#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 0.63 -4.29 1.61 0.28 -1.26 -4.31 120.64 113.30 1s6o n GLU 2 Ca 0.00 0.23 -0.19 0.00 -0.16 0.00 0.00 57.16 57.04 1s6o n GLU 2 Cb 0.00 -1.64 -0.13 0.00 1.43 0.00 0.00 31.44 31.10 1s6o n GLU 2 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1s6o s VAL 3 N -0.24 1.05 0.26 3.84 0.11 0.27 -4.86 120.40 120.83 1s6o s VAL 3 Ca 0.77 -1.04 -0.29 0.00 -2.93 0.00 0.00 61.98 58.49 1s6o s VAL 3 Cb -0.99 -0.97 -0.09 0.00 -1.53 0.00 0.00 36.38 32.80 1s6o s VAL 3 CO 0.54 -0.06 0.98 -0.69 -3.33 0.00 0.00 175.10 172.54 1s6o s VAL 4 N -0.94 3.94 0.01 2.04 1.01 -1.26 -1.26 120.40 123.94 1s6o s VAL 4 Ca 0.00 1.91 0.03 0.00 0.00 0.00 0.00 61.98 63.93 1s6o s VAL 4 Cb -0.08 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 1s6o s VAL 4 CO 0.01 0.42 -0.09 -0.22 0.00 0.00 0.00 175.10 175.22 1s6o s LEU 5 N -1.35 2.07 -0.19 3.92 1.98 0.57 -4.82 118.68 120.85 1s6o s LEU 5 Ca 0.43 -0.25 -0.04 0.00 -2.89 0.00 0.00 54.13 51.39 1s6o s LEU 5 Cb -0.27 -0.43 -0.02 0.00 0.66 0.00 0.00 46.19 46.13 1s6o s LEU 5 CO 0.33 0.06 -0.04 -0.75 -1.89 0.00 0.00 176.35 174.06 1s6o s LYS 6 N -0.50 3.51 0.20 1.98 2.20 -1.26 -0.53 119.74 125.33 1s6o s LYS 6 Ca 0.02 -0.58 0.11 0.00 -0.36 0.00 0.00 55.97 55.15 1s6o s LYS 6 Cb -0.05 -2.98 -0.04 0.00 -1.51 0.00 0.00 37.83 33.25 1s6o s LYS 6 CO 0.00 -0.01 -0.18 0.00 -0.36 0.00 0.00 175.35 174.80 1s6o s MET 7 N 1.02 1.74 -0.10 4.03 0.23 0.40 -3.08 119.30 123.53 1s6o s MET 7 Ca 0.01 -1.46 -0.15 0.00 -1.03 0.00 0.00 55.69 53.06 1s6o s MET 7 Cb -0.15 -1.95 -0.05 0.00 -1.53 0.00 0.00 34.83 31.15 1s6o s MET 7 CO 0.01 0.40 0.37 0.15 -2.03 0.00 0.00 175.02 173.92 1s6o s LYS 8 N -2.83 4.14 -0.66 3.16 -0.14 0.29 -0.55 119.74 123.15 1s6o s LYS 8 Ca 0.23 0.27 0.05 0.00 -1.36 0.00 0.00 55.97 55.16 1s6o s LYS 8 Cb -0.08 -3.36 0.30 0.00 -1.68 0.00 0.00 37.83 33.02 1s6o s LYS 8 CO 0.12 0.37 0.96 0.28 -0.76 0.00 0.00 175.35 176.33 1s6o n VAL 9 N 3.01 3.14 -1.07 3.17 0.31 0.10 -1.22 118.33 125.77 1s6o n VAL 9 Ca -0.12 -5.50 -0.29 0.00 -0.01 0.00 0.00 64.34 58.42 1s6o n VAL 9 Cb 0.52 -1.71 0.16 0.00 -0.91 0.00 0.00 33.84 31.90 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 -3.13 0.76 0.00 5.55 0.41 -1.23 -3.91 118.70 117.16 1s6o s GLU 10 Ca 0.44 0.81 0.00 0.00 -0.41 0.00 0.00 54.97 55.81 1s6o s GLU 10 Cb 0.21 -1.75 0.00 0.00 -1.78 0.00 0.00 34.13 30.81 1s6o s GLU 10 CO -0.08 -2.58 0.00 0.41 -0.49 0.00 0.00 175.26 172.52 1s6o n GLY 11 N -0.76 1.19 3.59 -1.39 0.00 -1.26 -4.40 105.19 102.16 1s6o n GLY 11 Ca 0.06 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 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 1.92 -4.44 1.61 2.81 -1.25 -4.96 117.12 112.81 1s6o n MET 12 Ca 0.00 0.53 -0.30 0.00 -1.81 0.00 0.00 57.70 56.12 1s6o n MET 12 Cb 0.00 -3.17 -0.11 0.00 -0.71 0.00 0.00 33.22 29.23 1s6o n MET 12 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1s6o s THR 13 N 8.09 3.00 0.54 2.03 -1.32 -1.26 -4.98 115.64 121.73 1s6o s THR 13 Ca 1.01 -1.