#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tvs s GLU 2 N 0.00 1.59 -0.77 3.23 8.01 -1.26 -5.07 118.70 124.43 1tvs s GLU 2 Ca 0.00 -1.86 0.02 0.00 0.01 0.00 0.00 54.97 53.14 1tvs s GLU 2 Cb 0.00 -0.90 0.34 0.00 -4.31 0.00 0.00 34.13 29.26 1tvs s GLU 2 CO 0.00 -0.13 1.38 -3.47 0.01 0.00 0.00 175.26 173.06 1tvs n ASP 3 N -0.63 5.87 -3.46 -0.19 2.03 -1.26 -4.94 116.55 113.98 1tvs n ASP 3 Ca -0.03 -3.70 -0.37 0.00 0.52 0.00 0.00 54.79 51.21 1tvs n ASP 3 Cb 0.66 -0.84 -0.02 0.00 -0.72 0.00 0.00 41.12 40.20 1tvs n ASP 3 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1tvs n ARG 4 N -0.20 2.66 -0.21 -0.67 1.74 -1.26 -4.55 116.66 114.17 1tvs n ARG 4 Ca 0.39 -2.07 0.11 0.00 -0.77 0.00 0.00 57.85 55.51 1tvs n ARG 4 Cb 0.34 -2.88 0.26 0.00 -1.02 0.00 0.00 32.46 29.16 1tvs n ARG 4 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1tvs n ARG 5 N 5.11 2.39 -0.77 5.56 1.74 -1.26 -5.06 116.66 124.37 1tvs n ARG 5 Ca 0.58 -2.12 0.00 0.00 -0.77 0.00 0.00 57.85 55.54 1tvs n ARG 5 Cb 0.29 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 1tvs n ARG 5 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1tvs n ILE 6 N 1.29 -3.92 -2.02 0.55 5.41 -1.26 -3.40 119.36 116.01 1tvs n ILE 6 Ca 0.20 0.95 -0.40 0.00 1.00 0.00 0.00 62.75 64.49 1tvs n ILE 6 Cb 0.55 -2.38 -0.01 0.00 -0.71 0.00 0.00 39.64 37.09 1tvs n ILE 6 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1tvs s PRO 7 N -2.90 4.18 0.00 0.38 0.04 -1.26 0.34 135.00 135.78 1tvs s PRO 7 Ca 0.00 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.33 1tvs s PRO 7 Cb 0.00 -2.95 0.00 0.00 0.04 0.00 0.00 34.50 31.59 1tvs s PRO 7 CO 0.00 -0.36 0.00 0.41 0.04 0.00 0.00 177.00 177.09 1tvs n GLY 8 N 0.68 3.04 0.00 0.56 0.00 -1.26 -4.66 105.19 103.55 1tvs n GLY 8 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1tvs n GLY 8 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tvs n THR 9 N -0.70 0.00 0.00 2.61 -2.24 -1.12 -4.27 114.28 108.56 1tvs n THR 9 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1tvs n THR 9 Cb 0.00 -0.64 -0.08 0.00 -2.10 0.00 0.00 70.33 67.51 1tvs n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tvs h ALA 10 N 0.00 -0.12 -0.68 6.98 0.00 -0.13 0.65 119.26 125.97 1tvs h ALA 10 Ca 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1tvs h ALA 10 Cb 0.75 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1tvs h ALA 10 CO 0.00 -0.18 0.24 0.93 0.00 0.00 0.00 179.25 180.24 1tvs h GLU 11 N -0.89 1.02 -0.25 0.00 3.07 -1.87 -1.23 114.58 114.43 1tvs h GLU 11 Ca -0.01 -0.19 0.02 0.00 -0.50 0.00 0.00 59.36 58.68 1tvs h GLU 11 Cb 0.58 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.30 1tvs h GLU 11 CO 0.02 0.86 0.11 1.49 -1.40 0.00 0.00 179.01 180.09 1tvs h GLU 12 N 0.99 0.24 0.34 2.33 