#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3da5 s LYS 9 N 0.00 4.13 0.67 1.97 2.47 -1.26 -5.01 119.74 122.71 3da5 s LYS 9 Ca 0.00 2.60 -0.11 0.00 -1.56 0.00 0.00 55.97 56.90 3da5 s LYS 9 Cb 0.00 -3.35 -0.01 0.00 -1.46 0.00 0.00 37.83 33.01 3da5 s LYS 9 CO 0.00 -0.80 1.06 0.95 0.16 0.00 0.00 175.35 176.72 3da5 s THR 10 N 2.01 3.94 0.25 3.43 -4.23 -1.26 -4.68 115.64 115.10 3da5 s THR 10 Ca 0.78 0.60 -0.04 0.00 -1.18 0.00 0.00 61.69 61.85 3da5 s THR 10 Cb -0.48 -3.62 0.23 0.00 1.34 0.00 0.00 72.50 69.97 3da5 s THR 10 CO 0.34 -0.81 1.84 0.25 -0.54 0.00 0.00 174.62 175.71 3da5 h LEU 11 N -0.51 0.83 -1.00 4.79 5.85 -0.61 -0.45 115.31 124.22 3da5 h LEU 11 Ca -0.45 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.21 3da5 h LEU 11 Cb 1.23 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 3da5 h LEU 11 CO 0.63 0.51 -0.30 -0.25 -0.34 0.00 0.00 178.44 178.70 3da5 h TRP 12 N 0.96 0.40 -0.22 1.25 -0.00 -1.65 -2.18 115.95 114.50 3da5 h TRP 12 Ca 0.40 -0.09 -0.17 0.00 -0.00 0.00 0.00 58.89 59.03 3da5 h TRP 12 Cb 0.24 -0.10 0.00 0.00 -0.00 0.00 0.00 29.16 29.31 3da5 h TRP 12 CO -0.03 0.62 -0.53 0.93 -0.00 0.00 0.00 178.44 179.43 3da5 h GLU 13 N 0.31 0.75 0.00 2.65 4.39 -1.67 -0.57 114.58 120.44 3da5 h GLU 13 Ca 0.04 -0.51 -0.03 0.00 0.34 0.00 0.00 59.36 59.21 3da5 h GLU 13 Cb 0.69 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.41 3da5 h GLU 13 CO 0.05 1.13 -0.13 -0.07 -1.16 0.00 0.00 179.01 178.84 3da5 h LEU 14 N 0.48 0.00 -2.72 1.33 3.38 -0.56 -2.71 115.31 114.50 3da5 h LEU 14 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3da5 h LEU 14 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3da5 h LEU 14 CO 0.12 0.13 0.00 1.33 0.09 0.00 0.00 178.44 180.10 3da5 n VAL 15 N -3.91 0.93 -1.48 1.22 0.24 -0.87 -4.95 118.33 109.50 3da5 n VAL 15 Ca -0.02 -0.96 0.00 0.00 -2.04 0.00 0.00 64.34 61.32 3da5 n VAL 15 Cb 0.22 0.57 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 3da5 n VAL 15 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3da5 n GLY 16 N 1.23 0.43 3.99 7.63 0.00 -1.02 -3.44 105.19 114.01 3da5 n GLY 16 Ca 0.19 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 3da5 n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3da5 n ARG 17 N -1.87 -4.27 -4.54 1.61 1.74 -0.23 -4.95 116.66 104.15 3da5 n ARG 17 Ca 0.00 0.49 -0.25 0.00 -0.77 0.00 0.00 57.85 57.32 3da5 n ARG 17 Cb 0.26 -5.13 -0.17 0.00 -1.02 0.00 0.00 32.46 26.41 3da5 n ARG 17 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3da5 s ASN 18 N -3.67 1.90 0.25 0.55 3.84 -1.22 -5.00 114.94 111.59 3da5 s ASN 18 Ca 0.46 -0.32 0.14 0.00 0.21 0.00 0.00 52.86 53.35 3da5 s ASN 18 Cb -0.24 -0.87 0.04 0.00 -0.55 0.00 0.00 41.25 39.63 3da5 s ASN 18 CO 