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.22 1s6o s THR 13 Cb -0.38 -2.33 0.00 0.00 -1.51 0.00 0.00 72.50 68.27 1s6o s THR 13 CO 0.37 0.22 0.00 0.00 -2.21 0.00 0.00 174.62 172.99 1s6o n HIS 15 N -4.11 2.61 0.00 0.00 8.25 -1.26 -4.02 115.22 116.69 1s6o n HIS 15 Ca -0.07 -2.38 -0.03 0.00 -0.26 0.00 0.00 57.72 54.98 1s6o n HIS 15 Cb 0.61 -2.11 -0.01 0.00 1.12 0.00 0.00 29.99 29.61 1s6o n HIS 15 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1s6o n SER 16 N 6.58 0.67 0.00 0.41 7.64 -1.26 -5.03 113.62 122.63 1s6o n SER 16 Ca 0.51 0.09 0.00 0.00 1.01 0.00 0.00 58.87 60.49 1s6o n SER 16 Cb 0.38 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 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 0.00 0.00 -0.33 0.00 -2.24 -1.26 -0.55 114.28 109.90 1s6o n THR 18 Ca 0.00 0.00 0.21 0.00 -2.27 0.00 0.00 64.05 61.99 1s6o n THR 18 Cb 0.00 0.00 0.43 0.00 -2.10 0.00 0.00 70.33 68.66 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 0.39 -0.06 3.42 0.87 -1.89 0.80 113.55 117.09 1s6o h SER 19 Ca 0.00 0.19 0.03 0.00 -1.23 0.00 0.00 61.79 60.78 1s6o h SER 19 Cb 0.00 0.17 -0.06 0.00 -0.44 0.00 0.00 62.40 62.07 1s6o h SER 19 CO 0.00 -0.14 -0.50 0.74 -0.53 0.00 0.00 176.83 176.40 1s6o h THR 20 N 0.30 0.05 -0.47 2.23 2.02 -1.10 -0.03 112.91 115.92 1s6o h THR 20 Ca 0.69 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.92 1s6o h THR 20 Cb 1.54 0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.96 1s6o h THR 20 CO -0.62 0.00 0.21 0.40 0.37 0.00 0.00 175.52 175.88 1s6o h ILE 21 N -0.60 0.92 0.15 3.11 5.03 0.28 -0.47 117.51 125.94 1s6o h ILE 21 Ca 0.04 -0.14 -0.00 0.00 -0.12 0.00 0.00 64.86 64.63 1s6o h ILE 21 Cb 0.69 0.47 -0.02 0.00 -3.03 0.00 0.00 36.82 34.93 1s6o h ILE 21 CO -0.38 0.08 -0.25 -0.33 -0.68 0.00 0.00 178.15 176.58 1s6o h GLU 22 N 0.42 -0.41 -0.60 2.37 5.08 0.04 0.25 114.58 121.73 1s6o h GLU 22 Ca 0.21 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.70 1s6o h GLU 22 Cb 0.15 0.09 -0.11 0.00 0.50 0.00 0.00 28.75 29.38 1s6o h GLU 22 CO -0.17 -0.27 -0.38 0.78 -1.00 0.00 0.00 179.01 177.97 1s6o h GLY 23 N -0.43 -0.25 0.67 -3.84 0.00 -1.01 0.12 103.07 98.33 1s6o h GLY 23 Ca -0.02 0.49 0.01 0.00 0.00 0.00 0.00 47.33 47.82 1s6o h GLY 23 CO -0.08 -0.19 -0.19 1.70 0.00 0.00 0.00 176.54 177.78 1s6o h LYS 24 N -0.18 -0.35 0.00 4.80 3.64 -0.83 -2.48 116.57 121.17 1s6o h