#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 1.41 -0.76 3.23 1.03 -1.26 -5.07 118.70 117.28 1tvs s GLU 2 Ca 0.00 -1.24 0.02 0.00 0.03 0.00 0.00 54.97 53.77 1tvs s GLU 2 Cb 0.00 0.43 0.35 0.00 -0.80 0.00 0.00 34.13 34.11 1tvs s GLU 2 CO 0.00 -0.56 1.49 -3.47 -1.33 0.00 0.00 175.26 171.39 1tvs n ASP 3 N -0.33 6.11 -4.59 0.83 2.03 -1.26 -5.04 116.55 114.30 1tvs n ASP 3 Ca -0.03 -3.73 -0.53 0.00 0.52 0.00 0.00 54.79 51.02 1tvs n ASP 3 Cb 0.63 -0.85 -0.07 0.00 -0.72 0.00 0.00 41.12 40.11 1tvs n ASP 3 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1tvs n ARG 4 N -0.28 1.31 -1.02 -0.67 0.00 -1.26 -4.85 116.66 109.88 1tvs n ARG 4 Ca 0.42 0.44 -0.22 0.00 -0.00 0.00 0.00 57.85 58.49 1tvs n ARG 4 Cb 0.36 -2.35 0.08 0.00 -0.00 0.00 0.00 32.46 30.55 1tvs n ARG 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1tvs n ARG 5 N 6.82 2.10 -2.13 2.89 5.12 -1.26 -4.69 116.66 125.51 1tvs n ARG 5 Ca 0.32 -2.26 -0.43 0.00 -1.93 0.00 0.00 57.85 53.55 1tvs n ARG 5 Cb 0.20 -1.89 -0.02 0.00 -1.16 0.00 0.00 32.46 29.59 1tvs n ARG 5 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1tvs s ILE 6 N -3.10 3.68 0.04 0.55 -1.09 -1.26 -4.87 121.20 115.15 1tvs s ILE 6 Ca 0.44 0.73 -0.30 0.00 -2.23 0.00 0.00 60.65 59.29 1tvs s ILE 6 Cb 0.35 -3.80 -0.05 0.00 -1.58 0.00 0.00 42.46 37.39 1tvs s ILE 6 CO 0.02 -0.42 1.10 -2.16 -1.23 0.00 0.00 174.94 172.25 1tvs s PRO 7 N 5.02 4.49 0.00 2.79 0.04 -1.26 -0.77 135.00 145.31 1tvs s PRO 7 Ca 0.72 1.62 0.00 0.00 0.04 0.00 0.00 61.00 63.38 1tvs s PRO 7 Cb -0.22 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1tvs s PRO 7 CO 0.31 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.61 1tvs n GLY 8 N 3.03 3.07 1.47 0.56 0.00 -1.26 -4.77 105.19 107.28 1tvs n GLY 8 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.40 0.37 0.06 2.61 -2.24 -1.22 -4.46 114.28 108.99 1tvs n THR 9 Ca 0.00 0.12 -0.12 0.00 -2.27 0.00 0.00 64.05 61.78 1tvs n THR 9 Cb 0.00 -1.07 -0.09 0.00 -2.10 0.00 0.00 70.33 67.07 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 -0.19 0.00 6.98 0.00 -1.25 0.57 119.26 125.37 1tvs h ALA 10 Ca 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1tvs h ALA 10 Cb 0.25 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1tvs h ALA 10 CO 0.00 -0.36 -0.10 0.93 0.00 0.00 0.00 179.25 179.71 1tvs h GLU 11 N -0.67 0.00 -0.36 0.00 3.07 -1.41 -0.90 114.58 114.31 1tvs h GLU 11 Ca -0.02 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.69 1tvs h GLU 11 Cb 0.50 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 1tvs h GLU 11 CO 0.03 0.10 -0.38 1.49 -1.40 0.00 0.00 179.01 178.86 1tvs h GLU 12 N 0.00 0.87 -6.98 2.33 4.81 -1.71 -3.44 114.58 110.46 1tvs h GLU 12 Ca -0.00 -0.45 -0.44 0.00 -0.13 0.00 0.00 59.36 58.34 1tvs h GLU 12 Cb 0.20 0.01 0.22 0.00 0.63 0.00 0.00 28.75 29.82 1tvs h GLU 12 CO 0.01 1.09 -0.36 0.09 -0.73 0.00 0.00 179.01 179.12 1tvs n ASN 13 N -4.05 -2.03 0.00 1.04 3.02 0.20 -1.15 115.26 112.29 1tvs n ASN 13 Ca -0.02 -0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 1tvs n ASN 13 Cb 0.54 -1.16 0.00 0.00 -0.61 0.00 0.00 39.78 38.55 1tvs n ASN 13 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1tvs n LEU 14 N -3.99 0.00 -0.11 3.41 4.77 -1.26 -4.03 117.00 115.79 1tvs n LEU 14 Ca 0.02 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.87 1tvs n LEU 14 Cb 0.57 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 1tvs n LEU 14 CO 0.56 0.00 0.56 1.56 -1.33 0.00 0.00 177.39 178.74 1tvs h GLN 15 N 0.00 0.83 -4.43 3.23 7.50 -1.84 -3.32 115.11 117.08 1tvs h GLN 15 Ca 0.00 -0.44 -0.72 0.00 0.50 0.00 0.00 58.65 57.99 1tvs h GLN 15 Cb 0.00 0.02 -0.10 0.00 0.05 0.00 0.00 27.48 27.44 1tvs h GLN 15 CO 0.00 1.08 2.31 1.17 -1.50 0.00 0.00 178.83 181.89 1tvs n LYS 16 N -4.16 3.23 -3.49 1.46 4.81 -0.30 -4.97 118.16 114.74 1tvs n LYS 16 Ca -0.03 -3.23 -0.35 0.00 -0.87 0.00 0.00 58.31 53.83 1tvs n LYS 16 Cb 0.51 -3.20 -0.06 0.00 0.02 0.00 0.00 35.03 32.31 1tvs n LYS 16 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1tvs s SER 17 N 2.74 6.72 0.06 3.14 0.15 -1.25 -4.84 113.70 120.42 1tvs s SER 17 Ca 0.46 0.91 -0.07 0.00 0.70 0.00 0.00 55.95 57.95 1tvs s SER 17 Cb 0.08 -2.22 -0.01 0.00 -1.71 0.00 0.00 66.02 62.15 1tvs s SER 17 CO -0.01 0.17 0.13 -0.55 1.20 0.00 0.00 173.24 174.18 1tvs s SER 18 N -1.66 0.18 0.00 5.45 0.15 -1.26 -4.94 113.70 111.61 1tvs s SER 18 Ca 0.33 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.38 1tvs s SER 18 Cb -0.15 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 1tvs s SER 18 CO 0.18 -0.60 0.00 0.61 1.20 0.00 0.00 173.24 174.62 1tvs n GLY 19 N 0.38 2.62 2.86 9.45 0.00 -1.26 -4.90 105.19 114.35 1tvs n GLY 19 Ca -0.17 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 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 4.04 3.42 -0.02 0.00 -1.26 -4.93 105.19 106.44 1tvs n GLY 20 Ca 0.00 -1.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.19 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 3.53 2.41 -1.50 1.61 -7.23 -1.26 -5.04 120.40 112.92 1tvs s VAL 21 Ca 0.49 -1.70 -0.13 0.00 -1.81 0.00 0.00 61.98 58.82 1tvs s VAL 21 Cb 0.13 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 35.00 1tvs s VAL 21 CO -0.05 0.09 2.40 -0.81 -0.31 0.00 0.00 175.10 176.41 1tvs n PRO 22 N 0.86 3.06 -1.93 4.82 -0.04 -1.26 -4.63 135.00 135.88 1tvs n PRO 22 Ca -0.17 -2.52 -0.27 0.00 -0.04 0.00 0.00 63.50 60.50 1tvs n PRO 22 Cb 0.53 -3.17 0.03 0.00 -0.04 0.00 0.00 33.50 30.85 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 3.96 6.25 1.58 0.55 0.00 -1.26 -4.66 105.19 111.60 1tvs n GLY 23 Ca 0.58 -2.61 0.03 0.00 0.00 0.00 0.00 46.02 44.03 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 -0.72 0.41 0.00 1.61 0.00 -1.26 -4.24 117.38 113.17 1tvs n GLN 24 Ca 0.47 -2.33 0.00 0.00 0.00 0.00 0.00 57.00 55.14 1tvs n GLN 24 Cb 0.86 -0.38 0.00 0.00 0.00 0.00 0.00 30.24 30.73 1tvs n GLN 24 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1tvs n ASN 25 N 0.20 0.62 -0.35 2.61 2.85 -1.26 -4.86 115.26 115.06 1tvs n ASN 25 Ca 0.08 -0.00 0.13 0.00 -0.11 0.00 0.00 54.58 54.68 1tvs n ASN 25 Cb 1.06 0.12 0.46 0.00 1.24 0.00 0.00 39.78 42.66 