0.87 0.02 1.43 0.07 -2.79 0.00 0.00 177.10 176.70 3da5 h LYS 19 N 7.10 0.00 -0.12 0.43 2.10 -1.90 -0.87 116.57 123.31 3da5 h LYS 19 Ca -0.30 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.19 3da5 h LYS 19 Cb 1.18 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.52 3da5 h LYS 19 CO 0.47 0.60 -0.53 -0.44 -2.00 0.00 0.00 179.45 177.55 3da5 h ASP 20 N 0.00 0.67 -0.90 7.07 3.32 -1.97 -2.30 116.42 122.31 3da5 h ASP 20 Ca -0.01 -0.63 0.21 0.00 0.02 0.00 0.00 57.03 56.62 3da5 h ASP 20 Cb 1.44 -0.20 -0.12 0.00 0.22 0.00 0.00 39.33 40.67 3da5 h ASP 20 CO 0.08 1.19 0.43 0.00 -1.72 0.00 0.00 179.24 179.22 3da5 h ALA 21 N 0.49 1.46 -0.46 3.45 0.00 -1.84 -0.25 119.26 122.11 3da5 h ALA 21 Ca -0.03 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3da5 h ALA 21 Cb 1.17 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 3da5 h ALA 21 CO 0.11 -0.28 0.07 1.25 0.00 0.00 0.00 179.25 180.40 3da5 h LEU 22 N 0.47 0.73 -0.71 0.00 5.85 -1.03 -1.73 115.31 118.88 3da5 h LEU 22 Ca 0.55 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 59.00 3da5 h LEU 22 Cb 1.00 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 3da5 h LEU 22 CO -0.49 0.81 0.39 -0.09 -0.34 0.00 0.00 178.44 178.72 3da5 h ARG 23 N 0.62 0.99 -0.01 1.25 2.43 -0.85 -2.26 114.38 116.56 3da5 h ARG 23 Ca 0.14 -0.12 -0.11 0.00 -0.81 0.00 0.00 59.98 59.08 3da5 h ARG 23 Cb 0.39 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 3da5 h ARG 23 CO 0.01 0.74 -0.53 -0.44 -1.51 0.00 0.00 179.97 178.24 3da5 h ASP 24 N 0.98 0.03 -0.15 -3.80 3.45 -0.82 -2.00 116.42 114.12 3da5 h ASP 24 Ca 0.25 -0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.65 3da5 h ASP 24 Cb 0.04 -0.01 -0.00 0.00 -0.56 0.00 0.00 39.33 38.79 3da5 h ASP 24 CO -0.04 0.56 -0.08 0.15 -1.57 0.00 0.00 179.24 178.26 3da5 h PHE 25 N 0.02 0.36 -0.22 4.55 3.57 -1.10 -0.80 116.94 123.32 3da5 h PHE 25 Ca -0.00 -0.09 -0.09 0.00 3.53 0.00 0.00 57.97 61.31 3da5 h PHE 25 Cb 0.95 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.60 3da5 h PHE 25 CO 0.00 0.64 -0.26 -0.07 -2.23 0.00 0.00 178.31 176.39 3da5 h LEU 26 N -0.03 0.43 -0.42 0.59 3.38 -1.34 -2.08 115.31 115.84 3da5 h LEU 26 Ca 0.03 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3da5 h LEU 26 Cb 0.55 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3da5 h LEU 26 CO 0.02 0.69 0.18 0.50 0.09 0.00 0.00 178.44 179.92 3da5 h LYS 27 N 0.38 0.62 -0.23 1.13 3.64 -1.27 -1.25 116.57 119.59 3da5 h LYS 27 Ca 0.06 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.22 3da5 h LYS 27 Cb 0.66 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 3da5 h LYS 27 CO 0.05 0.56 -0.33 0.93 -2.27 0.00 0.00 179.45 178.39 3da5 h GLU 28 N 0.54 0.47 -0.65 1.90 5.08 -0.94 -2.85 114.58 118.13 3da5 h GLU 28 Ca 0.14 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3da5 h GLU 28 Cb 0.16 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3da5 h GLU 28 CO -0.01 0.75 0.00 0.72 -1.00 0.00 0.00 179.01 179.46 3da5 n HIS 29 N -4.07 0.87 -1.65 4.33 8.25 -0.80 -4.99 115.22 117.17 3da5 n HIS 29 Ca -0.01 -0.45 -0.47 0.00 -0.26 0.00 0.00 57.72 56.52 3da5 n HIS 29 Cb 0.46 -0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.52 3da5 n HIS 29 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 3da5 n ARG 30 N 1.57 1.85 0.00 -0.41 0.63 -0.48 -1.12 116.66 118.70 3da5 n ARG 30 Ca 0.23 0.66 0.00 0.00 -0.92 0.00 0.00 57.85 57.82 3da5 n ARG 30 Cb 0.61 -2.37 0.00 0.00 0.45 0.00 0.00 32.46 31.15 3da5 n ARG 30 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3da5 n GLY 31 N 2.92 1.82 0.00 5.14 0.00 -1.26 -4.83 105.19 108.97 3da5 n GLY 31 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3da5 n GLY 31 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3da5 n THR 32 N -2.00 0.00 -5.08 2.61 -2.24 -0.27 -4.96 114.28 102.33 3da5 n THR 32 Ca 0.00 -0.35 -0.32 0.00 -2.27 0.00 0.00 64.05 61.11 3da5 n THR 32 Cb 0.00 1.11 -0.15 0.00 -2.10 0.00 0.00 70.33 69.19 3da5 n THR 32 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 3da5 s ILE 33 N -0.45 2.53 0.45 2.28 2.07 -1.08 -0.41 121.20 126.60 3da5 s ILE 33 Ca 0.00 -0.91 0.05 0.00 -1.41 0.00 0.00 60.65 58.39 3da5 s ILE 33 Cb 0.00 -1.96 -0.04 0.00 0.13 0.00 0.00 42.46 40.59 3da5 s ILE 33 CO 0.00 0.57 0.09 -0.76 -1.91 0.00 0.00 174.94 172.93 3da5 s LEU 34 N -0.40 2.75 -0.14 8.50 1.43 0.46 -4.75 118.68 126.54 3da5 s LEU 34 Ca 0.04 -1.37 0.01 0.00 -1.03 0.00 0.00 54.13 51.78 3da5 s LEU 34 Cb -0.12 -1.01 0.02 0.00 0.03 0.00 0.00 46.19 45.10 3da5 s LEU 34 CO 0.02 -0.66 -0.16 -0.76 0.23 0.00 0.00 176.35 175.01 3da5 s LEU 35 N -3.87 1.81 -0.22 1.79 1.43 0.00 0.42 118.68 120.05 3da5 s LEU 35 Ca 0.28 -0.50 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 3da5 s LEU 35 Cb 0.05 -1.23 -0.05 0.00 0.03 0.00 0.00 46.19 45.00 3da5 s LEU 35 CO 0.15 -0.00 0.24 -0.60 0.23 0.00 0.00 176.35 176.37 3da5 s ARG 36 N 1.18 4.11 -0.50 1.70 3.52 0.21 -1.37 118.95 127.80 3da5 s ARG 36 Ca -0.01 -0.10 -0.28 0.00 -0.13 0.00 0.00 55.73 55.21 3da5 s ARG 36 Cb -0.14 -3.53 0.00 0.00 -1.56 0.00 0.00 34.95 29.72 3da5 s ARG 36 CO -0.06 0.04 1.56 0.34 -0.81 0.00 0.00 175.30 176.36 3da5 s ASP 37 N 1.02 5.98 -0.01 -2.12 -1.08 -0.58 -1.85 116.67 118.03 3da5 s ASP 37 Ca 0.12 0.58 0.16 0.00 -0.52 0.00 0.00 52.55 52.89 3da5 s ASP 37 Cb -0.14 -2.54 0.47 0.00 -1.46 0.00 0.00 42.92 39.26 3da5 s ASP 37 CO 0.05 -1.77 1.39 2.30 0.52 0.00 0.00 175.17 177.67 3da5 n ILE 38 N 7.06 0.78 0.54 4.11 -5.35 0.61 -4.07 