LYS 24 Ca 0.21 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1s6o h LYS 24 Cb 0.56 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1s6o h LYS 24 CO -0.69 -0.23 -0.06 0.82 -2.27 0.00 0.00 179.45 177.01 1s6o h ILE 25 N -0.36 0.88 -0.06 2.00 1.08 0.22 -0.09 117.51 121.18 1s6o h ILE 25 Ca 0.03 -0.23 0.02 0.00 -0.39 0.00 0.00 64.86 64.29 1s6o h ILE 25 Cb 0.38 1.13 -0.00 0.00 -3.07 0.00 0.00 36.82 35.26 1s6o h ILE 25 CO -0.11 0.06 0.42 1.23 -0.69 0.00 0.00 178.15 179.06 1s6o h GLY 26 N 0.23 0.00 1.21 5.37 0.00 -0.29 0.14 103.07 109.73 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 0.01 0.00 -0.59 0.28 0.00 0.00 0.00 176.54 176.24 1s6o n LYS 27 N -2.96 0.29 -2.16 4.80 4.76 -0.05 -4.96 118.16 117.88 1s6o n LYS 27 Ca -0.00 0.09 -0.41 0.00 -2.87 0.00 0.00 58.31 55.12 1s6o n LYS 27 Cb 0.48 -1.69 -0.03 0.00 -1.84 0.00 0.00 35.03 31.95 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 -4.24 4.42 -0.22 -0.35 2.01 0.49 -4.91 118.68 115.87 1s6o s LEU 28 Ca 0.06 2.52 -0.30 0.00 0.01 0.00 0.00 54.13 56.42 1s6o s LEU 28 Cb 0.13 -3.62 -0.07 0.00 0.01 0.00 0.00 46.19 42.64 1s6o s LEU 28 CO 0.71 -0.54 2.18 0.00 1.01 0.00 0.00 176.35 179.72 1s6o n GLN 29 N 2.04 1.84 0.00 1.70 10.64 -1.26 -2.05 117.38 130.28 1s6o n GLN 29 Ca 0.04 0.53 0.00 0.00 -1.83 0.00 0.00 57.00 55.74 1s6o n GLN 29 Cb 0.42 -3.02 0.00 0.00 -0.86 0.00 0.00 30.24 26.78 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 5.79 2.23 3.72 2.61 0.00 -1.26 -4.01 105.19 114.27 1s6o n GLY 30 Ca 0.31 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.09 4.67 -0.25 1.61 1.01 -0.87 -3.67 120.40 120.80 1s6o s VAL 31 Ca 0.00 2.05 -0.12 0.00 0.00 0.00 0.00 61.98 63.91 1s6o s VAL 31 Cb 0.00 -4.31 -0.15 0.00 0.00 0.00 0.00 36.38 31.91 1s6o s VAL 31 CO 0.00 0.25 -0.17 0.00 0.00 0.00 0.00 175.10 175.18 1s6o n GLN 32 N 3.28 0.61 -3.75 2.72 1.13 0.43 -4.87 117.38 116.92 1s6o n GLN 32 Ca 0.04 0.30 -0.10 0.00 -1.94 0.00 0.00 57.00 55.30 1s6o n GLN 32 Cb 0.50 -1.56 -0.04 0.00 0.11 0.00 0.00 30.24 29.24 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 -2.49 1.28 -0.09 -1.09 3.52 -1.16 -5.00 118.95 113.92 1s6o s ARG 33 Ca -0.35 -0.88 -0.07 0.00 -0.13 0.00 0.00 55.73 54.30 1s6o s ARG 33 Cb 0.11 0.49 0.03 0.00 -1.56 0.00 0.00 34.95 34.02 1s6o s ARG 33 CO 0.55 -0.52 0.23 -1.50 -0.81 0.00 0.00 175.30 173.24 1s6o s ILE 34 N -3.87 -0.01 -0.26 4.11 2.07 -1.26 -0.86 121.20 121.11 1s6o s ILE 34 Ca 0.09 0.05 -0.02 0.00 -1.41 0.00 0.00 60.65 59.36 1s6o s ILE 34 Cb 0.00 -0.33 0.08 0.00 0.13 0.00 0.00 42.46 42.34 1s6o s ILE 34 CO -0.04 0.02 0.07 -0.54 -1.91 0.00 0.00 174.94 172.54 1s6o s LYS 35 N 0.49 0.66 -0.22 3.50 3.01 0.49 -5.00 119.74 122.66 1s6o