#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 2.50 -0.64 1.96 8.01 -1.26 -5.04 118.70 124.24 1tvs s GLU 2 Ca 0.00 -0.83 0.01 0.00 0.01 0.00 0.00 54.97 54.17 1tvs s GLU 2 Cb 0.00 -2.06 0.39 0.00 -4.31 0.00 0.00 34.13 28.16 1tvs s GLU 2 CO 0.00 0.29 1.61 -3.47 0.01 0.00 0.00 175.26 173.70 1tvs n ASP 3 N 3.16 6.25 -3.52 -0.19 -0.08 -1.26 -4.90 116.55 116.01 1tvs n ASP 3 Ca -0.18 -3.78 -0.41 0.00 -1.51 0.00 0.00 54.79 48.91 1tvs n ASP 3 Cb 0.52 -0.77 -0.01 0.00 2.34 0.00 0.00 41.12 43.20 1tvs n ASP 3 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1tvs n ARG 4 N -0.56 3.28 -0.13 -0.67 1.85 -1.26 -4.45 116.66 114.72 1tvs n ARG 4 Ca 0.48 -2.41 -0.27 0.00 -1.00 0.00 0.00 57.85 54.65 1tvs n ARG 4 Cb 0.48 -3.05 -0.09 0.00 -1.05 0.00 0.00 32.46 28.75 1tvs n ARG 4 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1tvs n ARG 5 N 4.85 0.58 -1.05 2.89 1.74 -1.26 -5.13 116.66 119.29 1tvs n ARG 5 Ca 0.65 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 58.00 1tvs n ARG 5 Cb 0.31 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 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 -4.28 -3.70 0.00 0.55 5.41 -1.26 -4.73 119.36 111.35 1tvs n ILE 6 Ca -0.49 1.50 0.00 0.00 1.00 0.00 0.00 62.75 64.76 1tvs n ILE 6 Cb 0.84 -2.33 0.00 0.00 -0.71 0.00 0.00 39.64 37.44 1tvs n ILE 6 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1tvs n PRO 7 N -0.11 2.21 -0.13 0.38 -0.04 -1.26 -4.22 135.00 131.83 1tvs n PRO 7 Ca 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.49 1tvs n PRO 7 Cb 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 33.52 1tvs n PRO 7 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tvs n GLY 8 N 2.71 -0.58 0.53 0.55 0.00 -1.26 0.24 105.19 107.39 1tvs n GLY 8 Ca 0.00 0.38 0.44 0.00 0.00 0.00 0.00 46.02 46.84 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 -4.54 -0.19 -0.03 2.61 -2.24 -1.26 0.13 114.28 108.76 1tvs n THR 9 Ca 0.06 1.74 -0.15 0.00 -2.27 0.00 0.00 64.05 63.43 1tvs n THR 9 Cb 0.20 -2.86 -0.12 0.00 -2.10 0.00 0.00 70.33 65.45 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 1.46 0.03 -0.90 6.98 0.00 -0.38 0.70 119.26 127.15 1tvs h ALA 10 Ca 0.90 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 1tvs h ALA 10 Cb 3.09 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 20.85 1tvs h ALA 10 CO -0.36 0.09 0.51 0.93 0.00 0.00 0.00 179.25 180.42 1tvs h GLU 11 N -0.51 1.23 -0.32 0.00 3.07 -0.70 -1.35 114.58 116.01 1tvs h GLU 11 Ca -0.03 -0.13 -0.08 0.00 -0.50 0.00 0.00 59.36 58.62 1tvs h GLU 11 Cb 1.03 -0.25 -0.02 0.00 -0.84 0.00 0.00 28.75 28.67 1tvs h GLU 11 CO 0.05 0.89 -0.14 1.49 -1.40 0.00 0.00 179.01 179.90 1tvs h GLU 12 N 1.25 0.55 -1.06 2.33 4.57 0.11 -3.06 114.58 119.27 1tvs h GLU 12 Ca 0.32 -0.17 0.29 0.00 -1.18 0.00 0.00 59.36 58.61 1tvs h GLU 12 Cb -0.00 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 28.46 1tvs h GLU 12 CO -0.05 0.68 0.72 -0.91 -1.18 0.00 0.00 179.01 178.27 1tvs h ASN 13 N 0.51 0.24 0.39 1.04 2.35 0.16 0.81 115.58 121.08 1tvs h ASN 13 Ca 0.09 0.04 -0.32 0.00 -0.55 0.00 0.00 56.30 55.57 1tvs h ASN 13 Cb 0.54 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.93 1tvs h ASN 13 CO 0.03 0.05 -1.49 -0.07 -1.65 0.00 0.00 177.43 174.30 1tvs h LEU 14 N 0.21 0.59 0.03 1.61 4.07 -1.59 -3.38 115.31 116.85 1tvs h LEU 14 Ca 0.56 -0.71 -0.00 0.00 0.08 0.00 0.00 57.88 57.80 1tvs h LEU 14 Cb 1.76 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 43.31 1tvs h LEU 14 CO -0.16 1.57 -0.02 -0.61 -1.08 0.00 0.00 178.44 178.15 1tvs h GLN 15 N 0.10 -0.04 -3.72 1.13 4.15 -0.73 -3.49 115.11 112.52 1tvs h GLN 15 Ca -0.24 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 58.96 1tvs h GLN 15 Cb 2.07 0.01 0.08 0.00 0.21 0.00 0.00 27.48 29.85 1tvs h GLN 15 CO 0.21 0.58 -0.38 1.63 -1.93 0.00 0.00 178.83 178.94 1tvs n LYS 16 N -4.73 -4.39 -2.78 1.69 4.01 0.25 -4.96 118.16 107.25 1tvs n LYS 16 Ca -0.07 0.46 -0.02 0.00 -0.51 0.00 0.00 58.31 58.18 1tvs n LYS 16 Cb 0.31 -4.38 0.07 0.00 -0.51 0.00 0.00 35.03 30.51 1tvs n LYS 16 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1tvs n SER 17 N -1.10 0.81 -2.14 4.39 2.88 -1.26 -4.91 113.62 112.29 1tvs n SER 17 Ca -0.01 -2.15 0.00 0.00 -1.33 0.00 0.00 58.87 55.39 1tvs n SER 17 Cb 0.54 -0.19 0.04 0.00 -0.75 0.00 0.00 64.21 63.84 1tvs n SER 17 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1tvs n SER 18 N -0.74 0.70 -4.39 -3.46 2.88 -1.26 -5.04 113.62 102.31 1tvs n SER 18 Ca 0.02 -2.04 -0.45 0.00 -1.33 0.00 0.00 58.87 55.07 1tvs n SER 18 Cb 0.82 -0.18 -0.02 0.00 -0.75 0.00 0.00 64.21 64.08 1tvs n SER 18 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1tvs s GLY 19 N -2.52 2.47 -1.13 0.46 0.00 -1.26 -4.95 107.32 100.39 1tvs s GLY 19 Ca 0.24 -3.22 -0.07 0.00 0.00 0.00 0.00 44.72 41.67 1tvs s GLY 19 CO -0.09 1.63 1.43 0.61 0.00 0.00 0.00 173.10 176.68 1tvs n GLY 20 N 4.31 4.71 3.35 0.20 0.00 -1.26 -4.99 105.19 111.50 1tvs n GLY 20 Ca 0.22 -2.52 -0.40 0.00 0.00 0.00 0.00 46.02 43.32 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 -1.61 4.40 0.02 1.61 -7.23 -1.26 -4.98 120.40 111.36 1tvs s VAL 21 Ca 0.33 -0.96 -0.18 0.00 -1.81 0.00 0.00 61.98 59.37 1tvs s VAL 21 Cb 0.01 -3.48 -0.25 0.00 0.56 0.00 0.00 36.38 33.21 1tvs s VAL 21 CO 0.03 -0.25 1.10 1.55 -0.31 0.00 0.00 175.10 177.22 1tvs h PRO 22 N 8.39 0.51 -4.08 4.82 0.13 -2.06 -3.49 132.00 136.22 1tvs h