 57.00 56.95 1s6o n GLN 41 Cb 0.40 -4.47 -0.07 0.00 1.02 0.00 0.00 30.24 27.12 1s6o n GLN 41 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1s6o s GLU 42 N -1.28 2.67 0.08 -1.09 2.56 -1.26 -0.95 118.70 119.42 1s6o s GLU 42 Ca 0.00 -0.90 -0.00 0.00 0.00 0.00 0.00 54.97 54.06 1s6o s GLU 42 Cb 0.00 -2.55 -0.04 0.00 2.00 0.00 0.00 34.13 33.54 1s6o s GLU 42 CO 0.00 0.50 -0.02 0.00 -0.56 0.00 0.00 175.26 175.18 1s6o s ALA 43 N -1.58 0.69 -0.08 6.30 0.00 0.40 -0.50 121.76 126.99 1s6o s ALA 43 Ca 0.28 -1.30 -0.02 0.00 0.00 0.00 0.00 51.96 50.92 1s6o s ALA 43 Cb -0.11 0.38 0.03 0.00 0.00 0.00 0.00 23.12 23.43 1s6o s ALA 43 CO 0.21 -0.37 0.04 0.99 0.00 0.00 0.00 175.76 176.62 1s6o s THR 44 N -3.89 0.15 0.29 0.00 2.01 0.54 -0.59 115.64 114.14 1s6o s THR 44 Ca 0.12 0.17 0.11 0.00 0.31 0.00 0.00 61.69 62.40 1s6o s THR 44 Cb 0.07 -0.42 -0.05 0.00 0.01 0.00 0.00 72.50 72.11 1s6o s THR 44 CO -0.06 0.14 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.20 1s6o s ILE 45 N 2.06 2.41 -0.16 1.82 1.01 -0.92 -0.62 121.20 126.80 1s6o s ILE 45 Ca 0.04 -2.37 -0.01 0.00 0.00 0.00 0.00 60.65 58.32 1s6o s ILE 45 Cb -0.13 -2.35 0.04 0.00 0.01 0.00 0.00 42.46 40.04 1s6o s ILE 45 CO -0.05 -0.37 -0.04 0.54 0.00 0.00 0.00 174.94 175.02 1s6o s VAL 46 N -2.55 0.98 0.38 2.92 0.11 -0.20 -0.73 120.40 121.31 1s6o s VAL 46 Ca 0.30 -0.57 -0.15 0.00 -2.93 0.00 0.00 61.98 58.64 1s6o s VAL 46 Cb -0.04 -1.20 0.05 0.00 -1.53 0.00 0.00 36.38 33.67 1s6o s VAL 46 CO 0.15 0.09 0.76 -0.72 -3.33 0.00 0.00 175.10 172.05 1s6o s TYR 47 N 1.69 0.20 0.04 1.54 -0.85 -0.56 -0.51 117.35 118.89 1s6o s TYR 47 Ca 0.01 -0.83 0.03 0.00 -0.52 0.00 0.00 57.07 55.75 1s6o s TYR 47 Cb -0.15 0.76 -0.02 0.00 0.38 0.00 0.00 41.96 42.92 1s6o s TYR 47 CO -0.07 -1.53 -0.09 -0.65 -1.52 0.00 0.00 175.55 171.68 1s6o s GLN 48 N -2.39 0.60 -0.90 -3.49 -1.52 -1.25 -0.51 119.66 110.19 1s6o s GLN 48 Ca 0.17 -0.74 -0.23 0.00 -1.95 0.00 0.00 55.36 52.60 1s6o s GLN 48 Cb -0.05 -0.44 -0.15 0.00 -0.22 0.00 0.00 33.01 32.15 1s6o s GLN 48 CO 0.12 0.09 1.91 -0.35 -0.25 0.00 0.00 175.29 176.81 1s6o n PRO 49 N 1.59 1.34 0.14 2.91 -0.04 -1.26 -3.70 135.00 135.98 1s6o n PRO 49 Ca -0.21 -2.03 0.00 0.00 -0.04 0.00 0.00 63.50 61.22 1s6o n PRO 49 Cb 0.55 -3.29 0.00 0.00 -0.04 0.00 0.00 33.50 30.72 1s6o n PRO 49 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1s6o n HIS 50 N 11.27 -2.57 0.14 0.54 8.25 -1.26 -4.91 115.22 126.69 1s6o n HIS 50 Ca 0.47 0.53 0.10 0.00 -0.26 0.00 0.00 57.72 58.56 1s6o n HIS 50 Cb 0.44 0.95 0.06 0.00 1.12 0.00 0.00 29.99 32.55 1s6o n HIS 50 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1s6o h LEU 51 N 0.00 0.00 -8.67 2.41 3.38 -1.83 -3.46 115.31 107.14 1s6o h LEU 51 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1s6o h LEU 51 Cb 0.00 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 40.51 1s6o h LEU 51 CO 0.00 0.09 -0.85 -0.51 0.09 0.00 0.00 178.44 177.26 1s6o s ILE 52 N -3.24 1.84 -0.30 1.22 1.10 -1.25 -4.73 121.20 115.84 1s6o s ILE 52 Ca 0.02 -1.43 0.00 0.00 -0.51 0.00 0.00 60.65 58.74 1s6o s ILE 52 Cb 0.08 -1.63 0.00 0.00 0.15 0.00 0.00 42.46 41.06 1s6o s ILE 52 CO 0.75 0.12 0.84 -1.20 -2.11 0.00 