s LYS 35 Ca -0.03 -0.73 -0.10 0.00 -1.01 0.00 0.00 55.97 54.11 1s6o s LYS 35 Cb -0.04 -1.97 -0.05 0.00 -1.01 0.00 0.00 37.83 34.76 1s6o s LYS 35 CO -0.02 -0.83 0.13 0.08 0.51 0.00 0.00 175.35 175.22 1s6o s VAL 36 N 1.77 5.22 -0.53 3.17 1.01 -1.26 -0.35 120.40 129.43 1s6o s VAL 36 Ca 0.04 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.14 1s6o s VAL 36 Cb -0.17 -3.41 0.14 0.00 0.00 0.00 0.00 36.38 32.94 1s6o s VAL 36 CO -0.18 0.39 0.32 -0.44 0.00 0.00 0.00 175.10 175.18 1s6o s SER 37 N 0.78 5.05 0.25 3.32 0.01 -0.57 -4.86 113.70 117.69 1s6o s SER 37 Ca 0.07 -2.60 -0.10 0.00 1.31 0.00 0.00 55.95 54.63 1s6o s SER 37 Cb -0.13 -1.79 0.38 0.00 0.21 0.00 0.00 66.02 64.69 1s6o s SER 37 CO 0.02 -0.39 1.59 0.25 0.41 0.00 0.00 173.24 175.12 1s6o h LEU 38 N 7.26 -0.74 -0.54 2.44 7.12 -1.93 0.13 115.31 129.04 1s6o h LEU 38 Ca -0.06 0.25 0.07 0.00 0.13 0.00 0.00 57.88 58.27 1s6o h LEU 38 Cb 0.97 0.51 -0.09 0.00 -0.53 0.00 0.00 40.66 41.51 1s6o h LEU 38 CO 0.69 -0.27 -0.52 0.44 -0.13 0.00 0.00 178.44 178.64 1s6o h ASP 39 N 0.01 -1.79 1.39 1.25 5.19 -1.92 -1.09 116.42 119.46 1s6o h ASP 39 Ca 0.41 0.26 0.00 0.00 -0.62 0.00 0.00 57.03 57.07 1s6o h ASP 39 Cb 0.64 0.76 0.00 0.00 0.18 0.00 0.00 39.33 40.91 1s6o h ASP 39 CO -0.85 -0.36 0.00 -3.20 -3.12 0.00 0.00 179.24 171.71 1s6o n ASN 40 N -5.37 0.79 0.00 6.45 2.85 -0.53 -4.89 115.26 114.56 1s6o n ASN 40 Ca -0.01 0.58 0.00 0.00 -0.11 0.00 0.00 54.58 55.04 1s6o n ASN 40 Cb 0.33 -0.79 0.00 0.00 1.24 0.00 0.00 39.78 40.56 1s6o n ASN 40 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1s6o n GLN 41 N -2.25 -0.34 -4.43 1.20 6.02 0.32 -4.97 117.38 112.94 1s6o n GLN 41 Ca 0.05 0.08 -0.25 0.00 -0.01 0.00 0.00 57.00 56.88 1s6o n GLN 41 Cb 0.41 -3.64 -0.10 0.00 1.02 0.00 0.00 30.24 27.92 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 -0.65 1.70 0.05 -1.09 2.12 -1.18 -0.73 118.70 118.92 1s6o s GLU 42 Ca 0.00 -1.64 0.00 0.00 0.36 0.00 0.00 54.97 53.70 1s6o s GLU 42 Cb 0.00 -1.84 -0.03 0.00 0.26 0.00 0.00 34.13 32.51 1s6o s GLU 42 CO 0.00 0.36 -0.05 0.00 -0.54 0.00 0.00 175.26 175.03 1s6o s ALA 43 N -2.19 0.50 -0.17 6.30 0.00 0.29 -1.51 121.76 124.98 1s6o s ALA 43 Ca 0.27 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.26 1s6o s ALA 43 Cb -0.06 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.26 1s6o s ALA 43 CO 0.14 -0.21 -0.11 0.99 0.00 0.00 0.00 175.76 176.56 1s6o s THR 44 N -2.64 1.55 0.26 0.00 2.01 0.53 -0.45 115.64 116.90 1s6o s THR 44 Ca -0.02 -0.81 0.11 0.00 0.31 0.00 0.00 61.69 61.28 1s6o s THR 44 Cb -0.01 -1.57 -0.05 0.00 0.01 0.00 0.00 72.50 70.88 1s6o s THR 44 CO -0.04 0.28 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.34 