119.36 123.04 3da5 n ILE 38 Ca 0.16 -0.72 0.10 0.00 -0.27 0.00 0.00 62.75 62.01 3da5 n ILE 38 Cb 0.49 0.31 0.12 0.00 -1.74 0.00 0.00 39.64 38.83 3da5 n ILE 38 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3da5 n ALA 39 N 1.02 2.43 -2.60 -1.28 0.00 -1.23 -4.97 120.51 113.88 3da5 n ALA 39 Ca 0.18 -0.79 -0.23 0.00 0.00 0.00 0.00 53.44 52.59 3da5 n ALA 39 Cb 0.47 -0.67 -0.07 0.00 0.00 0.00 0.00 19.45 19.18 3da5 n ALA 39 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3da5 s SER 40 N -1.45 4.49 0.10 0.00 1.04 -1.26 -4.81 113.70 111.82 3da5 s SER 40 Ca 0.26 -0.73 -0.22 0.00 0.48 0.00 0.00 55.95 55.74 3da5 s SER 40 Cb 0.17 -0.77 -0.13 0.00 0.10 0.00 0.00 66.02 65.40 3da5 s SER 40 CO 0.25 -0.09 1.74 1.05 0.98 0.00 0.00 173.24 177.17 3da5 h GLU 41 N 1.82 0.03 -5.04 4.02 9.09 -1.92 -3.37 114.58 119.20 3da5 h GLU 41 Ca -0.44 -0.00 -0.64 0.00 0.05 0.00 0.00 59.36 58.33 3da5 h GLU 41 Cb 1.25 -0.01 -0.16 0.00 -1.65 0.00 0.00 28.75 28.19 3da5 h GLU 41 CO 0.62 0.02 -0.30 -1.01 0.05 0.00 0.00 179.01 178.39 3da5 s HIS 42 N -6.19 3.23 -1.24 2.06 3.76 -1.26 -4.99 115.29 110.65 3da5 s HIS 42 Ca -0.13 0.20 -0.13 0.00 -0.15 0.00 0.00 55.06 54.85 3da5 s HIS 42 Cb 0.07 -2.58 0.16 0.00 1.11 0.00 0.00 32.58 31.33 3da5 s HIS 42 CO 0.67 -0.30 1.59 1.63 -0.85 0.00 0.00 174.74 177.48 3da5 n LYS 43 N 5.32 3.39 -2.58 1.40 5.02 -1.26 -4.93 118.16 124.51 3da5 n LYS 43 Ca -0.09 -3.68 -0.36 0.00 -2.02 0.00 0.00 58.31 52.16 3da5 n LYS 43 Cb 0.50 -3.07 -0.04 0.00 -0.02 0.00 0.00 35.03 32.40 3da5 n LYS 43 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3da5 s VAL 44 N 1.63 3.82 -0.11 -0.18 1.01 -1.26 -4.71 120.40 120.61 3da5 s VAL 44 Ca 0.43 1.32 -0.02 0.00 0.00 0.00 0.00 61.98 63.71 3da5 s VAL 44 Cb 0.01 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 3da5 s VAL 44 CO 0.01 -0.07 -0.02 -0.69 0.00 0.00 0.00 175.10 174.33 3da5 s VAL 45 N -1.77 4.10 0.16 2.92 1.01 -1.26 -1.53 120.40 124.03 3da5 s VAL 45 Ca 0.60 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 62.31 3da5 s VAL 45 Cb -0.19 -2.74 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 3da5 s VAL 45 CO 0.24 0.57 -0.10 -0.31 0.00 0.00 0.00 175.10 175.50 3da5 s TYR 46 N -0.47 1.35 -0.18 5.22 2.02 -0.47 -4.09 117.35 120.72 3da5 s TYR 46 Ca 0.08 -0.75 -0.04 0.00 -0.37 0.00 0.00 57.07 55.99 3da5 s TYR 46 Cb -0.12 -0.68 -0.02 0.00 -0.40 0.00 0.00 41.96 40.73 3da5 s TYR 46 CO 0.02 0.11 -0.02 0.21 -1.57 0.00 0.00 175.55 174.30 3da5 s LYS 47 N -3.74 3.61 0.11 -0.62 2.20 -0.01 -0.82 119.74 120.47 3da5 s LYS 47 Ca 0.18 -0.54 -0.34 0.00 -0.36 0.00 0.00 55.97 54.91 3da5 s LYS 47 Cb 0.02 -2.99 -0.14 0.00 -1.51 0.00 0.00 37.83 33.21 3da5 s LYS 47 CO 0.02 0.09 1.59 -2.30 -0.36 0.00 0.00 175.35 