#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 3.81 0.04 1.96 8.01 -1.26 -4.83 118.70 126.43 1tvs s GLU 2 Ca 0.00 -2.84 0.19 0.00 0.01 0.00 0.00 54.97 52.33 1tvs s GLU 2 Cb 0.00 -4.43 -0.16 0.00 -4.31 0.00 0.00 34.13 25.23 1tvs s GLU 2 CO 0.00 -1.26 0.72 -3.47 0.01 0.00 0.00 175.26 171.25 1tvs n ASP 3 N 3.31 0.61 -4.57 -0.19 2.03 -1.26 -4.71 116.55 111.77 1tvs n ASP 3 Ca 0.18 0.26 -0.41 0.00 0.52 0.00 0.00 54.79 55.34 1tvs n ASP 3 Cb 0.43 0.63 -0.02 0.00 -0.72 0.00 0.00 41.12 41.44 1tvs n ASP 3 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1tvs s ARG 4 N -3.06 3.74 0.00 -0.67 1.81 -1.26 -4.79 118.95 114.72 1tvs s ARG 4 Ca -0.04 -1.56 0.22 0.00 -1.72 0.00 0.00 55.73 52.63 1tvs s ARG 4 Cb 0.09 -5.44 0.96 0.00 -0.45 0.00 0.00 34.95 30.11 1tvs s ARG 4 CO 0.83 -2.31 1.70 0.54 -0.68 0.00 0.00 175.30 175.37 1tvs n ARG 5 N 8.62 0.06 -0.86 3.54 3.00 -1.26 -5.02 116.66 124.73 1tvs n ARG 5 Ca 0.42 0.12 0.00 0.00 -0.01 0.00 0.00 57.85 58.38 1tvs n ARG 5 Cb 0.48 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.44 1tvs n ARG 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1tvs n ILE 6 N -1.46 -3.23 0.00 0.55 5.41 -1.26 -4.76 119.36 114.61 1tvs n ILE 6 Ca 0.06 1.24 0.00 0.00 1.00 0.00 0.00 62.75 65.05 1tvs n ILE 6 Cb 0.24 -2.06 0.00 0.00 -0.71 0.00 0.00 39.64 37.11 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 -0.20 1.91 -0.13 0.38 -0.04 -1.26 -4.32 135.00 131.34 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 0.07 0.00 -0.04 0.00 0.00 33.50 33.53 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 2.80 -0.55 0.28 0.55 0.00 -1.26 -0.23 105.19 106.79 1tvs n GLY 8 Ca 0.00 0.37 0.23 0.00 0.00 0.00 0.00 46.02 46.62 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 -4.47 -0.36 -0.03 2.61 -2.24 -1.26 0.13 114.28 108.65 1tvs n THR 9 Ca 0.07 1.81 -0.14 0.00 -2.27 0.00 0.00 64.05 63.52 1tvs n THR 9 Cb 0.22 -2.84 -0.10 0.00 -2.10 0.00 0.00 70.33 65.51 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 1.74 0.06 -0.95 6.98 0.00 -0.79 0.52 119.26 126.81 1tvs h ALA 10 Ca 0.67 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1tvs h ALA 10 Cb 1.69 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.42 1tvs h ALA 10 CO -0.71 -0.04 0.62 0.93 0.00 0.00 0.00 179.25 180.05 1tvs h GLU 11 N -0.42 1.16 -0.77 0.00 3.07 -0.81 -0.10 114.58 116.71 1tvs h GLU 11 Ca -0.00 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.77 1tvs h GLU 11 Cb 0.75 -0.26 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 1tvs h GLU 11 CO 0.03 0.77 0.42 1.49 -1.40 0.00 0.00 179.01 180.31 1tvs h GLU 12 N 1.20 1.08 -0.31 2.33 4.57 0.12 0.27 114.58 123.83 1tvs h GLU 12 Ca 0.38 -0.13 0.04 0.00 -1.18 0.00 0.00 59.36 58.47 1tvs h GLU 12 Cb 0.01 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.37 1tvs h GLU 12 CO -0.12 0.80 0.21 -0.91 -1.18 0.00 0.00 179.01 177.82 1tvs h ASN 13 N 1.07 0.23 0.00 1.04 -0.26 0.19 0.73 115.58 118.58 1tvs h ASN 13 Ca 0.27 -0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.84 1tvs h ASN 13 Cb 0.04 -0.05 -0.03 