1s6o s ILE 45 N 1.46 2.35 -0.11 1.82 1.01 0.31 -0.38 121.20 127.66 1s6o s ILE 45 Ca 0.01 -2.36 -0.01 0.00 0.00 0.00 0.00 60.65 58.29 1s6o s ILE 45 Cb -0.15 -2.25 0.03 0.00 0.01 0.00 0.00 42.46 40.11 1s6o s ILE 45 CO -0.09 -0.42 -0.02 0.54 0.00 0.00 0.00 174.94 174.95 1s6o s VAL 46 N -2.55 0.63 0.33 2.92 0.11 -0.04 -0.32 120.40 121.47 1s6o s VAL 46 Ca 0.28 -0.16 -0.14 0.00 -2.93 0.00 0.00 61.98 59.03 1s6o s VAL 46 Cb -0.04 -0.81 0.06 0.00 -1.53 0.00 0.00 36.38 34.05 1s6o s VAL 46 CO 0.13 0.20 0.75 0.00 -3.33 0.00 0.00 175.10 172.85 1s6o n TYR 47 N 5.06 -2.11 -4.29 1.54 4.11 -0.39 -0.43 117.16 120.66 1s6o n TYR 47 Ca -0.09 -1.60 -0.19 0.00 -0.00 0.00 0.00 57.90 56.01 1s6o n TYR 47 Cb 0.49 0.80 -0.13 0.00 -0.00 0.00 0.00 39.34 40.50 1s6o n TYR 47 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.86 176.21 1s6o s GLN 48 N -2.08 0.87 -0.83 -3.48 -1.52 -1.24 -0.57 119.66 110.82 1s6o s GLN 48 Ca 0.15 -0.79 -0.21 0.00 -1.95 0.00 0.00 55.36 52.57 1s6o s GLN 48 Cb -0.04 -0.86 -0.14 0.00 -0.22 0.00 0.00 33.01 31.75 1s6o s GLN 48 CO 0.10 0.21 1.96 -0.35 -0.25 0.00 0.00 175.29 176.96 1s6o n PRO 49 N 1.76 1.63 0.10 2.91 -0.04 -1.26 -3.74 135.00 136.36 1s6o n PRO 49 Ca -0.19 -1.88 0.00 0.00 -0.04 0.00 0.00 63.50 61.40 1s6o n PRO 49 Cb 0.55 -2.92 0.00 0.00 -0.04 0.00 0.00 33.50 31.09 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 7.19 -2.14 0.19 0.54 8.25 -1.26 -4.90 115.22 123.09 1s6o n HIS 50 Ca 0.50 0.46 0.09 0.00 -0.26 0.00 0.00 57.72 58.50 1s6o n HIS 50 Cb 0.39 1.07 0.13 0.00 1.12 0.00 0.00 29.99 32.70 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 -8.54 2.41 3.38 -1.85 -3.45 115.31 107.26 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 0.18 -0.84 -0.51 0.09 0.00 0.00 178.44 177.36 1s6o s ILE 52 N -3.13 1.65 -0.05 1.22 1.10 -1.25 -4.70 121.20 116.04 1s6o s ILE 52 Ca 0.06 -1.21 0.00 0.00 -0.51 0.00 0.00 60.65 58.99 1s6o s ILE 52 Cb 0.06 -1.44 0.02 0.00 0.15 0.00 0.00 42.46 41.25 1s6o s ILE 52 CO 0.69 0.19 1.01 -1.20 -2.11 0.00 0.00 174.94 173.52 1s6o n SER 53 N 1.82 2.95 0.00 4.50 7.64 -1.26 -4.39 113.62 124.88 1s6o n SER 53 Ca -0.17 -2.05 0.00 0.00 1.01 0.00 0.00 58.87 57.66 1s6o n SER 53 Cb 0.53 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 0.43 0.00 0.10 0.44 3.14 -1.26 -3.74 118.33 117.44 1s6o n VAL 54 Ca 0.02 0.00 -0.24 0.00 -2.96 0.00 0.00 64.34 61.16 1s6o n VAL 54 Cb 0.53 0.00 -0.15 0.00 -1.06 0.00 0.00 33.84 33.16 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 0.45 -0.92 1.45 4.81 -2.00 -3.38 114.58 114.98 1s6o h GLU 55 Ca 0.00 -0.76 0.15 0.00 -0.13 0.00 0.00 59.36 58.62 1s6o h GLU 55 Cb 0.00 0.28 -0.16 0.00 0.63 0.00 0.00 28.75 29.51 1s6o h GLU 55 CO 