#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 0.00 -3.80 1.61 0.28 -1.26 -4.51 120.64 112.96 1s6o n GLU 2 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.88 1s6o n GLU 2 Cb 0.00 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.77 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 -1.90 0.05 0.00 3.84 1.01 0.55 -4.93 120.40 119.03 1s6o s VAL 3 Ca 0.00 -0.41 -0.26 0.00 0.00 0.00 0.00 61.98 61.31 1s6o s VAL 3 Cb 0.00 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 1s6o s VAL 3 CO 0.00 -0.23 0.80 -0.69 0.00 0.00 0.00 175.10 174.98 1s6o s VAL 4 N -0.95 4.85 0.21 2.92 1.01 -1.26 -1.56 120.40 125.62 1s6o s VAL 4 Ca -0.10 1.68 0.10 0.00 0.00 0.00 0.00 61.98 63.65 1s6o s VAL 4 Cb -0.05 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.14 1s6o s VAL 4 CO 0.02 0.28 -0.18 -1.48 0.00 0.00 0.00 175.10 173.74 1s6o s LEU 5 N 0.45 2.52 -0.16 3.92 -0.00 0.28 -4.65 118.68 121.04 1s6o s LEU 5 Ca 0.41 -0.96 0.01 0.00 -0.00 0.00 0.00 54.13 53.60 1s6o s LEU 5 Cb -0.20 -0.89 0.01 0.00 -0.00 0.00 0.00 46.19 45.11 1s6o s LEU 5 CO 0.23 -0.04 -0.20 -0.75 -0.00 0.00 0.00 176.35 175.59 1s6o s LYS 6 N -3.23 3.06 0.04 1.48 2.20 -1.25 -1.34 119.74 120.70 1s6o s LYS 6 Ca 0.22 -0.82 0.08 0.00 -0.36 0.00 0.00 55.97 55.09 1s6o s LYS 6 Cb -0.04 -2.53 -0.03 0.00 -1.51 0.00 0.00 37.83 33.72 1s6o s LYS 6 CO 0.09 -0.07 -0.23 0.00 -0.36 0.00 0.00 175.35 174.79 1s6o s MET 7 N 0.97 1.55 -0.02 4.03 0.23 0.45 -0.82 119.30 125.69 1s6o s MET 7 Ca -0.03 -1.01 -0.22 0.00 -1.03 0.00 0.00 55.69 53.40 1s6o s MET 7 Cb -0.15 -1.69 -0.05 0.00 -1.53 0.00 0.00 34.83 31.41 1s6o s MET 7 CO -0.05 0.43 0.64 0.15 -2.03 0.00 0.00 175.02 174.16 1s6o s LYS 8 N -1.20 4.38 -0.58 3.16 -0.14 0.12 -0.62 119.74 124.86 1s6o s LYS 8 Ca 0.09 0.79 0.06 0.00 -1.36 0.00 0.00 55.97 55.56 1s6o s LYS 8 Cb -0.09 -3.38 0.29 0.00 -1.68 0.00 0.00 37.83 32.96 1s6o s LYS 8 CO 0.02 0.26 0.79 0.28 -0.76 0.00 0.00 175.35 175.94 1s6o n VAL 9 N 3.10 2.14 -1.99 3.17 0.31 0.66 -0.52 118.33 125.20 1s6o n VAL 9 Ca -0.05 -5.19 -0.33 0.00 -0.01 0.00 0.00 64.34 58.76 1s6o n VAL 9 Cb 0.51 -1.73 0.02 0.00 -0.91 0.00 0.00 33.84 31.73 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 -2.69 3.14 0.00 5.55 2.02 -1.15 -3.99 118.70 121.59 1s6o s GLU 10 Ca 0.43 1.35 0.00 0.00 0.02 0.00 0.00 54.97 56.77 1s6o s GLU 10 Cb 0.21 -2.00 0.00 0.00 0.10 0.00 0.00 34.13 32.44 1s6o s GLU 10 CO -0.07 -0.97 0.00 0.41 0.02 0.00 0.00 175.26 174.65 1s6o n GLY 11 N -0.58 2.73 3.71 -1.39 0.00 -1.26 -4.12 105.19 104.27 1s6o n GLY 11 Ca 0.10 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 1s6o n GLY 11 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1s6o s MET 12 N 0.00 4.19 0.05 1.61 -1.94 -1.26 -5.00 119.30 116.96 1s6o s MET 12 Ca 0.00 2.41 0.04 0.00 -1.71 0.00 0.00 55.69 56.43 1s6o s MET 12 Cb 0.00 -3.33 -0.03 0.00 2.01 0.00 0.00 34.83 33.48 1s6o s MET 12 CO 0.00 -0.69 -0.11 -0.08 -0.01 0.00 0.00 175.02 174.13 1s6o s THR 13 N 1.80 0.85 0.33 2.05 -1.32 -1.26 -4.79 115.64 113.29 1s6o s THR 13 Ca 0.73 -1.13 0.00 0.00 -1.21 0.00 0.00 61.69 60.08 1s6o s THR 13 Cb -0.44 -0.84 0.00 0.00 -1.51 0.00 0.00 72.50 69.71 1s6o s THR 13 CO 0.32 -0.25 0.00 0.00 -2.21 0.00 0.00 174.62 172.48 1s6o s HIS 15 N -3.06 1.42 0.37 0.00 2.46 -1.26 -3.74 115.29 111.48 1s6o s HIS 15 Ca 0.00 1.65 0.00 0.00 0.47 0.00 0.00 55.06 57.18 1s6o s HIS 15 Cb 0.00 -3.58 0.00 0.00 -0.13 0.00 0.00 32.58 28.87 1s6o s HIS 15 CO 0.00 -1.14 0.00 0.43 -2.47 0.00 0.00 174.74 171.56 1s6o n SER 16 N 17.66 -2.04 -3.70 9.88 7.64 -1.26 -4.97 113.62 136.82 1s6o n SER 16 Ca 0.43 0.67 -0.42 0.00 1.01 0.00 0.00 58.87 60.56 1s6o n SER 16 Cb 0.46 2.02 -0.01 0.00 -1.01 0.00 0.00 64.21 65.67 1s6o n SER 16 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1s6o n THR 18 N 5.31 0.00 -0.23 0.00 -2.24 -1.26 -4.83 114.28 111.03 1s6o n THR 18 Ca 0.52 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 62.34 1s6o n THR 18 Cb 0.39 -0.27 0.30 0.00 -2.10 0.00 0.00 70.33 68.65 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 0.78 -0.18 3.42 0.87 -1.95 0.48 113.55 116.97 1s6o h SER 19 Ca 0.00 -0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.61 1s6o h SER 19 Cb 0.00 -0.17 -0.07 0.00 -0.44 0.00 0.00 62.40 61.73 1s6o h SER 19 CO 0.00 0.52 -0.28 0.74 -0.53 0.00 0.00 176.83 177.27 1s6o h THR 20 N 0.89 0.34 -0.09 2.23 2.02 -1.93 0.24 112.91 116.62 1s6o h THR 20 Ca 0.33 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.52 1s6o h THR 20 Cb 0.17 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 1s6o h THR 20 CO -0.11 0.00 0.02 0.40 0.37 0.00 0.00 175.52 176.20 1s6o h ILE 21 N -0.33 0.98 0.17 3.11 5.03 -0.50 0.11 117.51 126.08 1s6o h ILE 21 Ca 0.11 -0.02 -0.00 0.00 -0.12 0.00 0.00 64.86 64.83 1s6o h ILE 21 Cb 0.50 0.90 -0.02 0.00 -3.03 0.00 0.00 36.82 