0.00 -1.06 0.00 0.00 38.32 37.22 1tvs h ASN 13 CO -0.04 0.15 -1.09 0.18 -1.06 0.00 0.00 177.43 175.57 1tvs n LEU 14 N -4.49 1.85 0.10 1.61 4.32 -0.83 -4.64 117.00 114.92 1tvs n LEU 14 Ca 0.03 0.48 -0.23 0.00 -0.02 0.00 0.00 56.01 56.27 1tvs n LEU 14 Cb 0.19 -0.93 -0.15 0.00 -1.62 0.00 0.00 43.42 40.91 1tvs n LEU 14 CO 0.35 0.05 -0.26 1.56 -1.22 0.00 0.00 177.39 177.86 1tvs h GLN 15 N -1.00 0.44 -3.71 3.23 7.50 -0.47 -3.50 115.11 117.59 1tvs h GLN 15 Ca -0.25 -0.74 0.00 0.00 0.50 0.00 0.00 58.65 58.15 1tvs h GLN 15 Cb 1.07 0.28 0.00 0.00 0.05 0.00 0.00 27.48 28.88 1tvs h GLN 15 CO -0.15 1.36 -0.22 1.17 -1.50 0.00 0.00 178.83 179.49 1tvs n LYS 16 N -3.80 -0.90 -0.01 1.46 3.00 0.25 -5.02 118.16 113.15 1tvs n LYS 16 Ca -0.19 1.10 0.09 0.00 -0.00 0.00 0.00 58.31 59.31 1tvs n LYS 16 Cb 1.02 -2.68 -0.14 0.00 0.00 0.00 0.00 35.03 33.23 1tvs n LYS 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1tvs n SER 17 N -0.20 0.76 -4.57 3.14 3.41 -1.26 -4.96 113.62 109.95 1tvs n SER 17 Ca 0.02 -0.07 -0.43 0.00 -0.26 0.00 0.00 58.87 58.13 1tvs n SER 17 Cb 0.09 1.79 -0.04 0.00 -0.26 0.00 0.00 64.21 65.79 1tvs n SER 17 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1tvs n SER 18 N -2.09 2.91 -4.55 4.04 7.64 -1.26 -4.90 113.62 115.40 1tvs n SER 18 Ca -0.03 0.13 -0.41 0.00 1.01 0.00 0.00 58.87 59.57 1tvs n SER 18 Cb 0.47 -1.51 -0.03 0.00 -1.01 0.00 0.00 64.21 62.13 1tvs n SER 18 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1tvs s GLY 19 N 8.73 1.09 -0.65 0.23 0.00 -1.26 -4.97 107.32 110.49 1tvs s GLY 19 Ca 1.02 -1.85 -0.28 0.00 0.00 0.00 0.00 44.72 43.62 1tvs s GLY 19 CO 0.36 2.66 1.25 -0.32 0.00 0.00 0.00 173.10 177.05 1tvs s GLY 20 N 4.38 1.00 0.24 0.20 0.00 -1.26 -5.01 107.32 106.87 1tvs s GLY 20 Ca 0.41 -1.07 -0.30 0.00 0.00 0.00 0.00 44.72 43.76 1tvs s GLY 20 CO 0.02 2.59 1.10 -1.34 0.00 0.00 0.00 173.10 175.47 1tvs s VAL 21 N 5.40 3.61 -1.39 1.40 -7.23 -1.26 -4.94 120.40 115.99 1tvs s VAL 21 Ca 0.40 1.53 -0.15 0.00 -1.81 0.00 0.00 61.98 61.94 1tvs s VAL 21 Cb -0.08 -3.97 0.06 0.00 0.56 0.00 0.00 36.38 32.95 1tvs s VAL 21 CO 0.21 0.33 2.01 -0.81 -0.31 0.00 0.00 175.10 176.52 1tvs n PRO 22 N 1.65 3.03 -0.81 4.82 -0.04 -1.26 -4.76 135.00 137.63 1tvs n PRO 22 Ca 0.00 -2.92 -0.16 0.00 -0.04 0.00 0.00 63.50 60.38 1tvs n PRO 22 Cb 0.45 -3.35 0.10 0.00 -0.04 0.00 0.00 33.50 30.67 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 4.54 3.72 0.00 0.55 0.00 -1.26 -4.48 105.19 108.26 1tvs n GLY 23 Ca 0.50 -0.79 0.12 0.00 0.00 0.00 0.00 46.02 45.84 1tvs n GLY 23 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tvs n GLN 24 N -0.45 0.22 0.00 1.61 3.00 -1.26 -3.17 117.38 117.33 1tvs n GLN 24 Ca 0.38 0.07 0.13 0.00 -0.01 0.00 0.00 57.00 57.57 1tvs n GLN 24 Cb 1.14 -1.50 0.34 0.00 0.00 0.00 0.00 30.24 30.22 1tvs n GLN 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1tvs n ASN 25 N -1.36 1.95 0.00 1.08 3.02 -1.26 -4.29 115.26 114.40 1tvs n ASN 25 Ca 0.09 -1.59 0.12 0.00 -0.03 0.00 0.00 54.58 53.17 1tvs n ASN 25 Cb 0.22 0.05 0.59 0.00 -0.61 