0.00 1.36 -0.34 0.93 -0.73 0.00 0.00 179.01 180.23 1s6o h GLU 56 N 0.05 -0.03 -0.57 1.92 4.39 -1.93 0.28 114.58 118.70 1s6o h GLU 56 Ca -0.29 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.47 1s6o h GLU 56 Cb 2.07 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 30.66 1s6o h GLU 56 CO 0.21 -0.02 -0.34 -0.12 -1.16 0.00 0.00 179.01 177.59 1s6o n MET 57 N -5.50 -0.25 -0.06 2.33 1.56 -1.26 -0.48 117.12 113.45 1s6o n MET 57 Ca 0.10 0.93 -0.15 0.00 -0.27 0.00 0.00 57.70 58.31 1s6o n MET 57 Cb 0.41 -1.37 -0.06 0.00 2.15 0.00 0.00 33.22 34.36 1s6o n MET 57 CO 0.00 0.00 0.00 0.87 -0.73 0.00 0.00 175.97 176.11 1s6o h LYS 58 N 0.00 0.71 -0.30 2.12 6.56 -0.76 -3.07 116.57 121.83 1s6o h LYS 58 Ca 0.09 -0.47 0.09 0.00 -1.06 0.00 0.00 60.65 59.30 1s6o h LYS 58 Cb 0.24 0.06 -0.01 0.00 -0.57 0.00 0.00 32.23 31.95 1s6o h LYS 58 CO -0.54 1.09 0.25 0.87 -2.06 0.00 0.00 179.45 179.06 1s6o h LYS 59 N 0.42 0.00 -0.58 3.15 1.79 0.40 0.17 116.57 121.93 1s6o h LYS 59 Ca 0.00 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 1s6o h LYS 59 Cb 1.08 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.70 1s6o h LYS 59 CO 0.10 0.00 0.12 1.96 -1.08 0.00 0.00 179.45 180.56 1s6o h GLN 60 N 0.00 0.93 -0.07 3.15 4.20 -0.68 0.57 115.11 123.22 1s6o h GLN 60 Ca 0.14 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1s6o h GLN 60 Cb 0.64 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.30 1s6o h GLN 60 CO -0.00 0.87 0.02 0.82 -0.67 0.00 0.00 178.83 179.88 1s6o h ILE 61 N 0.84 1.15 -0.54 2.54 5.03 -0.82 -2.84 117.51 122.86 1s6o h ILE 61 Ca 0.18 -0.44 0.09 0.00 -0.12 0.00 0.00 64.86 64.57 1s6o h ILE 61 Cb 0.37 1.33 -0.07 0.00 -3.03 0.00 0.00 36.82 35.41 1s6o h ILE 61 CO 0.01 0.13 0.14 -0.33 -0.68 0.00 0.00 178.15 177.41 1s6o h GLU 62 N -0.06 0.28 -0.01 2.37 5.08 -0.53 0.64 114.58 122.35 1s6o h GLU 62 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1s6o h GLU 62 Cb 0.18 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1s6o h GLU 62 CO -0.00 0.18 0.06 0.00 -1.00 0.00 0.00 179.01 178.26 1s6o h ALA 63 N 1.41 1.12 -0.01 3.43 0.00 -0.84 0.90 119.26 125.27 1s6o h ALA 63 Ca 0.27 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 1s6o h ALA 63 Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1s6o h ALA 63 CO -0.33 -0.07 -0.15 0.52 0.00 0.00 0.00 179.25 179.22 1s6o h MET 64 N 0.00 0.02 0.00 0.00 2.86 -0.61 -3.47 114.93 113.73 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 0.13 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 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 -1.08 2.03 3.64 8.32 0.00 0.31 -5.10 105.19 113.31 1s6o n GLY 65 Ca -0.02 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.13 