35.18 1s6o h ILE 21 CO -0.36 0.01 -0.26 -0.33 -0.68 0.00 0.00 178.15 176.53 1s6o h GLU 22 N 0.07 -0.43 -0.86 2.37 5.08 -0.42 0.84 114.58 121.22 1s6o h GLU 22 Ca 0.04 0.03 0.17 0.00 -1.00 0.00 0.00 59.36 58.60 1s6o h GLU 22 Cb 0.02 0.10 -0.11 0.00 0.50 0.00 0.00 28.75 29.27 1s6o h GLU 22 CO -0.04 -0.29 0.41 0.78 -1.00 0.00 0.00 179.01 178.87 1s6o h GLY 23 N -0.45 1.42 0.51 -3.84 0.00 -0.52 0.33 103.07 100.52 1s6o h GLY 23 Ca -0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 1s6o h GLY 23 CO -0.08 -0.13 -0.24 1.70 0.00 0.00 0.00 176.54 177.79 1s6o h LYS 24 N 0.53 -0.66 -0.92 4.80 3.64 -0.49 -3.21 116.57 120.27 1s6o h LYS 24 Ca 0.50 0.04 0.16 0.00 -1.27 0.00 0.00 60.65 60.08 1s6o h LYS 24 Cb 0.81 0.15 -0.10 0.00 -0.41 0.00 0.00 32.23 32.68 1s6o h LYS 24 CO -0.43 -0.44 0.51 0.82 -2.27 0.00 0.00 179.45 177.65 1s6o h ILE 25 N -1.06 0.74 -0.07 2.00 5.03 -0.68 -0.20 117.51 123.27 1s6o h ILE 25 Ca -0.07 -0.24 0.02 0.00 -0.12 0.00 0.00 64.86 64.45 1s6o h ILE 25 Cb 0.52 -0.03 -0.00 0.00 -3.03 0.00 0.00 36.82 34.28 1s6o h ILE 25 CO 0.11 0.13 0.23 1.23 -0.68 0.00 0.00 178.15 179.17 1s6o h GLY 26 N 0.70 0.00 0.86 5.37 0.00 -0.40 0.15 103.07 109.76 1s6o h GLY 26 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.84 1s6o h GLY 26 CO -0.36 0.00 -0.88 0.28 0.00 0.00 0.00 176.54 175.58 1s6o n LYS 27 N -3.18 0.33 -2.01 4.80 5.02 -0.09 -4.86 118.16 118.18 1s6o n LYS 27 Ca -0.01 0.04 -0.41 0.00 -2.02 0.00 0.00 58.31 55.91 1s6o n LYS 27 Cb 0.31 -1.66 -0.02 0.00 -0.02 0.00 0.00 35.03 33.63 1s6o n LYS 27 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1s6o s LEU 28 N -4.22 4.38 -0.44 -0.35 2.01 0.53 -4.88 118.68 115.71 1s6o s LEU 28 Ca 0.04 2.65 -0.34 0.00 0.01 0.00 0.00 54.13 56.49 1s6o s LEU 28 Cb 0.13 -3.62 -0.12 0.00 0.01 0.00 0.00 46.19 42.59 1s6o s LEU 28 CO 0.77 -0.72 2.27 0.00 1.01 0.00 0.00 176.35 179.68 1s6o n GLN 29 N 2.62 0.91 0.00 1.70 10.64 -1.26 -1.30 117.38 130.68 1s6o n GLN 29 Ca 0.08 0.21 0.00 0.00 -1.83 0.00 0.00 57.00 55.46 1s6o n GLN 29 Cb 0.40 -2.43 0.00 0.00 -0.86 0.00 0.00 30.24 27.35 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 6.53 0.64 3.74 2.61 0.00 -1.26 -3.80 105.19 113.64 1s6o n GLY 30 Ca 0.44 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.01 4.23 -0.24 1.61 1.01 -0.42 -3.32 120.40 122.26 1s6o s VAL 31 Ca 0.00 2.02 -0.03 0.00 0.00 0.00 0.00 61.98 63.97 1s6o s VAL 31 Cb 0.00 -4.29 -0.14 0.00 0.00 0.00 0.00 36.38 31.95 1s6o s VAL 31 CO 0.00 0.40 -0.24 0.00 0.00 0.00 0.00 175.10 175.25 1s6o n GLN 32 N 2.13 0.56 -3.57 2.72 1.13 0.37 -4.86 117.38 115.86 1s6o n GLN 32 Ca 0.00 0.17 -0.11 0.00 -1.94 0.00 0.00 57.00 55.12 1s6o n GLN 32 Cb 0.48 -1.43 -0.03 0.00 0.11 0.00 0.00 30.24 29.37 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 -2.46 1.36 -0.05 -1.09 3.52 -1.22 -5.00 118.95 114.02 1s6o s ARG 33 Ca -0.32 -0.65 -0.06 0.00 -0.13 0.00 0.00 55.73 54.57 1s6o s ARG 33 Cb 0.10 0.57 0.01 0.00 -1.56 0.00 0.00 34.95 34.07 1s6o s ARG 33 CO 0.50 -0.59 0.16 -1.50 -0.81 0.00 0.00 175.30 173.05 1s6o s ILE 34 N -3.81 0.01 -0.11 4.11 2.07 -1.26 -1.03 121.20 121.19 1s6o s ILE 34 Ca 0.04 -0.09 0.00 0.00 -1.41 0.00 0.00 60.65 59.19 1s6o s ILE 34 Cb -0.02 -0.25 0.02 0.00 0.13 0.00 0.00 42.46 42.34 1s6o s ILE 34 CO -0.08 -0.05 -0.08 -0.54 -1.91 0.00 0.00 174.94 172.28 1s6o s LYS 35 N -0.11 1.56 -0.36 3.50 3.01 0.41 -4.99 119.74 122.75 1s6o s LYS 35 Ca -0.02 -0.28 -0.08 0.00 -1.01 0.00 0.00 55.97 54.57 1s6o s LYS 35 Cb -0.02 -1.56 0.04 0.00 -1.01 0.00 0.00 37.83 35.28 1s6o s LYS 35 CO 0.00 -0.22 0.16 0.08 0.51 0.00 0.00 175.35 175.89 1s6o s VAL 36 N 1.53 4.11 -0.87 3.17 1.01 -1.26 -0.37 120.40 127.72 1s6o s VAL 36 Ca 0.02 -1.10 -0.19 0.00 0.00 0.00 0.00 61.98 60.71 1s6o s VAL 36 Cb -0.13 -3.35 0.13 0.00 0.00 0.00 0.00 36.38 33.03 1s6o s VAL 36 CO -0.06 -0.26 1.05 -0.55 0.00 0.00 0.00 175.10 175.27 1s6o s SER 37 N 1.57 6.57 1.09 3.32 0.15 0.31 -4.97 113.70 121.75 1s6o s SER 37 Ca 0.00 -1.97 -0.14 0.00 0.70 0.00 0.00 55.95 54.54 1s6o s SER 37 Cb -0.20 -2.37 0.18 0.00 -1.71 0.00 0.00 66.02 61.92 1s6o s SER 37 CO 0.04 -1.05 0.66 -0.11 1.20 0.00 0.00 173.24 173.97 1s6o n LEU 38 N 6.38 -0.82 0.00 3.45 -0.00 -1.26 -1.22 117.00 123.53 1s6o n LEU 38 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.19 1s6o n LEU 38 Cb 0.48 -1.20 0.00 0.00 -0.00 0.00 0.00 43.42 42.70 1s6o n LEU 38 CO 0.50 -3.11 0.00 0.47 -0.00 0.00 0.00 177.39 175.25 1s6o n ASP 39 N -3.41 0.00 0.20 1.96 8.00 -1.26 -4.21 116.55 117.84 1s6o n ASP 39 Ca 0.04 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.58 1s6o n ASP 39 Cb 0.56 0.00 0.45 0.00 -0.02 0.00 0.00 41.12 42.11 1s6o n ASP 39 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1s6o h ASN 40 N 0.00 0.03 -1.16 -2.24 -0.73 -1.97 -3.46 115.58 106.05 1s6o h ASN 40 Ca 0.00 -0.01 -0.24 0.00 