#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 2.85 -0.50 1.96 0.41 -1.26 -4.94 118.70 117.22 1tvs s GLU 2 Ca 0.00 -1.69 0.08 0.00 -0.41 0.00 0.00 54.97 52.95 1tvs s GLU 2 Cb 0.00 -4.18 0.33 0.00 -1.78 0.00 0.00 34.13 28.50 1tvs s GLU 2 CO 0.00 -1.26 0.84 -3.47 -0.49 0.00 0.00 175.26 170.88 1tvs n ASP 3 N 5.15 2.94 -3.43 -0.19 2.03 -1.26 -4.98 116.55 116.82 1tvs n ASP 3 Ca -0.12 -3.38 -0.40 0.00 0.52 0.00 0.00 54.79 51.40 1tvs n ASP 3 Cb 0.41 -0.59 -0.02 0.00 -0.72 0.00 0.00 41.12 40.19 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 0.09 3.68 -0.22 -0.67 1.74 -1.26 -4.45 116.66 115.58 1tvs n ARG 4 Ca 0.28 -2.50 0.06 0.00 -0.77 0.00 0.00 57.85 54.92 1tvs n ARG 4 Cb 0.49 -2.87 0.16 0.00 -1.02 0.00 0.00 32.46 29.23 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 3.76 2.74 -1.41 5.56 1.74 -1.26 -4.86 116.66 122.93 1tvs n ARG 5 Ca 0.70 -2.25 -0.57 0.00 -0.77 0.00 0.00 57.85 54.96 1tvs n ARG 5 Cb 0.27 -1.42 -0.09 0.00 -1.02 0.00 0.00 32.46 30.19 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 -0.18 0.11 -2.41 0.55 -0.00 -1.26 -4.81 119.36 111.36 1tvs n ILE 6 Ca 0.13 -0.10 -0.40 0.00 -0.00 0.00 0.00 62.75 62.38 1tvs n ILE 6 Cb 0.56 -1.01 -0.04 0.00 -0.00 0.00 0.00 39.64 39.16 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 5.59 4.46 -0.06 0.38 0.04 -1.26 0.03 135.00 144.17 1tvs s PRO 7 Ca 1.13 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.99 1tvs s PRO 7 Cb -1.21 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 30.31 1tvs s PRO 7 CO 0.61 0.04 0.00 0.41 0.04 0.00 0.00 177.00 178.09 1tvs n GLY 8 N 0.95 0.46 0.40 0.56 0.00 -1.26 -4.70 105.19 101.59 1tvs n GLY 8 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1tvs n GLY 8 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1tvs n THR 9 N -2.97 0.00 -0.02 2.61 5.66 -1.22 -4.88 114.28 113.45 1tvs n THR 9 Ca -0.01 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.86 1tvs n THR 9 Cb 0.03 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.70 1tvs n THR 9 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1tvs h ALA 10 N 0.00 -0.00 -0.17 1.79 0.00 -0.68 0.68 119.26 120.86 1tvs h ALA 10 Ca 0.00 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 1tvs h ALA 10 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1tvs h ALA 10 CO 0.00 -0.21 -0.15 1.05 0.00 0.00 0.00 179.25 179.94 1tvs h GLU 11 N -0.59 0.29 -0.59 0.00 9.09 -1.87 -1.89 114.58 119.01 1tvs h GLU 11 Ca -0.00 -0.07 -0.06 0.00 0.05 0.00 0.00 59.36 59.27 1tvs h GLU 11 Cb 0.58 -0.03 -0.02 0.00 -1.65 0.00 0.00 28.75 27.63 1tvs h GLU 11 CO 0.00 0.44 0.13 1.49 0.05 0.00 0.00 179.01 181.12 1tvs h GLU 12 N 0.27 0.96 -0.92 1.06 4.81 -1.83 -2.98 114.58 115.94 1tvs h GLU 12 Ca 0.05 -0.24 0.24 0.00 -0.13 0.00 0.00 59.36 59.29 1tvs h GLU 12 Cb 0.43 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.64 1tvs h GLU 12 CO 0.03 0.89 0.63 -0.91 -0.73 0.00 0.00 179.01 178.92 1tvs h ASN 13 N 0.87 0.20 -0.91 1.04 -0.26 0.12 -2.10 115.58 114.54 1tvs h ASN 13 Ca 0.18 0.02 -0.23 0.00 -0.56 0.00 0.00 56.30 55.72 1tvs h ASN 13 Cb 0.37 -0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.61 1tvs h ASN 13 CO 0.00 0.07 0.70 -0.76 -1.06 0.00 0.00 177.43 176.38 1tvs s LEU 14 N -8.97 3.10 0.00 1.61 1.02 -1.13 -3.22 118.68 111.09 1tvs s LEU 14 Ca -0.07 0.14 0.00 0.00 0.02 0.00 0.00 54.13 54.22 1tvs s LEU 14 Cb 0.22 -2.54 0.00 0.00 0.02 0.00 0.00 46.19 43.89 1tvs s LEU 14 CO 0.78 -3.23 0.00 1.67 0.02 0.00 0.00 176.35 175.59 1tvs n GLN 15 N 8.92 0.00 -4.16 1.70 7.27 -1.26 -4.60 117.38 125.25 1tvs n GLN 15 Ca 0.40 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 57.14 1tvs n GLN 15 Cb 0.48 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.10 1tvs n GLN 15 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1tvs n LYS 16 N 0.00 -3.08 -2.09 3.69 4.76 -0.79 -4.97 118.16 115.68 1tvs n LYS 16 Ca 0.00 0.37 -0.20 0.00 -2.87 0.00 0.00 58.31 55.60 1tvs n LYS 16 Cb 0.00 -4.87 0.11 0.00 -1.84 0.00 0.00 35.03 28.44 1tvs n LYS 16 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1tvs n SER 17 N -2.76 0.89 -2.49 4.39 3.41 -1.26 -5.00 113.62 110.80 1tvs n SER 17 Ca -0.05 -1.83 -0.36 0.00 -0.26 0.00 0.00 58.87 56.37 1tvs n SER 17 Cb 0.55 -0.60 0.07 0.00 -0.26 0.00 0.00 64.21 63.97 1tvs n SER 17 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1tvs n SER 18 N -3.10 7.61 0.00 4.04 3.41 -1.26 -5.04 113.62 119.29 1tvs n SER 18 Ca 0.14 -3.80 0.00 0.00 -0.26 0.00 0.00 58.87 54.94 1tvs n SER 18 Cb 0.49 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 1tvs n SER 18 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tvs n GLY 19 N -0.81 0.22 0.00 5.00 0.00 -1.26 -4.79 105.19 103.55 1tvs n GLY 19 Ca 0.60 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.34 3.50 -0.02 0.00 -1.26 -4.93 105.19 101.13 1tvs n GLY 20 Ca 0.00 0.52 -0.34 0.00 0.00 0.00 0.00 46.02 46.20 1tvs n GLY 20 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tvs s VAL 21 N 0.00 4.11 0.15 1.61 -7.23 -1.26 -4.93 120.40 112.85 1tvs s VAL 21 Ca 0.00 -0.27 0.03 0.00 -1.81 0.00 0.00 61.98 59.93 1tvs s VAL 21 Cb 0.00 -2.84 -0.18 0.00 0.56 0.00 0.00 36.38 33.93 1tvs s VAL 21 CO 0.00 0.45 1.34 1.55 -0.31 0.00 0.00 175.10 178.13 1tvs h PRO 22 N 7.07 0.14 -2.54 4.82 0.13 -2.03 -3.48 132.00 136.10 1tvs h PRO 22 Ca -0.34 -0.18 -0.08 0.00 -0.87 0.00 0.00 66.00 64.53 1tvs h PRO 22 Cb 1.18 0.06 0.04 0.00 0.13 0.00 0.00 31.00 32.40 1tvs h PRO 22 CO 0.63 0.98 -0.16 0.41 -0.23 0.00 0.00 178.00 179.63 1tvs n GLY 23 N 1.04 0.39 2.54 1.56 0.00 -1.26 -4.99 105.19 104.47 1tvs n GLY 23 Ca -0.03 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.62 3.22 0.00 1.61 10.64 -1.26 -4.67 117.38 125.30 1tvs n GLN 24 Ca -0.04 -4.13 0.00 0.00 -1.83 0.00 0.00 57.00 51.00 1tvs n GLN 24 Cb 0.53 -2.26 0.00 0.00 -0.86 0.00 0.00 30.24 27.65 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 -0.55 0.20 0.00 2.61 2.85 -1.26 -4.92 115.26 114.20 1tvs n ASN 25 Ca 0.45 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.92 1tvs n ASN 25 Cb 0.58 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.60 1tvs n ASN 25 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1tvs n THR 26 N -2.09 0.00 0.00 -0.44 -2.24 -1.26 -3.83 114.28 104.42 1tvs n THR 26 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1tvs n THR 26 Cb 0.05 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 1tvs n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tvs n GLY 27 N 0.00 1.33 0.00 3.38 0.00 -1.26 -5.06 105.19 103.58 1tvs n GLY 27 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 0.10 5.00 -0.02 0.00 -1.25 -4.88 105.19 104.14 1tvs n GLY 28 Ca 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1tvs n GLY 28 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tvs n GLN 29 N -1.26 0.00 -0.02 1.61 6.02 -1.26 -4.00 117.38 118.47 1tvs n GLN 29 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.84 1tvs n GLN 29 Cb 0.00 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.16 1tvs n GLN 29 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1tvs h GLU 30 N 0.00 0.29 0.00 -1.09 3.07 -1.96 -3.48 114.58 111.40 1tvs h GLU 30 Ca 0.00 -0.26 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 1tvs h GLU 30 Cb 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1tvs h GLU 30 CO 0.00 0.93 0.00 0.00 -1.40 0.00 0.00 179.01 178.54 1tvs n ALA 31 N -2.52 0.00 -3.68 3.43 0.00 -1.26 -5.00 120.51 111.48 1tvs n ALA 31 Ca -0.09 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.06 1tvs n ALA 31 Cb 0.52 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.01 1tvs n ALA 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1tvs n ARG 32 N 0.00 -1.76 -2.85 0.00 5.12 -1.26 -4.49 116.66 111.42 1tvs n ARG 32 Ca 0.00 0.49 -0.36 0.00 -1.93 0.00 0.00 57.85 56.05 1tvs n ARG 32 Cb 0.00 -4.35 -0.06 0.00 -1.16 0.00 0.00 32.46 26.88 1tvs n ARG 32 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1tvs s PRO 33 N -5.93 4.44 -0.33 5.56 0.04 -1.26 -4.82 135.00 132.71 1tvs s PRO 33 Ca 0.39 1.19 -0.09 0.00 0.04 0.00 0.00 61.00 62.54 1tvs s PRO 33 Cb -0.13 -2.68 0.19 0.00 0.04 0.00 0.00 34.50 31.91 1tvs s PRO 33 CO 0.85 0.24 1.04 1.21 0.04 0.00 0.00 177.00 180.37 1tvs s ASN 34 N -1.75 -0.37 0.02 6.66 2.47 -1.26 -4.60 114.94 116.11 1tvs s ASN 34 Ca 0.51 -0.19 -0.02 0.00 0.42 0.00 0.00 52.86 53.59 1tvs s ASN 34 Cb -0.16 0.47 -0.01 0.00 -1.45 0.00 0.00 41.25 40.10 1tvs s ASN 34 CO 0.21 -0.04 -0.03 0.00 -3.72 0.00 0.00 177.10 173.52 1tvs n TYR 35 N 3.68 0.00 1.09 0.43 4.11 -1.26 -4.78 117.16 120.43 1tvs n TYR 35 Ca 0.06 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 58.00 1tvs n TYR 35 Cb 0.63 -0.04 0.12 0.00 -0.00 0.00 0.00 39.34 40.04 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 -3.03 0.38 -0.07 -3.48 1.44 -1.26 -4.90 115.22 104.29 1tvs n HIS 36 Ca -0.01 -0.18 0.00 0.00 -2.01 0.00 0.00 57.72 55.52 1tvs n HIS 36 Cb 0.05 -0.02 0.00 0.00 0.12 0.00 0.00 29.99 30.13 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 1.68 0.82 -0.12 0.00 4.15 -1.98 0.13 115.11 119.79 1tvs h GLN 38 Ca 0.00 -0.48 -0.05 0.00 0.77 0.00 0.00 58.65 58.89 1tvs h GLN 38 Cb 0.00 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 1tvs h GLN 38 CO 0.00 1.12 -0.16 -0.07 -1.93 0.00 0.00 178.83 177.78 1tvs h LEU 39 N 0.64 0.18 -0.93 -2.39 -0.00 -1.87 0.25 115.31 111.19 1tvs h LEU 39 Ca 0.03 -0.04 -0.11 0.00 -0.00 0.00 0.00 57.88 57.76 1tvs h LEU 39 Cb 1.07 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.67 1tvs h LEU 39 CO 0.11 0.36 -0.50 0.00 -0.00 0.00 0.00 178.44 178.41 1tvs h PHE 41 N 0.07 0.33 -0.16 0.00 3.57 0.14 -1.47 116.94 119.41 1tvs h PHE 41 Ca 0.00 -0.07 0.03 0.00 3.53 0.00 0.00 57.97 61.47 1tvs h PHE 41 Cb 0.91 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 1tvs h PHE 41 CO 0.01 0.56 0.11 -0.07 -2.23 0.00 0.00 178.31 176.68 1tvs h LEU 42 N 0.00 0.06 -1.48 0.59 4.07 -0.11 0.44 115.31 118.88 1tvs h LEU 42 Ca 0.04 -0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.94 1tvs h LEU 42 Cb 0.44 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 1tvs h LEU 42 CO 0.01 0.04 -0.26 -0.09 -1.08 0.00 0.00 178.44 177.06 1tvs h ARG 43 N 0.07 0.00 -0.58 1.13 2.43 0.44 -3.35 114.38 114.52 1tvs h ARG 43 Ca 0.07 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.96 1tvs h ARG 43 Cb 0.20 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 29.39 1tvs h ARG 43 CO -0.01 0.26 -1.01 -1.13 -1.51 0.00 0.00 179.97 176.57 1tvs n SER 44 N -4.18 0.96 -3.75 -3.80 3.41 0.53 -4.88 113.62 101.91 1tvs n SER 44 Ca -0.02 -2.34 -0.38 0.00 -0.26 0.00 0.00 58.87 55.87 1tvs n SER 44 Cb 0.32 -0.27 -0.11 0.00 -0.26 0.00 0.00 64.21 63.88 1tvs n SER 44 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1tvs n LEU 45 N -0.48 1.46 -0.39 1.04 4.32 0.12 -3.43 117.00 119.65 1tvs n LEU 45 Ca 0.05 -1.89 -0.05 0.00 -0.02 0.00 0.00 56.01 54.09 1tvs n LEU 45 Cb 0.82 -0.84 -0.02 0.00 -1.62 0.00 0.00 43.42 41.75 1tvs n LEU 45 CO 0.11 -2.14 -0.05 0.61 -1.22 0.00 0.00 177.39 174.70 1tvs n GLY 46 N 5.19 0.47 4.74 -0.72 0.00 -1.26 -2.94 105.19 110.67 1tvs n GLY 46 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.48 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 -2.06 0.00 0.21 -0.61 -0.00 -1.22 -4.60 119.36 111.08 1tvs n ILE 47 Ca -0.05 0.00 0.07 0.00 -0.00 0.00 0.00 62.75 62.77 1tvs n ILE 47 Cb 0.54 0.00 0.47 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 0.79 7.28 3.58 -1.93 0.12 116.42 126.26 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 0.29 0.00 0.22 -2.88 0.00 0.00 179.24 176.87 1tvs h TYR 49 N 0.00 0.00 0.00 0.28 3.20 -1.78 0.52 116.97 119.19 1tvs h TYR 49 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 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 -0.72 -0.07 -1.64 0.00 0.00 178.16 175.73 1tvs h LEU 50 N 0.00 0.00 -0.79 2.82 -0.00 -1.04 0.60 115.31 116.89 1tvs h LEU 50 Ca 0.00 -0.00 -0.10 0.00 -0.00 0.00 0.00 57.88 57.77 1tvs h LEU 50 Cb 0.40 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.04 1tvs h LEU 50 CO 0.00 0.00 -0.20 -0.78 -0.00 0.00 0.00 178.44 177.46 1tvs h ASP 51 N 0.00 0.69 0.33 -0.43 1.82 -0.93 -0.88 116.42 117.02 1tvs h ASP 51 Ca 0.00 -0.23 -0.01 0.00 -0.39 0.00 0.00 57.03 56.40 1tvs h ASP 51 Cb 1.00 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 40.81 1tvs h ASP 51 CO 0.00 0.89 -0.24 0.00 -1.61 0.00 0.00 179.24 178.28 1tvs h ALA 52 N 1.17 -0.56 -0.44 -0.78 0.00 0.85 