0.00 174.94 173.34 1s6o n SER 53 N 1.44 2.38 0.00 4.50 7.64 -1.26 -4.33 113.62 123.99 1s6o n SER 53 Ca -0.18 -1.98 0.00 0.00 1.01 0.00 0.00 58.87 57.72 1s6o n SER 53 Cb 0.53 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1s6o n SER 53 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1s6o n VAL 54 N 0.35 0.00 0.00 0.44 3.14 -1.26 -3.98 118.33 117.03 1s6o n VAL 54 Ca 0.00 0.00 -0.12 0.00 -2.96 0.00 0.00 64.34 61.26 1s6o n VAL 54 Cb 0.42 0.00 -0.14 0.00 -1.06 0.00 0.00 33.84 33.06 1s6o n VAL 54 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 1s6o h GLU 55 N 0.00 0.09 -0.96 1.45 4.81 -2.00 -3.38 114.58 114.60 1s6o h GLU 55 Ca 0.00 -0.15 0.18 0.00 -0.13 0.00 0.00 59.36 59.25 1s6o h GLU 55 Cb 0.00 0.06 -0.17 0.00 0.63 0.00 0.00 28.75 29.27 1s6o h GLU 55 CO 0.00 0.78 -0.29 0.93 -0.73 0.00 0.00 179.01 179.69 1s6o h GLU 56 N 0.02 -0.01 -0.51 1.92 5.08 -1.93 0.23 114.58 119.38 1s6o h GLU 56 Ca -0.28 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.13 1s6o h GLU 56 Cb 2.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 31.19 1s6o h GLU 56 CO 0.10 -0.01 -0.30 -0.12 -1.00 0.00 0.00 179.01 177.68 1s6o n MET 57 N -5.56 -0.23 -0.18 2.33 1.56 -1.26 -0.31 117.12 113.47 1s6o n MET 57 Ca 0.13 1.11 -0.08 0.00 -0.27 0.00 0.00 57.70 58.60 1s6o n MET 57 Cb 0.45 -1.65 0.02 0.00 2.15 0.00 0.00 33.22 34.19 1s6o n MET 57 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 1s6o h LYS 58 N 0.00 0.74 -0.33 2.12 3.11 -0.88 -2.78 116.57 118.56 1s6o h LYS 58 Ca 0.08 -0.11 0.05 0.00 -2.81 0.00 0.00 60.65 57.87 1s6o h LYS 58 Cb 0.21 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.29 1s6o h LYS 58 CO -0.48 0.61 0.22 0.87 -2.81 0.00 0.00 179.45 177.86 1s6o h LYS 59 N 0.69 0.20 -0.16 1.90 1.79 0.92 0.22 116.57 122.13 1s6o h LYS 59 Ca 0.18 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 1s6o h LYS 59 Cb 0.11 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 1s6o h LYS 59 CO -0.02 0.13 0.11 1.96 -1.08 0.00 0.00 179.45 180.54 1s6o h GLN 60 N 0.20 0.21 -0.22 3.15 1.08 -0.38 0.22 115.11 119.38 1s6o h GLN 60 Ca 0.14 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.35 1s6o h GLN 60 Cb 0.32 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1s6o h GLN 60 CO -0.02 0.15 0.09 0.82 -0.95 0.00 0.00 178.83 178.92 1s6o h ILE 61 N 0.21 0.97 -0.34 2.54 5.03 -1.11 -2.08 117.51 122.73 1s6o h ILE 61 Ca 0.06 -0.07 0.07 0.00 -0.12 0.00 0.00 64.86 64.80 1s6o h ILE 61 Cb -0.01 0.74 -0.07 0.00 -3.03 0.00 0.00 36.82 34.45 1s6o h ILE 61 CO -0.01 0.04 -0.13 -0.33 -0.68 0.00 0.00 178.15 177.03 1s6o h GLU 62 N 0.21 -0.06 0.00 2.37 5.08 -0.51 -1.17 114.58 120.50 1s6o h GLU 62 Ca 0.09 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1s6o h GLU 62 Cb 0.04 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1s6o h GLU 62 CO -0.08 -0.04 -0.00 0.00 -1.00 0.00 0.00 179.01 177.88 1s6o h ALA 63 N 1.23 1.14 0.00 3.43 0.00 -0.62 0.80 119.26 125.25 1s6o h ALA 63 Ca 0.17 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1s6o h ALA 63 Cb 0.33 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1s6o h ALA 63 CO -0.39 0.00 -0.06 0.52 0.00 0.00 0.00 179.25 179.32 1s6o h MET 64 N 0.00 0.00 