1.87 0.00 0.00 56.30 57.92 1s6o h ASN 40 Cb 0.00 -0.01 -0.05 0.00 0.27 0.00 0.00 38.32 38.53 1s6o h ASN 40 CO 0.00 0.26 -0.26 0.00 -0.37 0.00 0.00 177.43 177.06 1s6o n GLN 41 N -4.25 -0.89 -4.62 6.67 6.02 -0.35 -4.99 117.38 114.96 1s6o n GLN 41 Ca -0.02 0.74 -0.28 0.00 -0.01 0.00 0.00 57.00 57.42 1s6o n GLN 41 Cb 0.29 -4.82 -0.17 0.00 1.02 0.00 0.00 30.24 26.57 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 -3.84 2.26 0.05 -1.09 2.56 -0.75 -0.25 118.70 117.64 1s6o s GLU 42 Ca 0.00 -0.59 0.08 0.00 0.00 0.00 0.00 54.97 54.46 1s6o s GLU 42 Cb 0.00 -1.86 -0.03 0.00 2.00 0.00 0.00 34.13 34.24 1s6o s GLU 42 CO 0.00 0.00 -0.21 0.00 -0.56 0.00 0.00 175.26 174.49 1s6o s ALA 43 N 0.80 1.83 -0.15 6.30 0.00 0.21 -0.53 121.76 130.22 1s6o s ALA 43 Ca -0.11 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.75 1s6o s ALA 43 Cb -0.16 -0.35 0.02 0.00 0.00 0.00 0.00 23.12 22.64 1s6o s ALA 43 CO 0.01 0.41 -0.14 0.99 0.00 0.00 0.00 175.76 177.03 1s6o s THR 44 N -0.84 1.55 0.16 0.00 2.01 0.51 -0.41 115.64 118.62 1s6o s THR 44 Ca 0.08 -0.62 0.07 0.00 0.31 0.00 0.00 61.69 61.53 1s6o s THR 44 Cb -0.09 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.92 1s6o s THR 44 CO 0.02 0.46 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.63 1s6o s ILE 45 N 1.47 1.52 -0.09 1.82 1.01 -0.45 -0.45 121.20 126.03 1s6o s ILE 45 Ca 0.04 -1.98 0.02 0.00 0.00 0.00 0.00 60.65 58.73 1s6o s ILE 45 Cb -0.13 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 40.54 1s6o s ILE 45 CO -0.10 -0.52 -0.16 0.54 0.00 0.00 0.00 174.94 174.70 1s6o s VAL 46 N -2.62 1.49 0.34 2.92 0.11 -0.20 -0.56 120.40 121.89 1s6o s VAL 46 Ca 0.16 -0.67 -0.13 0.00 -2.93 0.00 0.00 61.98 58.42 1s6o s VAL 46 Cb -0.02 -1.34 0.03 0.00 -1.53 0.00 0.00 36.38 33.51 1s6o s VAL 46 CO 0.04 0.44 0.66 -0.72 -3.33 0.00 0.00 175.10 172.19 1s6o s TYR 47 N 0.75 0.35 0.05 1.54 -0.85 -0.60 -0.48 117.35 118.10 1s6o s TYR 47 Ca -0.12 -0.83 0.06 0.00 -0.52 0.00 0.00 57.07 55.66 1s6o s TYR 47 Cb -0.16 0.50 -0.02 0.00 0.38 0.00 0.00 41.96 42.66 1s6o s TYR 47 CO 0.02 -1.33 -0.18 -1.14 -1.52 0.00 0.00 175.55 171.40 1s6o s GLN 48 N -2.97 1.17 -1.09 -3.49 0.74 -1.21 -0.33 119.66 112.48 1s6o s GLN 48 Ca 0.20 -0.87 -0.21 0.00 0.05 0.00 0.00 55.36 54.52 1s6o s GLN 48 Cb -0.03 -1.24 -0.08 0.00 1.10 0.00 0.00 33.01 32.75 1s6o s GLN 48 CO 0.13 0.31 1.93 -0.35 -0.55 0.00 0.00 175.29 176.76 1s6o n PRO 