PRO 22 Ca -0.25 -0.60 -0.13 0.00 -0.87 0.00 0.00 66.00 64.16 1tvs h PRO 22 Cb 1.10 0.18 0.09 0.00 0.13 0.00 0.00 31.00 32.50 1tvs h PRO 22 CO 0.66 1.22 -0.40 0.41 -0.23 0.00 0.00 178.00 179.67 1tvs n GLY 23 N 1.20 -0.05 0.00 1.56 0.00 -1.26 -4.94 105.19 101.70 1tvs n GLY 23 Ca -0.12 0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.36 0.82 -0.07 1.61 -0.00 -1.26 -3.78 117.38 112.34 1tvs n GLN 24 Ca -0.05 0.00 -0.22 0.00 -0.00 0.00 0.00 57.00 56.73 1tvs n GLN 24 Cb 0.56 -1.34 -0.12 0.00 -0.00 0.00 0.00 30.24 29.34 1tvs n GLN 24 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.06 176.09 1tvs h ASN 25 N 0.00 0.11 -0.33 2.61 -0.73 -1.92 -2.10 115.58 113.23 1tvs h ASN 25 Ca 0.00 -0.62 0.02 0.00 1.87 0.00 0.00 56.30 57.56 1tvs h ASN 25 Cb 0.00 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.53 1tvs h ASN 25 CO 0.00 1.59 0.18 0.00 -0.37 0.00 0.00 177.43 178.84 1tvs h THR 26 N -0.72 1.02 -0.20 -3.57 1.03 -1.98 -3.38 112.91 105.12 1tvs h THR 26 Ca -0.37 -0.13 -0.22 0.00 -0.01 0.00 0.00 66.41 65.68 1tvs h THR 26 Cb 1.50 0.61 -0.22 0.00 -1.07 0.00 0.00 68.15 68.97 1tvs h THR 26 CO -0.13 0.07 -0.55 0.61 -0.01 0.00 0.00 175.52 175.51 1tvs n GLY 27 N -1.19 1.69 0.00 2.99 0.00 -1.26 -5.11 105.19 102.31 1tvs n GLY 27 Ca -0.00 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.89 3.14 3.18 -0.02 0.00 -0.79 -4.96 105.19 104.84 1tvs n GLY 28 Ca -0.06 -1.68 -0.14 0.00 0.00 0.00 0.00 46.02 44.15 1tvs n GLY 28 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1tvs s GLN 29 N 4.99 0.85 0.00 1.61 1.03 -1.19 -4.83 119.66 122.12 1tvs s GLN 29 Ca 0.00 -1.19 0.00 0.00 0.04 0.00 0.00 55.36 54.21 1tvs s GLN 29 Cb 0.00 -0.50 0.00 0.00 0.03 0.00 0.00 33.01 32.54 1tvs s GLN 29 CO 0.00 0.07 0.00 0.39 -2.54 0.00 0.00 175.29 173.21 1tvs n GLU 30 N 0.46 0.00 -0.10 9.60 4.71 -1.26 -4.77 120.64 129.28 1tvs n GLU 30 Ca -0.15 0.00 -0.23 0.00 -0.01 0.00 0.00 57.16 56.76 1tvs n GLU 30 Cb 0.58 -4.09 -0.11 0.00 -1.01 0.00 0.00 31.44 26.80 1tvs n GLU 30 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1tvs n ALA 31 N 0.99 0.89 -1.85 0.62 0.00 -1.26 -4.92 120.51 114.98 1tvs n ALA 31 Ca 0.00 -0.63 -0.41 0.00 0.00 0.00 0.00 53.44 52.40 1tvs n ALA 31 Cb 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.99 1tvs n ALA 31 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1tvs s ARG 32 N -2.41 4.51 -0.06 0.00 3.00 -1.26 -4.99 118.95 117.73 1tvs s ARG 32 Ca -0.30 1.94 -0.30 0.00 0.00 0.00 0.00 55.73 57.07 1tvs s ARG 32 Cb 0.08 -3.17 -0.03 0.00 0.00 0.00 0.00 34.95 31.83 1tvs s ARG 32 CO 0.59 0.00 1.12 -1.25 0.00 0.00 0.00 175.30 175.76 1tvs s PRO 33 N -1.12 4.40 -0.34 3.54 0.04 -1.26 -4.42 135.00 135.84 1tvs s