0.00 0.00 2.86 -0.52 -3.46 114.93 113.82 1s6o h MET 64 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1s6o h MET 64 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1s6o h MET 64 CO 0.00 0.06 0.00 0.41 1.06 0.00 0.00 176.91 178.44 1s6o n GLY 65 N -0.86 0.99 3.11 8.32 0.00 0.23 -5.14 105.19 111.85 1s6o n GLY 65 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 1s6o n GLY 65 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s6o s PHE 66 N -1.86 -0.51 -0.06 1.61 0.08 -0.94 -5.06 117.98 111.24 1s6o s PHE 66 Ca 0.00 1.09 -0.30 0.00 0.12 0.00 0.00 56.93 57.85 1s6o s PHE 66 Cb 0.00 0.09 -0.06 0.00 -0.57 0.00 0.00 43.02 42.48 1s6o s PHE 66 CO 0.00 -0.36 1.84 -1.25 -0.10 0.00 0.00 175.22 175.35 1s6o s PRO 67 N 2.10 4.00 0.06 0.24 0.04 -1.26 -4.05 135.00 136.13 1s6o s PRO 67 Ca -0.03 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.29 1s6o s PRO 67 Cb -0.11 -4.11 0.00 0.00 0.04 0.00 0.00 34.50 30.32 1s6o s PRO 67 CO -0.10 -1.09 0.03 0.00 0.04 0.00 0.00 177.00 175.88 1s6o n ALA 68 N 7.96 0.08 -3.53 8.56 0.00 -1.26 -3.46 120.51 128.87 1s6o n ALA 68 Ca 0.20 -0.26 -0.14 0.00 0.00 0.00 0.00 53.44 53.24 1s6o n ALA 68 Cb 0.43 0.12 -0.05 0.00 0.00 0.00 0.00 19.45 19.95 1s6o n ALA 68 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1s6o s PHE 69 N -0.65 -0.51 -0.15 0.00 2.19 -0.21 -4.91 117.98 113.74 1s6o s PHE 69 Ca 0.02 0.75 0.01 0.00 0.33 0.00 0.00 56.93 58.05 1s6o s PHE 69 Cb -0.00 0.46 0.01 0.00 -1.31 0.00 0.00 43.02 42.17 1s6o s PHE 69 CO 0.01 -0.54 -0.19 0.54 1.83 0.00 0.00 175.22 176.88 1s6o s VAL 70 N -1.70 2.29 0.00 3.12 0.11 -1.26 -0.64 120.40 122.32 1s6o s VAL 70 Ca -0.04 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.11 1s6o s VAL 70 Cb -0.00 -1.94 0.00 0.00 -1.53 0.00 0.00 36.38 32.90 1s6o s VAL 70 CO 0.02 0.53 0.12 0.29 -3.33 0.00 0.00 175.10 172.74 1s6o n LYS 71 N 4.17 0.00 -3.56 1.54 5.02 -0.76 -4.96 118.16 119.61 1s6o n LYS 71 Ca -0.20 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 55.96 1s6o n LYS 71 Cb 0.51 -0.61 -0.05 0.00 -0.02 0.00 0.00 35.03 34.86 1s6o n LYS 71 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1s6o s LYS 72 N -0.25 1.07 -0.27 1.97 2.20 -1.26 -5.08 119.74 118.13 1s6o s LYS 72 Ca 0.00 -0.30 -0.03 0.00 -0.36 0.00 0.00 55.97 55.28 1s6o s LYS 72 Cb 0.00 0.49 0.15 0.00 -1.51 0.00 0.00 37.83 36.96 1s6o s LYS 72 CO 0.00 -0.40 0.50 -1.50 -0.36 0.00 0.00 175.35 173.58 1s6o s ILE 73 N -2.72 -0.80 0.06 5.43 1.10 -1.26 -4.14 121.20 118.87 1s6o s ILE 73 Ca -0.04 -0.01 -0.20 0.00 -0.51 0.00 0.00 60.65 59.89 1s6o s ILE 73 Cb -0.00 -0.89 0.05 0.00 0.15 0.00 0.00 42.46 41.76 1s6o s ILE 73 CO -0.04 -0.04 0.48 -1.61 -2.11 0.00 0.00 174.94 171.62 1s6o s GLU 74 N 2.71 1.02 0.00 3.50 2.02 -1.26 -5.04 118.70 121.65 1s6o s GLU 74 Ca 0.13 -0.34 0.00 0.00 0.02 0.00 0.00 54.97 54.78 1s6o s GLU 74 Cb -0.15 0.46 0.00 0.00 0.10 0.00 0.00 34.13 34.54 1s6o s GLU 74 CO -0.18 -0.37 0.00 0.41 0.02 0.00 0.00 175.26 175.14 1s6o n GLY 75 N 0.31 0.61 2.78 -1.39 0.00 -1.26 -4.95 105.19 101.29 1s6o n GLY 75 Ca -0.18 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1s6o n GLY 75 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19