0.99 119.26 120.50 1tvs h ALA 52 Ca 0.09 -0.10 0.13 0.00 0.00 0.00 0.00 54.91 55.03 1tvs h ALA 52 Cb 0.68 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1tvs h ALA 52 CO 0.05 -0.83 0.49 1.03 0.00 0.00 0.00 179.25 179.99 1tvs h SER 53 N -0.57 0.00 0.00 0.00 0.87 0.84 -1.90 113.55 112.79 1tvs h SER 53 Ca -0.03 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1tvs h SER 53 Cb 0.49 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 1tvs h SER 53 CO 0.01 0.00 -0.29 0.18 -0.53 0.00 0.00 176.83 176.20 1tvs n LEU 54 N -3.65 2.20 0.09 2.23 4.77 -0.35 -4.84 117.00 117.44 1tvs n LEU 54 Ca 0.08 -3.14 0.05 0.00 -0.03 0.00 0.00 56.01 52.97 1tvs n LEU 54 Cb 0.67 -0.40 0.27 0.00 -2.33 0.00 0.00 43.42 41.62 1tvs n LEU 54 CO 0.27 0.91 0.67 0.54 -1.33 0.00 0.00 177.39 178.44 1tvs n ARG 55 N -1.09 0.06 -0.09 3.23 5.12 0.33 -1.94 116.66 122.28 1tvs n ARG 55 Ca 0.15 0.53 0.19 0.00 -1.93 0.00 0.00 57.85 56.79 1tvs n ARG 55 Cb 0.69 -1.80 0.61 0.00 -1.16 0.00 0.00 32.46 30.81 1tvs n ARG 55 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 1tvs h LYS 56 N 0.00 0.18 0.06 5.56 1.57 -1.85 -0.53 116.57 121.55 1tvs h LYS 56 Ca 0.00 -0.01 -0.32 0.00 -1.87 0.00 0.00 60.65 58.45 1tvs h LYS 56 Cb 0.18 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1tvs h LYS 56 CO 0.00 0.12 -1.80 -0.22 -0.57 0.00 0.00 179.45 176.98 1tvs h LYS 57 N 0.19 0.12 0.00 3.15 1.63 -1.77 -3.35 116.57 116.54 1tvs h LYS 57 Ca 0.33 -0.20 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1tvs h LYS 57 Cb 1.02 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 1tvs h LYS 57 CO -0.06 0.81 0.00 -0.97 -3.45 0.00 0.00 179.45 175.79 1tvs h ASN 58 N 0.03 0.00 0.00 4.20 -0.73 -1.23 -3.19 115.58 114.66 1tvs h ASN 58 Ca -0.33 0.00 -0.65 0.00 1.87 0.00 0.00 56.30 57.19 1tvs h ASN 58 Cb 2.02 0.00 0.01 0.00 0.27 0.00 0.00 38.32 40.62 1tvs h ASN 58 CO 0.09 0.00 2.78 2.29 -0.37 0.00 0.00 177.43 182.22 1tvs n LYS 59 N -2.56 2.26 0.00 6.67 2.85 -0.54 -0.77 118.16 126.07 1tvs n LYS 59 Ca 0.00 -2.12 0.00 0.00 -1.05 0.00 0.00 58.31 55.14 1tvs n LYS 59 Cb 0.18 -3.00 0.00 0.00 -0.65 0.00 0.00 35.03 31.56 1tvs n LYS 59 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1tvs n GLN 60 N 6.09 0.00 -0.33 -1.58 6.02 -1.25 -5.01 117.38 121.32 1tvs n GLN 60 Ca 0.52 0.00 0.36 0.00 -0.01 0.00 0.00 57.00 57.87 1tvs n GLN 60 Cb 0.36 0.00 0.75 0.00 1.02 0.00 0.00 30.24 32.37 1tvs n GLN 60 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1tvs h ARG 61 N 0.00 0.00 -1.05 -1.09 3.08 -0.93 -1.43 114.38 112.96 1tvs h ARG 61 Ca 0.00 -0.00 0.28 0.00 0.07 0.00 0.00 59.98 60.33 1tvs h ARG 61 Cb 0.00 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.94 1tvs h ARG 61 CO 0.00 0.00 0.66 1.37 -1.07 0.00 0.00 179.97 180.93 1tvs h LEU 62 N 0.00 0.50 0.00 3.04 -0.00 -1.93 0.60 115.31 117.53 1tvs h LEU 62 Ca 0.57 0.11 -0.34 0.00 -0.00 0.00 0.00 57.88 58.23 1tvs h LEU 62 Cb 2.30 0.04 -0.06 0.00 -0.00 0.00 0.00 40.66 42.93 1tvs h LEU 62 CO -0.01 0.05 -2.18 0.29 -0.00 0.00 0.00 178.44 176.59 1tvs n LYS 63 N -4.74 0.67 0.18 0.17 4.76 -0.56 -4.32 118.16 114.33 1tvs n LYS 63 Ca 0.27 0.08 0.04 0.00 -2.87 0.00 0.00 58.31 55.83 1tvs n LYS 63 Cb 0.90 -1.60 0.33 0.00 -1.84 0.00 0.00 35.03 32.81 1tvs n LYS 63 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1tvs h ALA 64 N 1.02 1.04 -0.18 7.82 0.00 -0.95 -2.54 119.26 125.47 1tvs h ALA 64 Ca -0.46 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.06 1tvs h ALA 64 Cb 2.