4.57 -1.74 -3.11 114.58 118.21 1tvs h GLU 12 Ca 0.23 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.39 1tvs h GLU 12 Cb 0.24 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.75 1tvs h GLU 12 CO -0.01 0.16 -0.48 -0.91 -1.18 0.00 0.00 179.01 176.59 1tvs h ASN 13 N 0.24 -1.35 0.00 1.04 2.35 0.13 -3.45 115.58 114.54 1tvs h ASN 13 Ca 0.11 0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1tvs h ASN 13 Cb 0.05 0.47 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1tvs h ASN 13 CO -0.09 -0.60 0.00 0.18 -1.65 0.00 0.00 177.43 175.28 1tvs n LEU 14 N -5.52 0.00 -2.74 1.61 4.77 -0.56 -1.71 117.00 112.84 1tvs n LEU 14 Ca -0.10 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.79 1tvs n LEU 14 Cb 0.43 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.60 1tvs n LEU 14 CO 0.23 0.00 0.25 1.67 -1.33 0.00 0.00 177.39 178.22 1tvs n GLN 15 N 0.00 1.13 0.00 3.23 -0.06 -1.26 -5.03 117.38 115.39 1tvs n GLN 15 Ca 0.00 -2.34 0.00 0.00 -2.00 0.00 0.00 57.00 52.66 1tvs n GLN 15 Cb 0.00 -0.68 0.00 0.00 -4.06 0.00 0.00 30.24 25.50 1tvs n GLN 15 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1tvs n LYS 16 N -0.20 0.00 0.00 3.69 5.02 -0.69 -2.55 118.16 123.42 1tvs n LYS 16 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1tvs n LYS 16 Cb 0.80 -0.17 0.00 0.00 -0.02 0.00 0.00 35.03 35.64 1tvs n LYS 16 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1tvs n SER 17 N -1.84 0.00 -4.03 4.39 2.88 -1.26 -2.43 113.62 111.33 1tvs n SER 17 Ca 0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 1tvs n SER 17 Cb 0.00 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.31 1tvs n SER 17 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1tvs s SER 18 N -4.00 4.70 0.00 -3.46 0.15 -1.26 -4.83 113.70 104.99 1tvs s SER 18 Ca 0.00 -1.98 0.00 0.00 0.70 0.00 0.00 55.95 54.67 1tvs s SER 18 Cb 0.00 -1.61 0.00 0.00 -1.71 0.00 0.00 66.02 62.70 1tvs s SER 18 CO 0.00 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.71 1tvs n GLY 19 N 4.29 2.07 0.00 9.45 0.00 -1.26 -4.89 105.19 114.85 1tvs n GLY 19 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1tvs n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tvs n GLY 20 N 0.00 1.14 0.29 -0.02 0.00 -1.02 -3.67 105.19 101.92 1tvs n GLY 20 Ca 0.00 -1.39 0.05 0.00 0.00 0.00 0.00 46.02 44.68 1tvs n GLY 20 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1tvs h VAL 21 N 0.00 0.75 0.00 1.61 -1.51 -1.75 -0.84 116.25 114.52 1tvs h VAL 21 Ca 0.00 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 1tvs h VAL 21 Cb 0.00 0.11 0.00 0.00 -2.13 0.00 0.00 31.29 29.27 1tvs h VAL 21 CO 0.00 0.11 0.00 -0.81 -1.23 0.00 0.00 177.57 175.64 1tvs n PRO 22 N -4.89 0.06 -2.81 5.19 -0.04 -1.26 -4.90 135.00 126.35 1tvs n PRO 22 Ca 0.15 