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 -0.19 0.00 -1.31 -0.44 5.66 -1.26 -4.94 114.28 111.80 1tvs n THR 26 Ca 0.00 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 1tvs n THR 26 Cb 0.00 0.43 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 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 1.26 0.99 0.03 1.09 0.00 -1.26 -4.99 105.19 102.31 1tvs n GLY 27 Ca 0.15 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.31 -0.45 0.16 -0.02 0.00 -1.26 -3.90 105.19 99.41 1tvs n GLY 28 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1tvs n GLY 28 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1tvs h GLN 29 N 0.00 0.00 0.00 1.61 4.20 -1.97 -2.79 115.11 116.16 1tvs h GLN 29 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1tvs h GLN 29 Cb 0.00 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 1tvs h GLN 29 CO 0.00 0.08 -0.35 0.93 -0.67 0.00 0.00 178.83 178.82 1tvs h GLU 30 N 0.00 0.00 -0.46 1.46 3.07 -1.85 -3.39 114.58 113.41 1tvs h GLU 30 Ca -0.01 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 1tvs h GLU 30 Cb 1.10 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.99 1tvs h GLU 30 CO 0.01 0.15 -0.09 0.00 -1.40 0.00 0.00 179.01 177.68 1tvs h ALA 31 N -0.90 0.63 -4.31 3.43 0.00 -1.75 -3.49 119.26 112.87 1tvs h ALA 31 Ca -0.03 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1tvs h ALA 31 Cb 0.42 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1tvs h ALA 31 CO -0.02 0.51 -0.56 0.54 0.00 0.00 0.00 179.25 179.73 1tvs n ARG 32 N -4.27 -2.04 -1.82 0.00 1.74 -1.05 -5.00 116.66 104.22 1tvs n ARG 32 Ca -0.00 1.84 -0.32 0.00 -0.77 0.00 0.00 57.85 58.60 1tvs n ARG 32 Cb 0.37 -3.74 0.03 0.00 -1.02 0.00 0.00 32.46 28.10 1tvs n ARG 32 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1tvs s PRO 33 N -1.15 3.07 -0.39 5.56 0.04 -1.26 -5.06 135.00 135.81 1tvs s PRO 33 Ca 0.02 1.15 -0.00 0.00 0.04 0.00 0.00 61.00 62.21 1tvs s PRO 33 Cb -0.01 -2.00 0.19 0.00 0.04 0.00 0.00 34.50 32.72 1tvs s PRO 33 CO 0.48 -1.00 0.87 1.21 0.04 0.00 0.00 177.00 178.59 1tvs s ASN 34 N -3.09 -0.91 0.04 6.66 3.84 -1.26 -4.77 114.94 115.44 1tvs s ASN 34 Ca 0.62 -0.68 0.00 0.00 0.21 0.00 0.00 52.86 53.01 1tvs s ASN 34 Cb -0.16 1.17 0.00 0.00 -0.55 0.00 0.00 41.25 41.71 1tvs s ASN 34 CO 0.44 -0.08 0.00 0.00 -2.79 0.00 0.00 177.10 174.67 1tvs n TYR 35 N 3.58 -0.27 1.86 0.43 4.11 -1.26 -4.84 117.16 120.78 1tvs n TYR 35 Ca 0.11 0.05 0.05 0.00 -0.00 0.00 0.00 57.90 58.10 1tvs n TYR 35 Cb 0.60 0.25 0.25 0.00 -0.00 0.00 0.00 39.34 40.44 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 -2.91 0.05 -0.45 -3.48 1.44 -1.26 -4.89 115.22 103.72 1tvs n HIS 36 Ca 0.00 -0.03 0.00 0.00 -2.01 0.00 0.00 57.72 55.68 1tvs n HIS 36 Cb 0.20 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.31 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 1.84 0.53 0.00 0.00 4.15 -1.98 0.14 115.11 119.79 1tvs h GLN 38 Ca 0.00 -0.61 -0.07 0.00 0.77 0.00 0.00 58.65 58.73 1tvs h GLN 38 Cb 0.00 0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 1tvs h GLN 38 CO 0.00 1.23 -0.35 -0.07 -1.93 0.00 0.00 178.83 177.71 1tvs h LEU 39 N 0.09 0.00 -0.78 -2.39 -0.00 -1.87 0.82 115.31 111.17 1tvs h LEU 39 Ca -0.12 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.64 1tvs h LEU 39 Cb 1.56 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 42.21 1tvs h LEU 39 CO 0.17 0.35 -0.57 0.00 -0.00 0.00 0.00 178.44 178.39 1tvs h PHE 41 N 0.00 0.10 -0.00 0.00 3.57 0.92 -0.40 116.94 121.12 1tvs h PHE 41 Ca -0.01 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1tvs h PHE 41 Cb 1.07 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 1tvs h PHE 41 CO 0.00 0.40 0.00 -0.07 -2.23 0.00 0.00 178.31 176.42 1tvs h LEU 42 N -0.24 0.00 -0.98 0.59 4.07 -0.59 0.69 115.31 118.85 1tvs h LEU 42 Ca 0.01 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.88 1tvs h LEU 42 Cb 0.37 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.10 1tvs h LEU 42 CO 0.00 0.00 -0.46 0.08 -1.08 0.00 0.00 178.44 176.98 1tvs h ARG 43 N 0.00 0.00 -0.59 1.13 -0.00 0.03 -3.37 114.38 111.58 1tvs h ARG 43 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 59.98 59.70 1tvs h ARG 43 Cb 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 29.97 29.57 1tvs h ARG 43 CO -0.00 0.46 -1.12 0.45 -0.00 0.00 0.00 179.97 179.76 1tvs n SER 44 N -3.78 1.70 -3.50 0.08 2.88 0.51 -4.85 113.62 106.65 1tvs n SER 44 Ca -0.01 -2.27 -0.42 0.00 -1.33 0.00 0.00 58.87 54.84 1tvs n SER 44 Cb 0.52 -0.49 -0.10 0.00 -0.75 0.00 0.00 64.21 63.39 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 -0.47 1.82 -0.61 2.46 4.32 0.21 -3.62 117.00 121.11 1tvs n LEU 45 Ca 0.09 -1.86 -0.07 0.00 -0.02 0.00 0.00 56.01 54.15 1tvs n LEU 45 Cb 0.81 -0.67 -0.03 0.00 -1.62 0.00 0.00 43.42 41.91 1tvs n LEU 45 CO 0.13 -1.49 -0.07 0.61 -1.22 0.00 0.00 177.39 175.35 1tvs n GLY 46 N 4.81 0.71 3.82 -0.72 0.00 -1.26 -2.89 105.19 109.65 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 -1.98 0.00 0.09 -0.61 -0.00 -1.24 -4.65 119.36 110.97 1tvs n ILE 47 Ca -0.07 0.00 -0.05 0.00 -0.00 0.00 0.00 62.75 62.63 1tvs n ILE 47 Cb 0.52 -0.20 -0.03 0.00 -0.00 0.00 0.00 39.64 39.93 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 0.88 7.28 3.58 -1.92 -2.14 116.42 124.10 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 0.87 0.00 0.22 -2.88 0.00 0.00 179.24 177.45 1tvs h TYR 49 N 0.00 0.00 0.00 0.28 3.20 -1.79 0.66 116.97 119.32 1tvs h TYR 49 Ca -0.01 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1tvs h TYR 49 Cb 1.56 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.82 1tvs h TYR 49 CO 0.00 0.00 -0.91 -0.07 -1.64 0.00 0.00 178.16 175.54 1tvs h LEU 50 N 0.00 0.00 -0.86 2.82 -0.00 -1.67 0.53 115.31 116.13 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 0.44 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.08 1tvs h LEU 50 CO 0.00 0.08 -0.08 -0.78 -0.00 0.00 0.00 178.44 177.66 1tvs h ASP 51 N 0.00 0.74 0.05 -0.43 3.58 -0.96 -1.50 116.42 117.90 1tvs h ASP 51 Ca -0.02 -0.21 0.01 0.00 0.42 0.00 0.00 57.03 57.23 1tvs h ASP 51 Cb 1.08 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.92 1tvs h ASP 51 CO 0.01 0.86 -0.08 0.00 -2.88 0.00 0.00 179.24 177.15 1tvs h ALA 52 N 1.22 -0.13 -1.47 -0.78 0.00 0.58 0.27 119.26 118.95 1tvs h ALA 52 Ca 0.13 -0.01 0.43 0.00 0.00 0.00 0.00 54.91 55.46 1tvs h ALA 52 Cb 0.54 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 1tvs h ALA 52 CO 0.03 -0.59 1.03 1.03 0.00 0.00 0.00 179.25 180.76 1tvs h SER 53 N -0.16 0.09 -0.13 0.00 0.87 0.10 0.13 113.55 114.45 1tvs h SER 53 Ca 0.01 0.03 -0.13 0.00 -1.23 0.00 0.00 61.79 60.47 1tvs h SER 53 Cb 0.17 0.03 -0.18 0.00 -0.44 0.00 0.00 62.40 61.98 1tvs h SER 53 CO -0.04 -0.03 -0.72 0.00 -0.53 0.00 0.00 176.83 175.51 1tvs n LEU 54 N -4.24 2.50 0.00 2.23 -0.00 -0.65 -5.03 117.00 111.81 1tvs n LEU 54 Ca 0.34 -3.48 0.00 0.00 -0.00 0.00 0.00 56.01 52.87 1tvs n LEU 54 Cb 1.52 -0.31 0.00 0.00 -0.00 0.00 0.00 43.42 44.63 1tvs n LEU 54 CO 0.37 1.25 0.00 0.54 -0.00 0.00 0.00 177.39 179.54 1tvs n ARG 55 N -0.62 0.00 0.00 1.47 1.74 0.86 -4.61 116.66 115.50 1tvs n ARG 55 Ca 0.18 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 1tvs n ARG 55 Cb 0.85 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.29 1tvs n ARG 55 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1tvs n LYS 56 N 0.00 0.00 0.25 5.56 5.02 -1.26 -2.82 118.16 124.91 1tvs n LYS 56 Ca 0.00 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 1tvs n LYS 56 Cb 0.00 0.00 0.68 0.00 -0.02 0.00 0.00 35.03 35.69 1tvs n LYS 56 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1tvs h LYS 57 N 0.00 0.00 -0.07 1.97 2.10 -1.98 -2.59 116.57 116.00 1tvs h LYS 57 Ca 0.00 0.00 0.02 0.00 -2.00 0.00 0.00 60.65 58.67 1tvs h LYS 57 Cb 0.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1tvs h LYS 57 CO 0.00 0.14 0.09 -0.97 -2.00 0.00 0.00 179.45 176.71 1tvs h ASN 58 N 0.00 0.00 -0.90 7.07 -0.73 -1.78 -0.85 115.58 118.39 1tvs h ASN 58 Ca -0.00 0.00 0.20 0.00 1.87 0.00 0.00 56.30 58.37 1tvs h ASN 58 Cb 0.35 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 38.87 1tvs h ASN 58 CO 0.02 0.00 0.60 0.50 -0.37 0.00 0.00 177.43 178.17 1tvs h LYS 59 N 0.00 0.41 -0.72 6.67 3.11 -1.76 -0.60 116.57 123.68 1tvs h LYS 59 Ca 0.03 -0.02 -0.47 0.00 -2.81 0.00 0.00 60.65 57.38 1tvs h LYS 59 Cb 0.21 -0.09 -0.42 0.00 -1.00 0.00 0.00 32.23 30.93 1tvs h LYS 59 CO -0.00 0.27 -0.90 1.04 -2.81 0.00 0.00 179.45 177.05 1tvs n GLN 60 N -4.52 3.08 0.00 1.90 3.00 -0.39 -4.88 117.38 115.56 1tvs n GLN 60 Ca 0.19 -4.00 0.02 0.00 -0.01 0.00 0.00 57.00 53.20 1tvs n GLN 60 Cb 0.69 -2.09 0.11 0.00 0.00 0.00 0.00 30.24 28.95 1tvs n GLN 60 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 1tvs n ARG 61 N -0.65 0.56 -1.42 -1.09 0.63 -0.23 -4.42 116.66 110.04 1tvs n ARG 61 Ca 0.34 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.87 1tvs n ARG 61 Cb 0.91 -1.10 -0.02 0.00 0.45 0.00 0.00 32.46 32.69 1tvs n ARG 61 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1tvs n LEU 62 N -0.60 6.59 0.00 6.15 -0.00 -1.26 -1.85 117.00 126.02 1tvs n LEU 62 Ca 0.03 -3.82 0.00 0.00 -0.00 0.00 0.00 56.01 52.21 1tvs n LEU 62 Cb 0.01 -1.47 0.00 0.00 -0.00 0.00 0.00 43.42 41.96 1tvs n LEU 62 CO 