3.14 0.06 1.61 0.08 -1.23 -4.98 117.98 116.53 1s6o s PHE 66 Ca 0.00 1.20 -0.31 0.00 0.12 0.00 0.00 56.93 57.94 1s6o s PHE 66 Cb 0.00 -3.68 -0.09 0.00 -0.57 0.00 0.00 43.02 38.69 1s6o s PHE 66 CO 0.00 -0.79 1.74 -1.25 -0.10 0.00 0.00 175.22 174.83 1s6o s PRO 67 N 3.65 4.17 0.00 0.24 0.04 -1.26 -4.05 135.00 137.79 1s6o s PRO 67 Ca 0.46 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.92 1s6o s PRO 67 Cb -0.12 -3.72 0.00 0.00 0.04 0.00 0.00 34.50 30.69 1s6o s PRO 67 CO 0.15 -0.81 0.00 0.00 0.04 0.00 0.00 177.00 176.38 1s6o n ALA 68 N 6.07 0.00 -3.63 8.56 0.00 -1.26 -3.47 120.51 126.77 1s6o n ALA 68 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.50 1s6o n ALA 68 Cb 0.40 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.78 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 0.37 -0.74 -0.16 0.00 5.36 -0.35 -4.90 117.98 117.57 1s6o s PHE 69 Ca 0.00 1.73 -0.11 0.00 -0.96 0.00 0.00 56.93 57.58 1s6o s PHE 69 Cb 0.00 0.34 -0.05 0.00 -0.34 0.00 0.00 43.02 42.97 1s6o s PHE 69 CO 0.00 -0.36 0.22 0.54 -1.46 0.00 0.00 175.22 174.16 1s6o s VAL 70 N 0.54 5.36 0.00 3.12 0.11 -1.26 -0.54 120.40 127.72 1s6o s VAL 70 Ca -0.01 0.38 0.00 0.00 -2.93 0.00 0.00 61.98 59.42 1s6o s VAL 70 Cb -0.05 -3.54 0.00 0.00 -1.53 0.00 0.00 36.38 31.26 1s6o s VAL 70 CO -0.04 0.45 0.00 0.29 -3.33 0.00 0.00 175.10 172.47 1s6o n LYS 71 N 3.22 0.00 -3.67 1.54 5.02 -1.18 -4.96 118.16 118.13 1s6o n LYS 71 Ca -0.15 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.00 1s6o n LYS 71 Cb 0.52 -0.30 -0.08 0.00 -0.02 0.00 0.00 35.03 35.15 1s6o n LYS 71 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1s6o s LYS 72 N 0.00 0.70 -0.14 1.97 1.02 -1.26 -5.11 119.74 116.91 1s6o s LYS 72 Ca 0.00 0.69 -0.06 0.00 0.02 0.00 0.00 55.97 56.62 1s6o s LYS 72 Cb 0.00 0.34 0.06 0.00 -0.52 0.00 0.00 37.83 37.71 1s6o s LYS 72 CO 0.00 -0.11 0.31 -1.50 -0.92 0.00 0.00 175.35 173.13 1s6o s ILE 73 N 0.08 -0.33 -0.07 2.17 -1.16 -1.26 -4.40 121.20 116.22 1s6o s ILE 73 Ca -0.02 0.21 -0.11 0.00 -0.51 0.00 0.00 60.65 60.22 1s6o s ILE 73 Cb -0.04 -0.49 0.02 0.00 0.61 0.00 0.00 42.46 42.56 1s6o s ILE 73 CO 0.02 0.09 0.28 -1.61 -2.81 0.00 0.00 174.94 170.90 1s6o s GLU 74 N 2.08 0.43 0.00 3.50 8.01 -1.26 -5.03 118.70 126.43 1s6o s GLU 74 Ca -0.03 0.17 0.00 0.00 0.01 0.00 0.00 54.97 55.13 1s6o s GLU 74 Cb -0.11 0.20 0.00 0.00 -4.31 0.00 0.00 34.13 29.91 1s6o s GLU 74 CO -0.10 -0.08 0.00 0.41 0.01 0.00 0.00 175.26 175.50 1s6o n GLY 75 N 2.38 3.59 0.00 -1.39 0.00 -1.26 -4.92 105.19 103.60 1s6o n GLY 75 Ca -0.16 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1s6o n GLY 75 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36