0.30 -0.08 0.00 -0.04 0.00 0.00 63.50 63.82 1tvs n PRO 22 Cb 0.38 -1.60 0.03 0.00 -0.04 0.00 0.00 33.50 32.27 1tvs n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tvs n GLY 23 N 0.02 0.34 2.30 0.55 0.00 -0.32 -4.96 105.19 103.12 1tvs n GLY 23 Ca 0.03 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1tvs n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tvs n GLN 24 N -2.15 2.77 -0.00 1.61 10.64 -1.25 -4.44 117.38 124.55 1tvs n GLN 24 Ca -0.02 -3.37 0.09 0.00 -1.83 0.00 0.00 57.00 51.87 1tvs n GLN 24 Cb 0.53 -2.29 -0.11 0.00 -0.86 0.00 0.00 30.24 27.51 1tvs n GLN 24 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 1tvs n ASN 25 N -0.90 0.82 0.01 2.61 2.85 -1.24 -4.83 115.26 114.57 1tvs n ASN 25 Ca 0.61 -0.74 0.00 0.00 -0.11 0.00 0.00 54.58 54.34 1tvs n ASN 25 Cb 0.69 1.18 0.00 0.00 1.24 0.00 0.00 39.78 42.89 1tvs n ASN 25 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 1tvs n THR 26 N -1.59 0.06 0.00 -0.44 5.66 -1.26 -4.85 114.28 111.86 1tvs n THR 26 Ca 0.02 0.02 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 1tvs n THR 26 Cb 0.33 -0.73 0.00 0.00 -1.55 0.00 0.00 70.33 68.38 1tvs n THR 26 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1tvs n GLY 27 N 2.89 3.21 0.00 1.09 0.00 -1.26 -1.21 105.19 109.91 1tvs n GLY 27 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1tvs n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tvs n GLY 28 N 0.00 1.05 2.04 -0.02 0.00 -1.26 -4.81 105.19 102.20 1tvs n GLY 28 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1tvs n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tvs n GLN 29 N 0.00 0.00 -0.25 1.61 10.64 -1.26 -4.57 117.38 123.55 1tvs n GLN 29 Ca 0.00 0.00 -0.04 0.00 -1.83 0.00 0.00 57.00 55.13 1tvs n GLN 29 Cb 0.00 0.00 0.06 0.00 -0.86 0.00 0.00 30.24 29.44 1tvs n GLN 29 CO 0.00 0.00 0.00 1.05 -1.83 0.00 0.00 177.06 176.28 1tvs h GLU 30 N 0.00 0.89 0.18 2.61 9.09 -1.95 -3.03 114.58 122.37 1tvs h GLU 30 Ca 0.00 -0.05 -0.30 0.00 0.05 0.00 0.00 59.36 59.06 1tvs h GLU 30 Cb 0.00 -0.20 0.02 0.00 -1.65 0.00 0.00 28.75 26.92 1tvs h GLU 30 CO 0.00 0.59 -1.41 0.00 0.05 0.00 0.00 179.01 178.24 1tvs h ALA 31 N 1.27 0.03 -0.98 1.06 0.00 -1.88 -3.47 119.26 115.29 1tvs h ALA 31 Ca 0.27 -0.97 -0.77 0.00 0.00 0.00 0.00 54.91 53.44 1tvs h ALA 31 Cb -0.06 0.32 0.05 0.00 0.00 0.00 0.00 17.79 18.10 1tvs h ALA 31 CO -0.08 0.76 0.06 -2.13 0.00 0.00 0.00 179.25 177.86 1tvs n ARG 32 N -3.82 0.00 -1.08 0.00 0.00 -0.35 -4.80 116.66 106.61 1tvs n ARG 32 Ca -0.21 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.35 1tvs n ARG 32 Cb 0.99 -1.46 0.17 0.00 0.00 0.00 0.00 32.46 32.15 1tvs n ARG 32 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1tvs s PRO 33 N -0.00 0.69 -1.07 -0.14 0.04 -1.26 -4.25 