0.02 1.01 0.00 1.17 -0.00 0.00 0.00 177.39 179.59 1tvs n LYS 63 N 5.48 0.00 -0.66 1.96 3.00 -1.26 -4.96 118.16 121.72 1tvs n LYS 63 Ca 0.57 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.75 1tvs n LYS 63 Cb 0.33 0.00 0.09 0.00 0.00 0.00 0.00 35.03 35.45 1tvs n LYS 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1tvs n ALA 64 N 0.00 4.20 -2.16 3.14 0.00 -0.77 -4.65 120.51 120.26 1tvs n ALA 64 Ca 0.00 -1.54 -0.30 0.00 0.00 0.00 0.00 53.44 51.60 1tvs n ALA 64 Cb 0.00 -1.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.16 1tvs n ALA 64 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1tvs s ILE 65 N -1.78 3.60 -1.02 0.00 -1.16 -0.89 -3.10 121.20 116.86 1tvs s ILE 65 Ca 0.30 -0.73 -0.07 0.00 -0.51 0.00 0.00 60.65 59.64 1tvs s ILE 65 Cb 0.25 -4.43 0.01 0.00 0.61 0.00 0.00 42.46 38.90 1tvs s ILE 65 CO 0.05 -1.18 0.89 0.00 -2.81 0.00 0.00 174.94 171.89 1tvs n GLN 66 N 8.63 -5.98 -0.57 3.50 3.00 -1.26 -5.02 117.38 119.68 1tvs n GLN 66 Ca 0.42 0.62 -0.18 0.00 -0.01 0.00 0.00 57.00 57.84 1tvs n GLN 66 Cb 0.47 -5.03 0.15 0.00 0.00 0.00 0.00 30.24 25.83 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 -3.88 -2.48 0.00 -1.09 1.13 -1.18 -5.02 117.38 104.86 1tvs n GLN 67 Ca 0.01 -1.04 0.00 0.00 -1.94 0.00 0.00 57.00 54.03 1tvs n GLN 67 Cb 0.55 -1.01 0.00 0.00 0.11 0.00 0.00 30.24 29.89 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 -2.10 0.00 1.03 1.08 0.00 -1.19 -4.83 105.19 99.19 1tvs n GLY 68 Ca 0.09 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 0.06 -3.39 1.61 0.00 0.56 -4.79 116.66 110.71 1tvs n ARG 69 Ca 0.00 -0.92 -0.21 0.00 -0.00 0.00 0.00 57.85 56.73 1tvs n ARG 69 Cb 0.00 0.49 -0.01 0.00 0.00 0.00 0.00 32.46 32.95 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 -0.07 0.92 -1.76 -0.14 6.02 -0.75 -4.99 117.38 116.61 1tvs n GLN 70 Ca -0.25 -2.62 -0.27 0.00 -0.01 0.00 0.00 57.00 53.85 1tvs n GLN 70 Cb 0.67 0.37 -0.08 0.00 1.02 0.00 0.00 30.24 32.21 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 -1.37 1.11 0.00 -1.09 -0.04 -1.26 -4.38 135.00 127.98 1tvs n PRO 71 Ca -0.04 -2.13 0.00 0.00 -0.04 0.00 0.00 63.50 61.29 1tvs n PRO 71 Cb 0.47 -3.64 0.00 0.00 -0.04 0.00 0.00 33.50 30.30 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 8.09 0.00 -0.03 0.54 6.02 -1.26 -4.59 117.38 126.15 1tvs n GLN 72 Ca 0.45 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 57.27 1tvs n GLN 72 Cb 0.46 -3.83 -0.14 0.00 1.02 0.00 0.00 30.24 27.75 1tvs n GLN 72 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 1tvs n TYR 73 N -1.79 0.93 -2.87 1.08 0.18 -1.26 -4.39 117.16 109.04 1tvs n TYR 73 Ca 0.00 0.24 -0.38 0.00 1.88 0.00 0.00 57.90 59.63 1tvs n TYR 73 Cb 0.00 -1.14 -0.00 0.00 -0.38 0.00 0.00 39.34 37.82 1tvs n TYR 73 CO 0.00 0.00 0.00 -0.11 -2.08 0.00 0.00 176.86 174.67 1tvs n LEU 74 N -3.28 6.35 0.00 -3.48 7.94 -1.26 -5.03 117.00 118.23 1tvs n LEU 74 Ca -0.30 -5.38 0.00 0.00 -1.11 0.00 0.00 56.01 49.22 1tvs n LEU 74 Cb 1.05 -1.07 0.00 0.00 0.53 0.00 0.00 43.42 43.93 1tvs n LEU 74 CO 0.41 1.99 0.07 -0.11 -1.11 0.00 0.00 177.39 178.64