PRO 33 Ca 0.49 1.57 -0.06 0.00 0.04 0.00 0.00 61.00 63.04 1tvs s PRO 33 Cb -0.34 -3.53 0.01 0.00 0.04 0.00 0.00 34.50 30.67 1tvs s PRO 33 CO 0.43 -0.36 0.21 -1.71 0.04 0.00 0.00 177.00 175.61 1tvs n ASN 34 N 4.96 -7.75 -0.01 6.66 5.15 -1.26 -5.03 115.26 117.97 1tvs n ASN 34 Ca 0.10 1.06 -0.05 0.00 -0.60 0.00 0.00 54.58 55.09 1tvs n ASN 34 Cb 0.47 -5.18 -0.02 0.00 -0.53 0.00 0.00 39.78 34.53 1tvs n ASN 34 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1tvs n TYR 35 N 0.31 0.00 0.80 1.20 4.11 -1.26 -4.73 117.16 117.59 1tvs n TYR 35 Ca 0.04 0.00 0.06 0.00 -0.00 0.00 0.00 57.90 58.00 1tvs n TYR 35 Cb 0.16 -0.19 0.16 0.00 -0.00 0.00 0.00 39.34 39.48 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 -3.51 0.52 -0.32 -3.48 1.44 -1.26 -4.92 115.22 103.69 1tvs n HIS 36 Ca -0.09 -0.25 0.00 0.00 -2.01 0.00 0.00 57.72 55.37 1tvs n HIS 36 Cb 0.38 -0.02 0.00 0.00 0.12 0.00 0.00 29.99 30.47 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 1.59 0.77 -0.29 0.00 5.75 -1.97 0.39 115.11 121.35 1tvs h GLN 38 Ca 0.00 -0.51 -0.06 0.00 -0.15 0.00 0.00 58.65 57.92 1tvs h GLN 38 Cb 0.00 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 1tvs h GLN 38 CO 0.00 1.14 -0.09 -0.07 -2.65 0.00 0.00 178.83 177.15 1tvs h LEU 39 N 0.57 0.45 -1.27 -2.39 -0.00 -1.95 0.52 115.31 111.24 1tvs h LEU 39 Ca -0.00 -0.11 -0.08 0.00 -0.00 0.00 0.00 57.88 57.70 1tvs h LEU 39 Cb 1.19 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 41.72 1tvs h LEU 39 CO 0.12 0.59 -0.36 0.00 -0.00 0.00 0.00 178.44 178.80 1tvs h PHE 41 N 0.00 0.53 0.00 0.00 3.04 0.12 -1.58 116.94 119.05 1tvs h PHE 41 Ca -0.00 -0.09 -0.03 0.00 3.98 0.00 0.00 57.97 61.82 1tvs h PHE 41 Cb 0.66 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 39.03 1tvs h PHE 41 CO 0.00 0.64 -0.14 -0.07 -2.02 0.00 0.00 178.31 176.72 1tvs h LEU 42 N 0.26 0.00 -1.33 0.59 4.07 -0.33 1.06 115.31 119.64 1tvs h LEU 42 Ca 0.08 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.05 1tvs h LEU 42 Cb 0.44 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.14 1tvs h LEU 42 CO 0.02 0.14 0.46 -0.09 -1.08 0.00 0.00 178.44 177.88 1tvs h ARG 43 N 0.00 0.89 0.00 1.13 1.12 -0.10 -3.37 114.38 114.06 1tvs h ARG 43 Ca -0.00 -0.05 -0.15 0.00 -1.11 0.00 0.00 59.98 58.66 1tvs h ARG 43 Cb 0.35 -0.20 -0.25 0.00 -0.01 0.00 0.00 29.97 29.86 1tvs h ARG 43 CO 0.02 0.59 -0.64 0.45 -3.11 0.00 0.00 179.97 177.28 1tvs n SER 44 N -4.44 -0.04 -3.53 -3.80 2.88 -0.55 -4.92 113.62 99.23 1tvs n SER 44 Ca 0.08 -1.99 -0.41 0.00 -1.33 0.00 0.00 58.87 55.22 1tvs n SER 44 Cb 0.05 0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 63.51 1tvs n SER 44 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tvs