135.00 129.01 1tvs s PRO 33 Ca 0.89 0.77 -0.02 0.00 0.04 0.00 0.00 61.00 62.67 1tvs s PRO 33 Cb -1.24 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.53 1tvs s PRO 33 CO 0.56 -2.61 0.91 0.09 0.04 0.00 0.00 177.00 175.98 1tvs n ASN 34 N -4.13 -3.60 -0.02 6.66 3.02 -1.26 -4.96 115.26 110.97 1tvs n ASN 34 Ca 0.06 -0.61 -0.04 0.00 -0.03 0.00 0.00 54.58 53.96 1tvs n ASN 34 Cb 0.56 -4.87 -0.01 0.00 -0.61 0.00 0.00 39.78 34.84 1tvs n ASN 34 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tvs n TYR 35 N -3.64 0.00 1.57 3.10 4.11 -1.26 -4.73 117.16 116.31 1tvs n TYR 35 Ca -0.20 0.00 0.06 0.00 -0.00 0.00 0.00 57.90 57.77 1tvs n TYR 35 Cb 0.64 -0.12 0.28 0.00 -0.00 0.00 0.00 39.34 40.13 1tvs n TYR 35 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.86 174.47 1tvs n HIS 36 N -3.14 0.15 -0.21 -3.48 1.44 -1.26 -4.91 115.22 103.82 1tvs n HIS 36 Ca -0.07 -0.08 0.00 0.00 -2.01 0.00 0.00 57.72 55.56 1tvs n HIS 36 Cb 0.55 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.66 1tvs n HIS 36 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1tvs h GLN 38 N 1.49 0.37 -0.16 0.00 4.15 -1.97 0.14 115.11 119.12 1tvs h GLN 38 Ca 0.00 -0.63 -0.12 0.00 0.77 0.00 0.00 58.65 58.67 1tvs h GLN 38 Cb 0.00 0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1tvs h GLN 38 CO 0.00 1.30 -0.42 -0.07 -1.93 0.00 0.00 178.83 177.71 1tvs h LEU 39 N -0.22 0.40 -1.29 -2.39 4.07 -1.95 -0.87 115.31 113.05 1tvs h LEU 39 Ca -0.19 -0.17 -0.07 0.00 0.08 0.00 0.00 57.88 57.53 1tvs h LEU 39 Cb 1.81 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 43.42 1tvs h LEU 39 CO 0.18 0.77 -0.32 0.00 -1.08 0.00 0.00 178.44 178.00 1tvs h PHE 41 N 0.00 0.10 -0.14 0.00 3.57 0.57 -0.17 116.94 120.87 1tvs h PHE 41 Ca -0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.51 1tvs h PHE 41 Cb 0.67 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 1tvs h PHE 41 CO 0.00 0.33 0.10 -0.07 -2.23 0.00 0.00 178.31 176.44 1tvs h LEU 42 N -0.16 0.05 -1.00 0.59 4.07 -0.50 0.71 115.31 119.07 1tvs h LEU 42 Ca 0.02 -0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.89 1tvs h LEU 42 Cb 0.28 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 1tvs h LEU 42 CO 0.00 0.03 -0.41 -0.09 -1.08 0.00 0.00 178.44 176.89 1tvs h ARG 43 N 0.05 0.00 -0.34 1.13 9.65 0.07 -3.36 114.38 121.58 1tvs h ARG 43 Ca 0.06 0.00 -0.25 0.00 -1.10 0.00 0.00 59.98 58.69 1tvs h ARG 43 Cb 0.19 0.00 -0.38 0.00 -1.39 0.00 0.00 29.97 28.39 1tvs h ARG 43 CO -0.01 0.41 -1.03 0.45 2.80 0.00 0.00 179.97 182.60 1tvs n SER 44 N -3.68 1.86 -3.85 -3.80 2.88 0.70 -4.85 113.62 102.89 1tvs n SER 44 Ca -0.01 -2.34 -0.35 0.00 -1.33 0.00 0.00 58.87 54.84 1tvs n SER 44 Cb 0.50 -0.42 -0.12 0.00 -0.75 0.00 0.00 64.21 63.42 1tvs n SER 44 