49 N 1.82 1.90 0.12 1.67 -0.04 -1.26 -3.68 135.00 135.52 1s6o n PRO 49 Ca -0.18 -2.39 0.00 0.00 -0.04 0.00 0.00 63.50 60.89 1s6o n PRO 49 Cb 0.54 -3.39 0.00 0.00 -0.04 0.00 0.00 33.50 30.61 1s6o n PRO 49 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1s6o n HIS 50 N 10.55 -3.09 0.10 0.54 -0.00 -1.26 -4.92 115.22 117.14 1s6o n HIS 50 Ca 0.48 0.73 0.03 0.00 0.46 0.00 0.00 57.72 59.42 1s6o n HIS 50 Cb 0.44 1.95 -0.02 0.00 -0.12 0.00 0.00 29.99 32.24 1s6o n HIS 50 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 1s6o h LEU 51 N 0.00 0.00 -8.54 0.27 3.38 -1.83 -3.46 115.31 105.12 1s6o h LEU 51 Ca 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 1s6o h LEU 51 Cb 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 40.49 1s6o h LEU 51 CO 0.00 0.46 -0.84 -0.51 0.09 0.00 0.00 178.44 177.64 1s6o s ILE 52 N -3.00 1.65 -0.63 1.22 1.10 -1.25 -4.73 121.20 115.57 1s6o s ILE 52 Ca 0.01 -1.20 0.00 0.00 -0.51 0.00 0.00 60.65 58.94 1s6o s ILE 52 Cb 0.08 -1.44 0.00 0.00 0.15 0.00 0.00 42.46 41.25 1s6o s ILE 52 CO 0.77 0.19 0.53 -1.20 -2.11 0.00 0.00 174.94 173.13 1s6o n SER 53 N 1.82 1.36 0.00 4.50 7.64 -1.26 -4.48 113.62 123.20 1s6o n SER 53 Ca -0.17 -1.56 0.00 0.00 1.01 0.00 0.00 58.87 58.15 1s6o n SER 53 Cb 0.53 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 1s6o n SER 53 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1s6o n VAL 54 N 0.30 0.00 -0.07 0.44 0.31 -1.26 -4.02 118.33 114.03 1s6o n VAL 54 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 1s6o n VAL 54 Cb 0.27 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 33.05 1s6o n VAL 54 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1s6o n GLU 55 N 0.00 0.68 -0.31 5.55 4.07 -1.26 -4.26 120.64 125.11 1s6o n GLU 55 Ca 0.00 0.16 -0.01 0.00 -0.06 0.00 0.00 57.16 57.24 1s6o n GLU 55 Cb 0.00 -1.63 0.04 0.00 -0.06 0.00 0.00 31.44 29.80 1s6o n GLU 55 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1s6o h GLU 56 N 0.01 -0.05 -0.89 5.31 5.08 -1.94 -0.03 114.58 122.08 1s6o h GLU 56 Ca -0.46 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.00 1s6o h GLU 56 Cb 2.07 0.01 -0.12 0.00 0.50 0.00 0.00 28.75 31.22 1s6o h GLU 56 CO 0.03 -0.03 -0.45 -0.12 -1.00 0.00 0.00 179.01 177.43 1s6o n MET 57 N -5.48 -0.32 -0.03 2.33 1.56 -1.26 -0.54 117.12 113.38 1s6o n MET 57 Ca 0.09 1.35 -0.16 0.00 -0.27 0.00 0.00 57.70 58.70 1s6o n MET 57 Cb 0.39 -1.99 -0.08 0.00 2.15 0.00 0.00 33.22 33.69 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 0.58 -0.88 2.12 3.11 -1.54 -3.16 116.57 116.80 1s6o h LYS 58 Ca 0.21 -0.47 0.26 0.00 -2.81 0.00 0.00 60.65 57.83 1s6o h LYS 58 Cb 0.43 0.10 -0.04 0.00 -1.00 0.00 0.00 32.23 31.72 1s6o h LYS 58 CO -0.85 1.10 0.66 0.87 -2.81 0.00 0.00 179.45 178.42 1s6o h LYS 59 N 0.22 0.00 -0.50 1.90 6.56 0.54 0.28 116.57 125.56 1s6o h LYS 59 Ca -0.04 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.52 1s6o h LYS 59 Cb 1.20 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.84 1s6o h LYS 59 CO 0.12 0.00 0.17 -0.56 -2.06 0.00 0.00 179.45 177.12 1s6o h GLN 60 N 0.00 0.73 -0.15 3.15 3.07 -0.78 0.49 115.11 121.63 1s6o h GLN 60 Ca 0.42 -0.12 -0.06 0.00 0.09 0.00 0.00 58.65 58.98 1s6o h GLN 60 Cb 1.73 -0.13 -0.00 0.00 0.08 0.00 0.00 27.48 29.16 1s6o h GLN 60 CO -0.00 0.63 -0.14 0.82 0.09 0.00 0.00 178.83 180.22 1s6o h ILE 61 N 0.72 1.34 -0.48 1.86 5.03 -0.60 -2.43 117.51 122.96 1s6o h ILE 61 Ca 0.17 -1.29 0.10 0.00 -0.12 0.00 0.00 64.86 63.71 1s6o h ILE 61 Cb 0.19 1.86 -0.09 0.00 -3.03 0.00 0.00 36.82 35.75 1s6o h ILE 61 CO -0.01 0.38 -0.06 -0.33 -0.68 0.00 0.00 178.15 177.45 1s6o h GLU 62 N -0.01 0.05 0.00 2.37 5.08 -0.88 0.03 114.58 121.21 1s6o h GLU 62 Ca 0.02 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1s6o h GLU 62 Cb 0.67 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 1s6o h GLU 62 CO 0.04 0.03 -0.00 0.00 -1.00 0.00 0.00 179.01 178.08 1s6o h ALA 63 N 1.46 1.01 0.00 3.43 0.00 -0.80 0.56 119.26 124.92 1s6o h ALA 63 Ca 0.24 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1s6o h ALA 63 Cb 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1s6o h ALA 63 CO -0.45 0.00 -0.17 0.52 0.00 0.00 0.00 179.25 179.15 1s6o h MET 64 N 0.00 0.00 0.00 0.00 2.86 -0.47 -3.47 114.93 113.85 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 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1s6o h MET 64 CO 0.00 0.17 0.00 0.41 1.06 0.00 0.00 176.91 178.55 1s6o n GLY 65 N -0.91 2.04 3.65 8.32 0.00 0.19 -5.11 105.19 113.37 1s6o n GLY 65 Ca -0.02 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.26 3.29 0.00 1.61 0.08 -1.23 -4.98 117.98 116.48 1s6o s PHE 66 Ca 0.00 1.34 -0.30 0.00 0.12 0.00 0.00 56.93 58.09 1s6o s PHE 66 Cb 0.00 -3.34 -0.07 0.00 -0.57 0.00 0.00 43.02 39.04 1s6o s PHE 66 CO 0.00 -0.54 1.79 -1.25 -0.10 0.00 0.00 