174.39 3da5 n PRO 48 N 3.99 2.01 -3.26 4.03 -0.02 -1.26 -0.83 135.00 139.66 3da5 n PRO 48 Ca -0.17 0.73 -0.39 0.00 -2.02 0.00 0.00 63.50 61.65 3da5 n PRO 48 Cb 0.52 -2.49 -0.06 0.00 -0.02 0.00 0.00 33.50 31.45 3da5 n PRO 48 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3da5 s ILE 49 N 1.33 4.82 0.16 4.25 1.01 -0.07 -4.88 121.20 127.82 3da5 s ILE 49 Ca 0.82 1.21 0.05 0.00 0.00 0.00 0.00 60.65 62.72 3da5 s ILE 49 Cb -0.72 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 37.81 3da5 s ILE 49 CO 0.41 0.50 0.15 -0.36 0.00 0.00 0.00 174.94 175.64 3da5 s PHE 50 N -0.71 3.19 0.59 3.97 0.08 -1.26 -1.99 117.98 121.86 3da5 s PHE 50 Ca 0.29 0.00 -0.19 0.00 0.12 0.00 0.00 56.93 57.16 3da5 s PHE 50 Cb -0.19 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 40.69 3da5 s PHE 50 CO 0.18 0.52 1.15 1.63 -0.10 0.00 0.00 175.22 178.60 3da5 n LYS 51 N -0.32 1.16 -0.50 0.44 5.02 -0.58 -4.64 118.16 118.73 3da5 n LYS 51 Ca -0.08 0.44 0.41 0.00 -2.02 0.00 0.00 58.31 57.06 3da5 n LYS 51 Cb 0.54 -2.36 0.70 0.00 -0.02 0.00 0.00 35.03 33.89 3da5 n LYS 51 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3da5 h ARG 52 N 0.77 0.04 -2.63 1.97 2.47 -1.98 -1.95 114.38 113.08 3da5 h ARG 52 Ca -0.49 -0.00 -0.60 0.00 -1.26 0.00 0.00 59.98 57.62 3da5 h ARG 52 Cb 1.34 -0.01 -0.39 0.00 -1.65 0.00 0.00 29.97 29.26 3da5 h ARG 52 CO 0.53 0.03 -0.83 0.71 0.56 0.00 0.00 179.97 180.97 3da5 s TYR 53 N -5.18 1.90 -0.49 3.04 2.02 -1.26 -5.11 117.35 112.27 3da5 s TYR 53 Ca -0.07 -2.62 -0.23 0.00 -0.37 0.00 0.00 57.07 53.78 3da5 s TYR 53 Cb 0.29 -1.53 0.03 0.00 -0.40 0.00 0.00 41.96 40.36 3da5 s TYR 53 CO 0.84 -0.74 0.84 -0.80 -1.57 0.00 0.00 175.55 174.12 3da5 s ASN 54 N -0.36 6.38 -0.14 2.29 0.01 -0.73 -4.98 114.94 117.41 3da5 s ASN 54 Ca 0.29 -0.24 0.02 0.00 -0.71 0.00 0.00 52.86 52.23 3da5 s ASN 54 Cb -0.01 -2.40 -0.10 0.00 0.41 0.00 0.00 41.25 39.15 3da5 s ASN 54 CO -0.17 -1.03 -0.10 0.61 -1.51 0.00 0.00 177.10 174.90 3da5 n GLY 55 N 5.04 -0.24 3.91 0.66 0.00 -1.26 -4.84 105.19 108.46 3da5 n GLY 55 Ca 0.02 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 3da5 n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3da5 s ASP 56 N -5.22 6.38 0.55 1.61 1.11 -1.26 -4.88 116.67 114.97 3da5 s ASP 56 Ca -0.17 0.35 -0.21 0.00 0.18 0.00 0.00 52.55 52.70 3da5 s ASP 56 Cb 0.05 -2.00 -0.05 0.00 1.07 0.00 0.00 42.92 41.99 3da5 s ASP 56 CO 0.34 0.22 1.28 -2.16 1.18 0.00 0.00 175.17 176.03 3da5 s PRO 57 N -2.16 3.16 -0.88 8.23 0.04 -1.26 -1.52 135.00 140.60 3da5 s PRO 57 Ca 0.31 2.04 -0.22 0.00 0.04 0.00 0.00 61.00 63.17 3da5 s PRO 57 Cb -0.13 -2.17 0.08 0.00 0.04 0.00 0.00 34.50 32.32 3da5 s PRO 57 CO 0.22 -1.11 1.22 0.34 0.04 0.00 0.00 177.00 177.70 3da5 s ASP 