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1tvs n LEU 45 N -0.37 1.15 -0.71 2.46 4.32 0.22 -3.40 117.00 120.66 1tvs n LEU 45 Ca 0.12 -1.84 -0.08 0.00 -0.02 0.00 0.00 56.01 54.19 1tvs n LEU 45 Cb 0.90 -0.90 -0.04 0.00 -1.62 0.00 0.00 43.42 41.76 1tvs n LEU 45 CO 0.08 -2.52 -0.08 0.61 -1.22 0.00 0.00 177.39 174.26 1tvs n GLY 46 N 5.36 0.80 4.51 -0.72 0.00 -1.26 -2.84 105.19 111.04 1tvs n GLY 46 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1tvs n GLY 46 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1tvs n ILE 47 N -1.93 0.00 0.22 -0.61 -0.00 -1.22 -4.58 119.36 111.24 1tvs n ILE 47 Ca -0.08 0.00 0.08 0.00 -0.00 0.00 0.00 62.75 62.75 1tvs n ILE 47 Cb 0.50 0.00 0.49 0.00 -0.00 0.00 0.00 39.64 40.64 1tvs n ILE 47 CO 0.00 0.00 0.00 -0.78 -0.00 0.00 0.00 176.55 175.77 1tvs h ASP 48 N 0.00 0.00 0.94 7.28 3.58 -1.93 0.99 116.42 127.28 1tvs h ASP 48 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1tvs h ASP 48 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1tvs h ASP 48 CO 0.00 0.26 0.00 0.22 -2.88 0.00 0.00 179.24 176.84 1tvs h TYR 49 N 0.00 0.00 0.00 0.28 3.20 -1.77 0.18 116.97 118.86 1tvs h TYR 49 Ca -0.00 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1tvs h TYR 49 Cb 0.64 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.91 1tvs h TYR 49 CO 0.00 0.00 -0.87 -0.07 -1.64 0.00 0.00 178.16 175.58 1tvs h LEU 50 N 0.00 0.00 -0.80 2.82 -0.00 -1.09 0.55 115.31 116.80 1tvs h LEU 50 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.79 1tvs h LEU 50 Cb 0.47 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.11 1tvs h LEU 50 CO 0.00 0.06 -0.03 -0.78 -0.00 0.00 0.00 178.44 177.69 1tvs h ASP 51 N 0.00 0.86 0.26 -0.43 1.82 -0.74 -0.37 116.42 117.82 1tvs h ASP 51 Ca -0.01 -0.23 0.00 0.00 -0.39 0.00 0.00 57.03 56.40 1tvs h ASP 51 Cb 1.06 -0.23 -0.02 0.00 0.68 0.00 0.00 39.33 40.82 1tvs h ASP 51 CO 0.01 0.93 -0.25 0.00 -1.61 0.00 0.00 179.24 178.32 1tvs h ALA 52 N 1.15 -0.53 -0.23 -0.78 0.00 0.83 0.70 119.26 120.40 1tvs h ALA 52 Ca 0.15 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1tvs h ALA 52 Cb 0.52 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1tvs h ALA 52 CO 0.03 -0.83 0.39 1.03 0.00 0.00 0.00 179.25 179.87 1tvs h SER 53 N -0.54 0.00 -0.15 0.00 0.87 0.90 -1.37 113.55 113.26 1tvs h SER 53 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1tvs h SER 53 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1tvs h SER 53 CO -0.05 0.00 0.00 0.18 -0.53 0.00 0.00 176.83 176.43 1tvs n LEU 54 N -3.38 2.26 0.00 2.23 4.32 -0.04 -4.89 117.00 117.49 1tvs n LEU 54 Ca 0.03 -1.50 0.00 0.00 -0.02 0.00 0.00 56.01 54.53 1tvs n LEU 54 Cb 0.51 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 42.22 1tvs n LEU 54 CO 0.22 0.52 0.13 0.54 -1.22 0.00 0.00 