n LEU 45 N 0.24 7.82 -1.97 2.46 -0.00 0.36 -4.49 117.00 121.41 1tvs n LEU 45 Ca -0.11 -4.41 -0.00 0.00 -0.00 0.00 0.00 56.01 51.49 1tvs n LEU 45 Cb 0.91 -1.55 -0.00 0.00 -0.00 0.00 0.00 43.42 42.77 1tvs n LEU 45 CO -0.09 1.69 -0.20 0.61 -0.00 0.00 0.00 177.39 179.39 1tvs n GLY 46 N 3.38 -3.47 0.09 1.47 0.00 -1.26 -4.51 105.19 100.89 1tvs n GLY 46 Ca 0.63 0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.81 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 0.33 1.38 0.25 -0.61 -0.00 -1.26 0.55 119.36 120.00 1tvs n ILE 47 Ca -0.02 0.59 0.13 0.00 -0.00 0.00 0.00 62.75 63.45 1tvs n ILE 47 Cb 0.03 -1.58 0.65 0.00 -0.00 0.00 0.00 39.64 38.74 1tvs n ILE 47 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.55 176.99 1tvs h ASP 48 N 0.00 0.00 1.16 7.28 5.19 -1.99 0.24 116.42 128.30 1tvs h ASP 48 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1tvs h ASP 48 Cb 0.04 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1tvs h ASP 48 CO 0.00 0.14 0.00 0.22 -3.12 0.00 0.00 179.24 176.48 1tvs h TYR 49 N 0.00 0.00 0.00 4.55 3.20 -0.13 -1.43 116.97 123.16 1tvs h TYR 49 Ca -0.00 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 1tvs h TYR 49 Cb 0.50 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 1tvs h TYR 49 CO 0.00 0.00 -0.56 -0.07 -1.64 0.00 0.00 178.16 175.89 1tvs h LEU 50 N 0.00 0.00 -1.19 2.82 -0.00 -0.60 0.93 115.31 117.27 1tvs h LEU 50 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.81 1tvs h LEU 50 Cb 0.58 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.22 1tvs h LEU 50 CO 0.00 0.22 -0.17 -0.78 -0.00 0.00 0.00 178.44 177.71 1tvs h ASP 51 N 0.00 0.34 0.09 -0.43 1.82 -1.11 -1.61 116.42 115.52 1tvs h ASP 51 Ca -0.02 -0.09 -0.00 0.00 -0.39 0.00 0.00 57.03 56.52 1tvs h ASP 51 Cb 1.19 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 41.11 1tvs h ASP 51 CO 0.02 0.54 -0.04 0.00 -1.61 0.00 0.00 179.24 178.15 1tvs h ALA 52 N 1.50 -0.12 -1.07 -0.78 0.00 0.23 0.30 119.26 119.32 1tvs h ALA 52 Ca 0.06 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 55.09 1tvs h ALA 52 Cb 0.49 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 1tvs h ALA 52 CO 0.03 -0.40 0.74 0.77 0.00 0.00 0.00 179.25 180.40 1tvs h SER 53 N -0.46 0.15 -0.51 0.00 0.02 0.16 -0.60 113.55 112.31 1tvs h SER 53 Ca -0.01 0.03 -0.38 0.00 -0.84 0.00 0.00 61.79 60.59 1tvs h SER 53 Cb 0.39 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 62.62 1tvs h SER 53 CO 0.02 0.03 -0.75 -0.11 -1.14 0.00 0.00 176.83 174.88 1tvs n LEU 54 N -4.35 4.08 -0.55 5.07 7.94 -0.69 -4.90 117.00 123.60 1tvs n LEU 54 Ca 0.24 -4.38 0.46 0.00 -1.11 0.00 0.00 56.01 51.21 1tvs n LEU 54 Cb 1.05 -0.35 0.71 0.00 0.53 0.00 