58 N -1.22 6.44 0.27 6.66 -1.08 -0.84 -4.64 116.67 122.27 3da5 s ASP 58 Ca 0.72 -1.46 0.07 0.00 -0.52 0.00 0.00 52.55 51.37 3da5 s ASP 58 Cb -0.36 -2.48 -0.03 0.00 -1.46 0.00 0.00 42.92 38.59 3da5 s ASP 58 CO 0.41 -1.37 0.22 -0.76 0.52 0.00 0.00 175.17 174.19 3da5 s LEU 59 N 4.05 3.78 -0.22 -1.34 1.43 -1.26 -2.35 118.68 122.77 3da5 s LEU 59 Ca 0.35 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 3da5 s LEU 59 Cb -0.06 -2.34 0.03 0.00 0.03 0.00 0.00 46.19 43.85 3da5 s LEU 59 CO -0.03 -0.11 -0.12 -0.63 0.23 0.00 0.00 176.35 175.69 3da5 s ILE 60 N -2.17 2.48 -0.30 -0.59 1.01 -0.11 -4.96 121.20 116.57 3da5 s ILE 60 Ca 0.35 -1.06 0.05 0.00 0.00 0.00 0.00 60.65 59.98 3da5 s ILE 60 Cb -0.07 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.15 3da5 s ILE 60 CO 0.25 0.30 0.28 -0.62 0.00 0.00 0.00 174.94 175.16 3da5 n GLU 61 N 4.62 4.48 -0.40 2.79 1.02 -1.26 -0.49 120.64 131.39 3da5 n GLU 61 Ca -0.18 -0.14 0.11 0.00 -0.02 0.00 0.00 57.16 56.94 3da5 n GLU 61 Cb 0.48 -0.79 0.33 0.00 -0.02 0.00 0.00 31.44 31.44 3da5 n GLU 61 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3da5 n ASP 62 N -0.87 4.06 -3.45 1.62 5.68 -1.26 -4.88 116.55 117.45 3da5 n ASP 62 Ca 0.01 -2.06 -0.28 0.00 -0.50 0.00 0.00 54.79 51.96 3da5 n ASP 62 Cb 0.08 -0.50 -0.11 0.00 -1.14 0.00 0.00 41.12 39.45 3da5 n ASP 62 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 3da5 s ASN 63 N -0.99 2.41 0.30 -1.12 2.47 -1.26 -4.95 114.94 111.80 3da5 s ASN 63 Ca 0.49 -2.57 0.26 0.00 0.42 0.00 0.00 52.86 51.45 3da5 s ASN 63 Cb 0.26 -0.45 0.76 0.00 -1.45 0.00 0.00 41.25 40.37 3da5 s ASN 63 CO 0.32 -0.25 1.74 0.77 -3.72 0.00 0.00 177.10 175.96 3da5 h SER 64 N 6.44 0.00 -0.76 -4.21 4.64 -1.90 -2.06 113.55 115.70 3da5 h SER 64 Ca 0.14 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.44 3da5 h SER 64 Cb 0.94 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.00 3da5 h SER 64 CO 0.32 0.00 0.39 0.78 -0.87 0.00 0.00 176.83 177.45 3da5 h ASN 65 N 0.00 0.98 0.08 4.97 2.35 -1.95 -1.72 115.58 120.28 3da5 h ASN 65 Ca 0.00 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.55 3da5 h ASN 65 Cb 0.73 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 3da5 h ASN 65 CO 0.00 0.82 -0.27 0.44 -1.65 0.00 0.00 177.43 176.77 3da5 h ASP 66 N 1.06 0.31 -0.22 5.81 5.19 -1.80 -1.58 116.42 125.19 3da5 h ASP 66 Ca 0.26 -0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 56.56 3da5 h ASP 66 Cb 0.08 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 3da5 h ASP 66 CO -0.04 0.58 0.09 0.58 -3.12 0.00 0.00 179.24 177.33 3da5 h VAL 67 N 0.28 1.16 -0.43 -1.35 2.07 -1.34 -1.33 116.25 115.30 3da5 h VAL 67 Ca 0.04 -0.48 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 3da5 h