177.39 177.58 1tvs n ARG 55 N 0.42 0.00 0.00 3.23 5.12 0.22 -4.70 116.66 120.96 1tvs n ARG 55 Ca 0.07 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.00 1tvs n ARG 55 Cb 0.31 -0.77 0.00 0.00 -1.16 0.00 0.00 32.46 30.84 1tvs n ARG 55 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1tvs n LYS 56 N -0.27 0.00 -0.63 5.56 4.01 -1.26 -1.55 118.16 124.02 1tvs n LYS 56 Ca 0.00 0.00 0.05 0.00 -0.51 0.00 0.00 58.31 57.85 1tvs n LYS 56 Cb 0.00 0.00 0.09 0.00 -0.51 0.00 0.00 35.03 34.61 1tvs n LYS 56 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1tvs n LYS 57 N 0.00 0.68 0.00 1.97 3.00 -1.26 -4.97 118.16 117.58 1tvs n LYS 57 Ca 0.00 -2.14 0.00 0.00 -0.00 0.00 0.00 58.31 56.17 1tvs n LYS 57 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 35.03 34.14 1tvs n LYS 57 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1tvs n ASN 58 N -0.51 0.00 0.00 3.14 2.85 -0.59 -4.69 115.26 115.46 1tvs n ASN 58 Ca 0.10 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.57 1tvs n ASN 58 Cb 0.78 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.80 1tvs n ASN 58 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1tvs n LYS 59 N 0.00 0.00 -0.85 1.20 5.02 -1.26 -1.75 118.16 120.52 1tvs n LYS 59 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 1tvs n LYS 59 Cb 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.16 1tvs n LYS 59 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1tvs n GLN 60 N 0.00 1.09 0.14 1.97 1.13 -1.26 -4.82 117.38 115.63 1tvs n GLN 60 Ca 0.00 -2.87 0.02 0.00 -1.94 0.00 0.00 57.00 52.21 1tvs n GLN 60 Cb 0.00 -1.12 0.38 0.00 0.11 0.00 0.00 30.24 29.60 1tvs n GLN 60 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1tvs h ARG 61 N 0.96 0.17 -0.97 -1.09 -0.00 -1.62 0.42 114.38 112.26 1tvs h ARG 61 Ca -0.07 -0.05 0.07 0.00 -0.50 0.00 0.00 59.98 59.43 1tvs h ARG 61 Cb 1.27 -0.02 -0.07 0.00 0.00 0.00 0.00 29.97 31.15 1tvs h ARG 61 CO 0.03 0.38 0.62 -0.07 0.00 0.00 0.00 179.97 180.93 1tvs h LEU 62 N 0.16 0.98 0.00 3.04 3.38 -1.88 0.48 115.31 121.47 1tvs h LEU 62 Ca 0.03 0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.79 1tvs h LEU 62 Cb 0.47 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 1tvs h LEU 62 CO 0.03 0.62 -1.25 0.50 0.09 0.00 0.00 178.44 178.43 1tvs h LYS 63 N 1.11 0.00 0.00 1.13 3.64 -1.86 -3.29 116.57 117.30 1tvs h LYS 63 Ca 0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 1tvs h LYS 63 Cb 0.