0.00 43.42 45.37 1tvs n LEU 54 CO 0.35 1.83 1.42 0.08 -1.11 0.00 0.00 177.39 179.97 1tvs h ARG 55 N 1.85 0.00 -0.81 1.96 -0.00 0.13 0.20 114.38 117.71 1tvs h ARG 55 Ca 0.23 0.00 0.12 0.00 -0.00 0.00 0.00 59.98 60.33 1tvs h ARG 55 Cb 1.39 0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 31.30 1tvs h ARG 55 CO 0.51 0.00 0.53 -0.22 -0.00 0.00 0.00 179.97 180.79 1tvs h LYS 56 N 0.00 0.62 0.02 0.08 1.63 -1.87 -0.05 116.57 116.99 1tvs h LYS 56 Ca 0.80 -0.04 -0.21 0.00 -0.85 0.00 0.00 60.65 60.35 1tvs h LYS 56 Cb 3.49 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 34.97 1tvs h LYS 56 CO -0.01 0.41 -0.93 0.87 -3.45 0.00 0.00 179.45 176.34 1tvs h LYS 57 N 0.64 0.19 0.00 1.90 1.79 -0.93 -3.39 116.57 116.77 1tvs h LYS 57 Ca 0.39 -0.23 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 1tvs h LYS 57 Cb 0.62 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1tvs h LYS 57 CO -0.15 0.99 0.00 -1.71 -1.08 0.00 0.00 179.45 177.49 1tvs n ASN 58 N -3.62 0.00 -4.12 0.86 2.85 -0.05 -4.38 115.26 106.79 1tvs n ASN 58 Ca -0.04 0.30 -0.37 0.00 -0.11 0.00 0.00 54.58 54.36 1tvs n ASN 58 Cb 0.84 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.83 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 -0.31 -0.99 -2.46 1.20 5.02 -1.09 -0.97 118.16 118.56 1tvs n LYS 59 Ca 0.00 0.15 -0.02 0.00 -2.02 0.00 0.00 58.31 56.42 1tvs n LYS 59 Cb 0.00 -3.33 0.01 0.00 -0.02 0.00 0.00 35.03 31.69 1tvs n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1tvs n GLN 60 N -4.72 -0.76 -0.32 1.97 10.64 -1.26 -4.74 117.38 118.19 1tvs n GLN 60 Ca -0.22 0.08 0.33 0.00 -1.83 0.00 0.00 57.00 55.36 1tvs n GLN 60 Cb 0.63 -2.84 0.51 0.00 -0.86 0.00 0.00 30.24 27.68 1tvs n GLN 60 CO 0.00 0.00 0.00 2.89 -1.83 0.00 0.00 177.06 178.12 1tvs n ARG 61 N -1.07 0.01 -2.23 2.61 -4.01 -0.15 -2.05 116.66 109.77 1tvs n ARG 61 Ca -0.01 1.02 -0.33 0.00 -1.04 0.00 0.00 57.85 57.50 1tvs n ARG 61 Cb 0.51 -2.51 -0.04 0.00 -3.04 0.00 0.00 32.46 27.38 1tvs n ARG 61 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 1tvs s LEU 62 N -6.72 3.30 0.00 2.89 1.43 -1.26 0.03 118.68 118.35 1tvs s LEU 62 Ca -0.03 -1.87 0.00 0.00 -1.03 0.00 0.00 54.13 51.20 1tvs s LEU 62 Cb 0.17 -2.59 0.00 0.00 0.03 0.00 0.00 46.19 43.80 1tvs s LEU 62 CO 0.55 -2.47 0.00 1.17 0.23 0.00 0.00 176.35 175.83 1tvs n LYS 63 N 8.35 0.00 0.01 1.70 4.81 -1.24 -4.91 118.16 126.88 1tvs n LYS 63 Ca 0.46 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 58.01 1tvs n LYS 63 Cb 0.46 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.53 1tvs n LYS 63 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1tvs n ALA 64 N 0.00 3.74 -0.24 3.14 0.00 -0.79 -4.04 120.51 122.32 1tvs