VAL 67 Cb 0.62 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3da5 h VAL 67 CO 0.04 0.16 -0.11 -0.33 0.02 0.00 0.00 177.57 177.36 3da5 h GLU 68 N 0.20 0.78 0.00 1.57 5.08 -1.24 -1.55 114.58 119.42 3da5 h GLU 68 Ca 0.07 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.18 3da5 h GLU 68 Cb 0.17 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3da5 h GLU 68 CO -0.01 0.86 -0.04 1.25 -1.00 0.00 0.00 179.01 180.07 3da5 h HIS 69 N 0.71 -0.09 -0.23 4.33 2.76 -1.00 -0.40 115.15 121.22 3da5 h HIS 69 Ca 0.12 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.20 3da5 h HIS 69 Cb 0.58 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.57 3da5 h HIS 69 CO 0.03 -0.06 -0.28 -1.49 -1.30 0.00 0.00 177.93 174.83 3da5 h TRP 70 N -0.07 0.50 0.14 5.26 4.06 -1.16 0.94 115.95 125.61 3da5 h TRP 70 Ca 0.02 -0.11 -0.01 0.00 2.06 0.00 0.00 58.89 60.85 3da5 h TRP 70 Cb 0.09 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.13 3da5 h TRP 70 CO -0.11 0.68 -0.06 -0.92 -3.56 0.00 0.00 178.44 174.46 3da5 h TYR 71 N 0.39 -0.17 -0.55 0.49 3.20 -1.12 -2.80 116.97 116.40 3da5 h TYR 71 Ca 0.05 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 3da5 h TYR 71 Cb 0.69 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 3da5 h TYR 71 CO 0.02 0.14 0.07 -0.44 -1.64 0.00 0.00 178.16 176.31 3da5 h ASP 72 N -0.48 0.84 -0.44 -2.11 3.32 -1.05 -2.34 116.42 114.16 3da5 h ASP 72 Ca -0.02 -0.18 0.09 0.00 0.02 0.00 0.00 57.03 56.93 3da5 h ASP 72 Cb 0.38 -0.22 -0.08 0.00 0.22 0.00 0.00 39.33 39.63 3da5 h ASP 72 CO 0.03 0.86 -0.03 0.22 -1.72 0.00 0.00 179.24 178.61 3da5 h TYR 73 N 0.84 -0.08 -0.09 4.55 3.20 -0.83 -0.23 116.97 124.33 3da5 h TYR 73 Ca 0.17 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 3da5 h TYR 73 Cb 0.39 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.77 3da5 h TYR 73 CO 0.02 -0.12 -0.29 0.45 -1.64 0.00 0.00 178.16 176.58 3da5 h HIS 74 N 0.08 0.47 -0.57 -3.82 3.86 -1.22 -2.10 115.15 111.86 3da5 h HIS 74 Ca 0.22 -0.19 0.11 0.00 -1.16 0.00 0.00 60.37 59.35 3da5 h HIS 74 Cb 0.33 -0.08 -0.11 0.00 1.06 0.00 0.00 27.41 28.60 3da5 h HIS 74 CO -0.31 0.91 -0.24 1.25 0.86 0.00 0.00 177.93 180.39 3da5 h LEU 75 N -0.09 -0.84 -0.44 2.43 5.85 -1.26 0.11 115.31 121.06 3da5 h LEU 75 Ca -0.01 0.20 -0.18 0.00 0.84 0.00 0.00 57.88 58.73 3da5 h LEU 75 Cb 0.91 0.47 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 3da5 h LEU 75 CO 0.06 -0.26 -0.75 -0.33 -0.34 0.00 0.00 178.44 176.83 3da5 h GLU 76 N -0.10 0.28 -0.00 1.25 5.08 -0.99 -0.67 114.58 119.43 3da5 h GLU 76 Ca 0.26 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 3da5 h GLU 76 Cb 0.50 0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.81 3da5 h GLU 76 CO -0.64 0.90 -0.27 