0.00 0.00 39.78 40.03 1tvs n ASN 25 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1tvs n THR 26 N 0.43 0.26 0.00 3.41 5.66 -1.19 -4.88 114.28 117.97 1tvs n THR 26 Ca 0.16 0.07 0.00 0.00 -3.05 0.00 0.00 64.05 61.23 1tvs n THR 26 Cb 0.44 -0.68 0.00 0.00 -1.55 0.00 0.00 70.33 68.54 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 0.72 1.20 0.00 1.09 0.00 -1.26 -4.96 105.19 101.98 1tvs n GLY 27 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 1.30 2.43 -0.02 0.00 -1.26 -5.02 105.19 102.62 1tvs n GLY 28 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.44 2.72 0.00 1.61 1.13 -1.26 -4.42 117.38 115.71 1tvs n GLN 29 Ca 0.00 -3.93 0.00 0.00 -1.94 0.00 0.00 57.00 51.13 1tvs n GLN 29 Cb 0.00 -1.94 0.00 0.00 0.11 0.00 0.00 30.24 28.41 1tvs n GLN 29 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 1tvs n GLU 30 N -0.54 0.00 -0.02 -1.09 0.00 -1.26 -4.92 120.64 112.81 1tvs n GLU 30 Ca 0.28 0.00 -0.20 0.00 0.00 0.00 0.00 57.16 57.24 1tvs n GLU 30 Cb 0.84 -0.05 -0.13 0.00 0.00 0.00 0.00 31.44 32.09 1tvs n GLU 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1tvs h ALA 31 N 0.00 0.14 -2.20 -1.84 0.00 -1.96 -3.46 119.26 109.94 1tvs h ALA 31 Ca 0.00 -1.00 -0.60 0.00 0.00 0.00 0.00 54.91 53.31 1tvs h ALA 31 Cb 0.00 0.43 0.06 0.00 0.00 0.00 0.00 17.79 18.28 1tvs h ALA 31 CO 0.00 0.67 0.71 -2.13 0.00 0.00 0.00 179.25 178.50 1tvs n ARG 32 N -4.10 1.98 -1.67 0.00 0.00 -1.26 -4.98 116.66 106.63 1tvs n ARG 32 Ca -0.23 0.71 -0.32 0.00 -0.00 0.00 0.00 57.85 58.01 1tvs n ARG 32 Cb 0.81 -2.44 0.05 0.00 0.00 0.00 0.00 32.46 30.87 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 0.58 2.91 -0.76 -0.14 0.04 -1.26 -4.39 135.00 131.97 1tvs s PRO 33 Ca 0.77 1.12 -0.00 0.00 0.04 0.00 0.00 61.00 62.93 1tvs s PRO 33 Cb -0.71 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 31.85 1tvs s PRO 33 CO 0.41 -1.13 0.69 -1.71 0.04 0.00 0.00 177.00 175.30 1tvs n ASN 34 N -2.80 -7.30 -0.07 6.66 5.15 -1.26 -4.99 115.26 110.65 1tvs n ASN 34 Ca 0.08 -0.23 -0.15 0.00 -0.60 0.00 0.00 54.58 53.68 1tvs n ASN 34 Cb 0.53 -4.72 -0.05 0.00 -0.53 0.00 0.00 39.78 35.00 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 -1.95 0.00 0.52 1.20 4.11 -1.26 -4.65 117.16 115.13 1tvs n TYR 35 Ca -0.05 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 57.93 1tvs n TYR 35 Cb 0.53 -0.53 0.23 0.00 -0.00 0.00 0.00 39.34 39.58 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 -3.58 0.60 -0.01 -3.48 1.44 -1.26 -4.94 115.22 104.00 1tvs n HIS 36 Ca -0.28 -0.30 0.00 0.00 -2.01 0.00 0.00 57.72 55.13 1tvs n HIS 36 Cb 0.71 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.82 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 0.92 0.00 0.00 4.15 -1.96 0.11 115.11 119.82 1tvs h GLN 38 Ca 0.00 -0.50 -0.05 0.00 0.77 0.00 0.00 58.65 58.88 1tvs h GLN 38 Cb 0.00 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1tvs h GLN 38 CO 0.00 1.15 -0.22 -0.07 -1.93 0.00 0.00 178.83 177.76 1tvs h LEU 39 N 0.74 0.00 -0.65 -2.39 -0.00 -1.94 0.29 115.31 111.36 1tvs h LEU 39 Ca 