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.87 1tvs h ALA 64 CO 0.04 0.51 0.03 0.97 0.00 0.00 0.00 179.25 180.80 1tvs h ILE 65 N 0.00 1.10 -0.62 0.00 6.09 -0.05 -1.09 117.51 122.94 1tvs h ILE 65 Ca -0.00 -0.36 0.00 0.00 -1.37 0.00 0.00 64.86 63.13 1tvs h ILE 65 Cb 0.89 0.93 0.00 0.00 0.47 0.00 0.00 36.82 39.11 1tvs h ILE 65 CO 0.05 0.13 0.00 0.00 -3.07 0.00 0.00 178.15 175.26 1tvs n GLN 66 N -4.42 3.07 0.00 2.19 3.00 -1.10 -4.96 117.38 115.16 1tvs n GLN 66 Ca -0.00 -2.63 0.00 0.00 -0.01 0.00 0.00 57.00 54.36 1tvs n GLN 66 Cb 0.15 -1.62 0.00 0.00 0.00 0.00 0.00 30.24 28.77 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 1.20 -0.02 0.04 -1.09 1.13 -0.41 -4.93 117.38 113.29 1tvs n GLN 67 Ca 0.22 0.00 0.10 0.00 -1.94 0.00 0.00 57.00 55.39 1tvs n GLN 67 Cb 0.68 0.00 0.43 0.00 0.11 0.00 0.00 30.24 31.46 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 4.31 -1.26 2.97 1.08 0.00 -1.26 -4.95 105.19 106.09 1tvs n GLY 68 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 1tvs n GLY 68 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1tvs n ARG 69 N -1.76 -1.41 -1.18 1.61 0.00 -1.26 -5.03 116.66 107.63 1tvs n ARG 69 Ca 0.04 1.55 -0.26 0.00 -0.00 0.00 0.00 57.85 59.17 1tvs n ARG 69 Cb 0.25 -5.60 0.21 0.00 0.00 0.00 0.00 32.46 27.32 1tvs n ARG 69 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1tvs n GLN 70 N -1.54 -2.34 -0.81 -0.14 1.13 -1.26 -4.78 117.38 107.65 1tvs n GLN 70 Ca 0.02 -1.65 -0.35 0.00 -1.94 0.00 0.00 57.00 53.08 1tvs n GLN 70 Cb 0.49 -1.38 -0.11 0.00 0.11 0.00 0.00 30.24 29.35 1tvs n GLN 70 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1tvs n PRO 71 N -4.16 0.02 0.00 -1.09 -0.04 -1.26 -4.36 135.00 124.11 1tvs n PRO 71 Ca 0.14 -1.13 0.00 0.00 -0.04 0.00 0.00 63.50 62.47 1tvs n PRO 71 Cb 0.52 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.18 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 7.81 0.00 0.06 0.54 6.02 -1.26 -4.58 117.38 125.98 1tvs n GLN 72 Ca 0.43 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 57.30 1tvs n GLN 72 Cb 0.43 -2.79 -0.02 0.00 1.02 0.00 0.00 30.24 28.88 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 0.55 -0.23 1.08 -0.00 -1.92 -3.14 116.97 113.31 1tvs h TYR 73 Ca 0.00 -0.29 -0.17 0.00 0.00 0.00 0.00 58.73 58.28 1tvs h TYR 73 Cb 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 36.73 36.66 1tvs h TYR 73 CO 0.00 1.09 -0.53 1.25 -0.00 0.00 0.00 178.16 179.96 1tvs h LEU 74 N 0.23 0.75 0.00 0.10 5.85 -1.81 -3.42 115.31 117.01 1tvs h LEU 74 Ca -0.06 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1tvs h LEU 74 Cb 1.49 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1tvs h LEU 74 CO 0.15 1.14 0.00 -0.11 -0.34 0.00 0.00 178.44 179.28