175.22 175.12 1s6o s PRO 67 N 3.25 4.17 0.48 0.24 0.04 -1.26 -3.89 135.00 138.03 1s6o s PRO 67 Ca 0.43 2.39 0.02 0.00 0.04 0.00 0.00 61.00 63.88 1s6o s PRO 67 Cb -0.14 -4.00 -0.02 0.00 0.04 0.00 0.00 34.50 30.37 1s6o s PRO 67 CO 0.09 -0.88 0.04 0.00 0.04 0.00 0.00 177.00 176.28 1s6o s ALA 68 N 4.02 3.75 0.12 8.56 0.00 -1.26 -2.91 121.76 134.04 1s6o s ALA 68 Ca 0.80 -0.70 -0.22 0.00 0.00 0.00 0.00 51.96 51.84 1s6o s ALA 68 Cb -0.38 0.23 0.06 0.00 0.00 0.00 0.00 23.12 23.03 1s6o s ALA 68 CO 0.35 -0.11 0.54 0.12 0.00 0.00 0.00 175.76 176.66 1s6o s PHE 69 N -2.96 -0.45 -0.21 0.00 2.19 0.32 -4.91 117.98 111.97 1s6o s PHE 69 Ca 0.12 0.29 -0.07 0.00 0.33 0.00 0.00 56.93 57.60 1s6o s PHE 69 Cb 0.02 0.45 -0.04 0.00 -1.31 0.00 0.00 43.02 42.14 1s6o s PHE 69 CO 0.07 -0.77 0.06 0.08 1.83 0.00 0.00 175.22 176.49 1s6o s VAL 70 N -3.42 4.54 -0.15 3.12 1.01 -1.26 0.16 120.40 124.40 1s6o s VAL 70 Ca -0.00 -0.11 -0.15 0.00 0.00 0.00 0.00 61.98 61.72 1s6o s VAL 70 Cb -0.00 -3.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 1s6o s VAL 70 CO -0.10 0.41 -0.29 0.29 0.00 0.00 0.00 175.10 175.41 1s6o n LYS 71 N 4.06 0.44 -2.84 2.72 5.02 -0.45 -4.90 118.16 122.21 1s6o n LYS 71 Ca -0.16 0.18 -0.20 0.00 -2.02 0.00 0.00 58.31 56.11 1s6o n LYS 71 Cb 0.52 -1.29 0.02 0.00 -0.02 0.00 0.00 35.03 34.27 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 -2.60 2.72 0.32 1.97 2.20 0.00 -4.96 119.74 119.39 1s6o s LYS 72 Ca -0.24 -0.91 -0.07 0.00 -0.36 0.00 0.00 55.97 54.38 1s6o s LYS 72 Cb 0.03 -2.60 0.01 0.00 -1.51 0.00 0.00 37.83 33.76 1s6o s LYS 72 CO 0.36 -0.48 0.51 -1.50 -0.36 0.00 0.00 175.35 173.88 1s6o s ILE 73 N -2.57 0.00 1.09 5.43 2.07 -1.26 -3.94 121.20 122.02 1s6o s ILE 73 Ca 0.55 -1.47 -0.18 0.00 -1.41 0.00 0.00 60.65 58.14 1s6o s ILE 73 Cb -0.10 -2.54 0.25 0.00 0.13 0.00 0.00 42.46 40.20 1s6o s ILE 73 CO 0.36 0.00 1.24 -1.83 -1.91 0.00 0.00 174.94 172.80 1s6o s GLU 74 N -3.27 -0.40 0.00 3.50 4.04 -1.26 -4.62 118.70 116.69 1s6o s GLU 74 Ca 0.26 -0.33 0.00 0.00 0.04 0.00 0.00 54.97 54.94 1s6o s GLU 74 Cb -0.01 -1.72 0.00 0.00 0.02 0.00 0.00 34.13 32.42 1s6o s GLU 74 CO 0.15 -3.12 0.00 0.41 -1.84 0.00 0.00 175.26 170.86 1s6o n GLY 75 N -2.51 2.60 0.00 -3.83 0.00 -1.26 -5.10 105.19 95.09 1s6o n GLY 75 Ca 0.15 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1s6o n GLY 75 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36