0.05 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.79 1tvs h LEU 39 Cb 1.00 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.65 1tvs h LEU 39 CO 0.10 0.22 -0.62 0.00 -0.00 0.00 0.00 178.44 178.14 1tvs h PHE 41 N 0.15 0.14 0.00 0.00 3.57 0.11 -1.22 116.94 119.69 1tvs h PHE 41 Ca -0.01 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 1tvs h PHE 41 Cb 1.13 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.83 1tvs h PHE 41 CO 0.02 0.43 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.44 1tvs h LEU 42 N -0.18 0.00 -0.77 0.59 4.07 -0.25 0.63 115.31 119.39 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 0.38 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.11 1tvs h LEU 42 CO 0.01 0.02 -0.42 -0.09 -1.08 0.00 0.00 178.44 176.87 1tvs h ARG 43 N 0.00 0.00 -0.30 1.13 2.43 0.50 -3.38 114.38 114.76 1tvs h ARG 43 Ca -0.00 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 58.95 1tvs h ARG 43 Cb 0.05 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 29.23 1tvs h ARG 43 CO 0.00 0.42 -1.01 -1.13 -1.51 0.00 0.00 179.97 176.74 1tvs n SER 44 N -3.49 1.13 -3.92 -3.80 3.41 0.49 -4.89 113.62 102.54 1tvs n SER 44 Ca 0.00 -2.03 -0.30 0.00 -0.26 0.00 0.00 58.87 56.27 1tvs n SER 44 Cb 0.56 -0.32 -0.11 0.00 -0.26 0.00 0.00 64.21 64.07 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 -0.45 0.92 -0.69 1.04 4.32 0.19 -3.27 117.00 119.05 1tvs n LEU 45 Ca 0.04 -1.80 -0.08 0.00 -0.02 0.00 0.00 56.01 54.15 1tvs n LEU 45 Cb 0.87 -0.92 -0.03 0.00 -1.62 0.00 0.00 43.42 41.72 1tvs n LEU 45 CO 0.02 -2.54 -0.08 0.61 -1.22 0.00 0.00 177.39 174.18 1tvs n GLY 46 N 5.31 0.77 4.61 -0.72 0.00 -1.26 -2.71 105.19 111.19 1tvs n GLY 46 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 -1.90 0.00 0.23 -0.61 -0.00 -1.20 -4.56 119.36 111.32 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 0.49 0.00 0.58 0.00 -0.00 0.00 0.00 39.64 40.71 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 0.97 7.28 3.58 -1.93 0.21 116.42 126.53 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 0.18 0.00 0.22 -2.88 0.00 0.00 179.24 176.76 1tvs h TYR 49 N 0.00 0.00 0.00 0.28 3.20 -1.75 0.43 116.97 119.13 1tvs h TYR 49 Ca -0.00 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1tvs h TYR 49 Cb 0.37 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1tvs h TYR 49 CO 0.00 0.00 -1.15 1.28 -1.64 0.00 0.00 178.16 176.65 1tvs n LEU 50 N -2.77 0.79 0.12 2.82 7.99 0.66 0.17 117.00 126.79 1tvs n LEU 50 Ca 0.01 0.31 0.01 0.00 -0.01 0.00 0.00 56.01 56.34 1tvs n LEU 50 Cb 0.29 -0.03 0.35 0.00 -0.11 0.00 0.00 43.42 43.92 1tvs n LEU 50 CO 0.25 -0.11 0.81 0.44 -1.51 0.00 0.00 177.39 177.27 1tvs h ASP 51 N 0.00 0.20 0.00 -1.43 5.19 -0.73 -3.18 116.42 116.46 1tvs h ASP 51 Ca -0.03 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1tvs h ASP 51 Cb 1.11 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.57 1tvs h ASP 51 CO 0.01 0.43 0.00 0.00 -3.12 0.00 0.00 179.24 176.56 1tvs n ALA 52 N -2.48 -0.20 -4.07 3.45 0.00 0.14 -4.80 120.51 112.56 1tvs n ALA 52 