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1tvs h LYS 63 CO -0.18 0.68 0.00 0.00 -2.27 0.00 0.00 179.45 177.68 1tvs n ALA 64 N -2.41 2.09 0.20 5.00 0.00 0.10 -3.17 120.51 122.31 1tvs n ALA 64 Ca -0.07 -0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.42 1tvs n ALA 64 Cb 0.95 -1.44 0.50 0.00 0.00 0.00 0.00 19.45 19.46 1tvs n ALA 64 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1tvs h ILE 65 N 0.00 1.12 -0.41 0.00 6.09 -0.14 -1.09 117.51 123.07 1tvs h ILE 65 Ca 0.00 -0.54 0.00 0.00 -1.37 0.00 0.00 64.86 62.95 1tvs h ILE 65 Cb 0.59 1.22 0.00 0.00 0.47 0.00 0.00 36.82 39.10 1tvs h ILE 65 CO 0.00 0.16 0.00 0.00 -3.07 0.00 0.00 178.15 175.24 1tvs n GLN 66 N -4.35 2.48 -0.89 2.19 3.00 -1.19 -4.99 117.38 113.63 1tvs n GLN 66 Ca -0.02 -2.25 -0.16 0.00 -0.01 0.00 0.00 57.00 54.57 1tvs n GLN 66 Cb 0.22 -1.51 0.11 0.00 0.00 0.00 0.00 30.24 29.06 1tvs n GLN 66 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1tvs n GLN 67 N 1.44 -1.05 0.00 -1.09 1.13 -0.41 -5.05 117.38 112.34 1tvs n GLN 67 Ca 0.20 -1.05 0.00 0.00 -1.94 0.00 0.00 57.00 54.21 1tvs n GLN 67 Cb 0.59 -0.76 0.00 0.00 0.11 0.00 0.00 30.24 30.18 1tvs n GLN 67 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1tvs n GLY 68 N -0.05 0.00 2.39 1.08 0.00 -1.26 -5.02 105.19 102.33 1tvs n GLY 68 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 1tvs n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tvs n ARG 69 N 0.00 0.82 -2.04 1.61 5.12 -0.00 -4.75 116.66 117.42 1tvs n ARG 69 Ca 0.00 -0.95 -0.06 0.00 -1.93 0.00 0.00 57.85 54.90 1tvs n ARG 69 Cb 0.00 0.17 0.00 0.00 -1.16 0.00 0.00 32.46 31.47 1tvs n ARG 69 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1tvs n GLN 70 N -0.84 1.29 -1.82 5.56 6.02 0.14 -4.99 117.38 122.74 1tvs n GLN 70 Ca -0.12 -0.83 -0.27 0.00 -0.01 0.00 0.00 57.00 55.77 1tvs n GLN 70 Cb 0.75 0.08 -0.08 0.00 1.02 0.00 0.00 30.24 32.02 1tvs n GLN 70 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1tvs n PRO 71 N -0.83 1.22 0.00 -1.09 -0.04 -1.26 -4.39 135.00 128.61 1tvs n PRO 71 Ca -0.00 -2.20 0.00 0.00 -0.04 0.00 0.00 63.50 61.25 1tvs n PRO 71 Cb 0.15 -3.66 0.00 0.00 -0.04 0.00 0.00 33.50 29.95 1tvs n PRO 71 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1tvs n GLN 72 N 8.11 0.00 -0.15 0.54 6.02 -1.26 -4.45 117.38 126.19 1tvs n GLN 72 Ca 0.45 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.45 1tvs n GLN 72 Cb 0.46 -0.23 0.28 0.00 1.02 0.00 0.00 30.24 31.77 1tvs n GLN 72 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 177.06 176.15 1tvs h TYR 73 N 0.00 0.83 -2.15 1.08 -0.00 -2.02 -2.70 116.97 112.01 1tvs h TYR 73 Ca 0.00 0.01 -0.66 0.00 0.00 0.00 0.00 58.73 58.07 1tvs h TYR 73 Cb 0.00 -0.27 -0.37 0.00 0.00 0.00 0.00 36.73 36.09 1tvs h TYR 73 CO 0.00 0.55 -0.06 1.28 -0.00 0.00 0.00 178.16 179.93 1tvs n LEU 74 N -4.41 5.55 0.00 0.10 4.77 -1.26 -5.03 117.00 116.72 1tvs n LEU 74 Ca 0.06 -5.47 0.09 0.00 -0.03 0.00 0.00 56.01 50.66 1tvs n LEU 74 Cb 0.07 -0.75 0.53 0.00 -2.33 0.00 0.00 43.42 40.93 1tvs n LEU 74 CO 0.37 2.21 0.73 0.00 -1.33 0.00 0.00 177.39 179.36