n ALA 64 Ca 0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 53.44 52.97 1tvs n ALA 64 Cb 0.00 -0.93 0.18 0.00 0.00 0.00 0.00 19.45 18.69 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 1.22 0.00 0.00 6.09 -0.60 -1.03 117.51 123.20 1tvs h ILE 65 Ca 0.00 -0.55 -0.02 0.00 -1.37 0.00 0.00 64.86 62.92 1tvs h ILE 65 Cb 0.65 0.18 -0.00 0.00 0.47 0.00 0.00 36.82 38.11 1tvs h ILE 65 CO 0.00 0.25 -0.17 1.56 -3.07 0.00 0.00 178.15 176.72 1tvs h GLN 66 N 1.07 0.00 0.00 2.19 7.50 -1.80 -3.47 115.11 120.60 1tvs h GLN 66 Ca 0.27 0.00 -0.38 0.00 0.50 0.00 0.00 58.65 59.04 1tvs h GLN 66 Cb 0.01 0.00 0.21 0.00 0.05 0.00 0.00 27.48 27.75 1tvs h GLN 66 CO -0.05 0.11 -0.05 1.04 -1.50 0.00 0.00 178.83 178.38 1tvs n GLN 67 N -3.10 -4.17 0.00 1.46 1.13 -0.39 -5.04 117.38 107.27 1tvs n GLN 67 Ca 0.03 -1.60 0.00 0.00 -1.94 0.00 0.00 57.00 53.49 1tvs n GLN 67 Cb 0.58 -1.80 0.00 0.00 0.11 0.00 0.00 30.24 29.13 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 -5.41 1.05 0.70 1.08 0.00 -1.26 -4.93 105.19 96.42 1tvs n GLY 68 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.84 0.00 -4.00 1.61 3.00 -1.26 -4.87 116.66 110.29 1tvs n ARG 69 Ca 0.00 -0.47 -0.27 0.00 -0.00 0.00 0.00 57.85 57.11 1tvs n ARG 69 Cb 0.00 0.13 -0.03 0.00 0.00 0.00 0.00 32.46 32.56 1tvs n ARG 69 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 1tvs n GLN 70 N 0.02 -3.11 -1.80 -0.14 7.27 -1.26 -4.82 117.38 113.54 1tvs n GLN 70 Ca -0.09 0.38 -0.20 0.00 0.07 0.00 0.00 57.00 57.15 1tvs n GLN 70 Cb 0.60 -4.50 -0.09 0.00 2.41 0.00 0.00 30.24 28.67 1tvs n GLN 70 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1tvs s PRO 71 N -6.65 1.76 0.00 3.69 0.04 -1.26 -4.05 135.00 128.53 1tvs s PRO 71 Ca 0.06 -0.66 0.00 0.00 0.04 0.00 0.00 61.00 60.44 1tvs s PRO 71 Cb -0.03 -5.08 0.00 0.00 0.04 0.00 0.00 34.50 29.43 1tvs s PRO 71 CO 0.90 -4.78 0.00 1.04 0.04 0.00 0.00 177.00 174.20 1tvs n GLN 72 N 8.28 0.00 -0.34 4.56 6.02 -0.84 -4.45 117.38 130.60 1tvs n GLN 72 Ca 0.43 0.00 0.33 0.00 -0.01 0.00 0.00 57.00 57.75 1tvs n GLN 72 Cb 0.47 -0.23 0.68 0.00 1.02 0.00 0.00 30.24 32.17 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 0.21 0.00 1.08 -0.00 -2.01 -2.88 116.97 113.38 1tvs h TYR 73 Ca 0.00 0.01 -0.28 0.00 -0.00 0.00 0.00 58.73 58.45 1tvs h TYR 73 Cb 0.00 -0.06 -0.04 0.00 -0.00 0.00 0.00 36.73 36.63 1tvs h TYR 73 CO 0.00 0.00 -1.90 -0.11 -0.00 0.00 0.00 178.16 176.16 1tvs n LEU 74 N -4.32 1.42 0.00 0.10 -0.00 -1.26 -5.20 117.00 107.73 1tvs n LEU 74 Ca 0.27 0.24 0.00 0.00 -0.00 0.00 0.00 56.01 56.52 1tvs n LEU 74 Cb 1.19 -0.58 0.00 0.00 -0.00 0.00 0.00 43.42 44.03 1tvs n LEU 74 CO 0.35 0.29 0.00 -0.11 -0.00 0.00 0.00 177.39 177.92