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.15 1tvs n ALA 52 Cb 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 1tvs n ALA 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1tvs n SER 53 N -1.81 -0.29 -0.24 0.00 2.88 0.45 -0.05 113.62 114.57 1tvs n SER 53 Ca 0.00 -1.08 -0.02 0.00 -1.33 0.00 0.00 58.87 56.44 1tvs n SER 53 Cb 0.00 -2.66 -0.00 0.00 -0.75 0.00 0.00 64.21 60.80 1tvs n SER 53 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1tvs n LEU 54 N -4.44 -0.76 0.00 2.46 7.94 -1.26 -4.86 117.00 116.07 1tvs n LEU 54 Ca -0.28 0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.65 1tvs n LEU 54 Cb 0.67 -0.78 0.00 0.00 0.53 0.00 0.00 43.42 43.84 1tvs n LEU 54 CO 0.79 -0.06 0.00 0.54 -1.11 0.00 0.00 177.39 177.54 1tvs n ARG 55 N -1.87 0.00 0.00 1.96 5.12 0.93 -4.81 116.66 118.00 1tvs n ARG 55 Ca -0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.89 1tvs n ARG 55 Cb 0.36 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.66 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 0.00 0.00 0.13 5.56 5.02 -1.26 -3.31 118.16 124.30 1tvs n LYS 56 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1tvs n LYS 56 Cb 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 35.12 1tvs n LYS 56 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1tvs h LYS 57 N 0.00 0.00 0.00 1.97 3.64 -1.91 -3.20 116.57 117.06 1tvs h LYS 57 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1tvs h LYS 57 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1tvs h LYS 57 CO 0.00 0.62 0.00 -1.71 -2.27 0.00 0.00 179.45 176.09 1tvs n ASN 58 N -3.46 0.00 -4.57 4.20 5.15 -1.21 -3.79 115.26 111.59 1tvs n ASN 58 Ca 0.00 -0.85 -0.31 0.00 -0.60 0.00 0.00 54.58 52.82 1tvs n ASN 58 Cb 0.70 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.91 1tvs n ASN 58 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1tvs s LYS 59 N -2.00 2.87 -0.16 1.20 -2.85 -1.21 -2.15 119.74 115.43 1tvs s LYS 59 Ca 0.30 -0.77 -0.01 0.00 -1.00 0.00 0.00 55.97 54.49 1tvs s LYS 59 Cb 0.14 -5.20 0.00 0.00 -2.06 0.00 0.00 37.83 30.71 1tvs s LYS 59 CO 0.23 -3.18 0.14 0.94 0.10 0.00 0.00 175.35 173.59 1tvs n GLN 60 N 8.71 -0.96 0.24 1.78 7.27 -1.26 -4.94 117.38 128.22 1tvs n GLN 60 Ca 0.40 0.10 0.13 0.00 0.07 0.00 0.00 57.00 57.71 1tvs n GLN 60 Cb 0.48 -2.92 0.70 0.00 2.41 0.00 0.00 30.24 30.91 1tvs n GLN 60 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 1tvs h ARG 61 N -0.32 0.00 -0.77 3.69 2.43 -1.53 -2.55 114.38 115.34 1tvs h ARG 61 Ca -0.07 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.24 1tvs h ARG 61 Cb 1.05 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.50 1tvs h ARG 61 CO 0.07 0.00 0.33 1.25 -1.51 0.00 0.00 179.97 180.10 1tvs h LEU 62 N 0.00 0.33 -3.33 3.80 5.85 -1.91 0.15 115.31 120.20 1tvs h LEU 62 Ca 0.00 0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.71 1tvs h LEU 62 Cb 0.32 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 1tvs h LEU 62 CO 0.00 0.13 -0.01 1.17 -0.34 0.00 0.00 178.44 179.39 1tvs n LYS 63 N -4.97 2.32 0.00 1.25 3.00 -0.97 -4.49 118.16 114.30 1tvs n LYS 63 Ca 0.15 -3.01 0.00 0.00 -0.00 0.00 0.00 58.31 55.44 1tvs n LYS 63 Cb 0.41 -1.84 0.00 0.00 0.00 0.00 0.00 35.03 33.60 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 -0.86 0.86 -0.27 3.14 0.00 -0.31 -4.73 120.51 118.35 1tvs n ALA 64 Ca 0.29 -0.37 -0.06 0.00 0.00 0.00 0.00 53.44 53.29 1tvs n ALA 64 Cb 0.99 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.50 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 1.76 1.26 -0.22 0.00 6.09 -1.01 -2.32 117.51 123.06 1tvs h ILE 65 Ca 0.00 -0.84 0.00 0.00 -1.37 0.00 0.00 64.86 62.65 1tvs h ILE 65 Cb 0.70 0.41 0.00 0.00 0.47 0.00 0.00 36.82 38.40 1tvs h ILE 65 CO 0.00 0.34 0.00 0.00 -3.07 0.00 0.00 178.15 175.42 1tvs n GLN 66 N -4.30 2.24 0.00 2.19 3.00 -1.26 -4.98 117.38 114.27 1tvs n GLN 66 Ca 0.06 -1.85 0.00 0.00 -0.01 0.00 0.00 57.00 55.20 1tvs n GLN 66 Cb 0.20 -1.47 0.00 0.00 0.00 0.00 0.00 30.24 28.97 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 1.12 -0.08 0.00 -1.09 3.00 -0.87 -4.67 117.38 114.77 1tvs n GLN 67 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 1tvs n GLN 67 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.77 1tvs n GLN 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1tvs n GLY 68 N 4.44 3.03 2.38 1.08 0.00 -1.26 -4.87 105.19 110.00 1tvs n GLY 68 Ca 0.00 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.86 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 3.44 0.00 1.61 0.00 -1.26 -5.00 116.66 115.45 1tvs n ARG 69 Ca 0.00 -4.38 0.00 0.00 -0.00 0.00 0.00 57.85 53.47 1tvs n ARG 69 Cb 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 32.46 30.20 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 -0.54 3.92 -0.41 -0.14 7.27 -1.26 -5.10 117.38 121.12 1tvs n GLN 70 Ca 0.41 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 57.18 1tvs n GLN 70 Cb 0.72 0.00 0.28 0.00 2.41 0.00 0.00 30.24 33.65 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 2.55 -2.26 0.00 3.69 0.04 -1.26 -4.83 135.00 132.93 1tvs s PRO 71 Ca 0.00 0.41 0.05 0.00 0.04 0.00 0.00 61.00 61.50 1tvs s PRO 71 Cb 0.00 -1.43 0.25 0.00 0.04 0.00 0.00 34.50 33.35 1tvs s PRO 71 CO 0.00 -4.50 1.02 1.04 0.04 0.00 0.00 177.00 174.59 1tvs n GLN 72 N -5.41 0.06 0.00 4.56 6.02 -1.26 -4.40 117.38 116.95 1tvs n GLN 72 Ca 0.08 0.26 0.00 0.00 -0.01 0.00 0.00 57.00 57.34 1tvs n GLN 72 Cb 0.58 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.34 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 -1.31 0.00 0.00 1.08 4.11 -1.26 -4.50 117.16 115.27 1tvs n TYR 73 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.92 1tvs n TYR 73 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.38 1tvs n TYR 73 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.86 176.75 1tvs n LEU 74 N 0.00 0.00 0.00 -3.48 7.94 -1.26 -5.07 117.00 115.13 1tvs n LEU 74 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1tvs n LEU 74 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1tvs n LEU 74 CO 0.00 0.00 0.00 0.18 -1.11 0.00 0.00 177.39 176.46