0.00 -1.00 0.00 0.00 179.01 178.01 3da5 h ARG 77 N 0.19 0.19 0.00 2.33 3.08 -1.06 -3.40 114.38 115.70 3da5 h ARG 77 Ca -0.03 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.82 3da5 h ARG 77 Cb 1.32 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.42 3da5 h ARG 77 CO 0.12 0.93 -0.38 0.66 -1.07 0.00 0.00 179.97 180.23 3da5 n TYR 78 N -4.49 0.00 -2.63 3.04 4.01 0.34 -4.65 117.16 112.78 3da5 n TYR 78 Ca -0.10 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.53 3da5 n TYR 78 Cb 0.51 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 39.56 3da5 n TYR 78 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 3da5 n TRP 79 N -1.20 1.64 -1.62 -0.72 7.02 -0.26 -4.88 117.44 117.42 3da5 n TRP 79 Ca 0.01 -2.73 -0.29 0.00 -1.02 0.00 0.00 57.50 53.48 3da5 n TRP 79 Cb 0.11 -0.30 0.06 0.00 -2.42 0.00 0.00 31.31 28.76 3da5 n TRP 79 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 3da5 n ASN 80 N -0.25 6.23 -4.43 -0.99 5.15 -1.23 -3.00 115.26 116.74 3da5 n ASN 80 Ca 0.16 -3.77 -0.24 0.00 -0.60 0.00 0.00 54.58 50.13 3da5 n ASN 80 Cb 0.79 -0.70 -0.11 0.00 -0.53 0.00 0.00 39.78 39.24 3da5 n ASN 80 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3da5 s THR 81 N -4.63 2.29 0.26 -0.44 -4.23 -1.26 -5.00 115.64 102.63 3da5 s THR 81 Ca 0.58 -2.25 -0.02 0.00 -1.18 0.00 0.00 61.69 58.82 3da5 s THR 81 Cb 0.46 -2.18 0.26 0.00 1.34 0.00 0.00 72.50 72.38 3da5 s THR 81 CO 0.01 -0.35 1.69 -0.65 -0.54 0.00 0.00 174.62 174.78 3da5 h PRO 82 N 2.62 0.30 0.10 3.99 0.11 -1.99 0.90 132.00 138.02 3da5 h PRO 82 Ca -0.41 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.67 3da5 h PRO 82 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3da5 h PRO 82 CO 0.56 0.20 -0.05 0.93 -0.21 0.00 0.00 178.00 179.43 3da5 h GLU 83 N 0.31 -0.13 -0.38 1.05 3.07 -1.97 -2.36 114.58 114.18 3da5 h GLU 83 Ca 0.47 0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 59.25 3da5 h GLU 83 Cb 0.84 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.76 3da5 h GLU 83 CO -0.53 0.03 -0.14 -0.07 -1.40 0.00 0.00 179.01 176.90 3da5 h LEU 84 N -0.27 0.67 -0.92 1.33 3.38 -1.72 -2.23 115.31 115.56 3da5 h LEU 84 Ca -0.01 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 3da5 h LEU 84 Cb 0.22 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3da5 h LEU 84 CO 0.02 0.83 -0.04 0.50 0.09 0.00 0.00 178.44 179.85 3da5 h LYS 85 N 0.61 0.76 -0.19 1.13 3.64 -0.74 0.76 116.57 122.55 3da5 h LYS 85 Ca 0.10 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3da5 h LYS 85 Cb 0.59 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 3da5 h LYS 85 CO 0.04 0.79 0.10 -0.22 -2.27 0.00 0.00 179.45 177.89 3da5 h LYS 86 N 0.70 0.26 -0.36 1.90 3.64 -1.18 -1.78 116.57 119.75 3da5 h LYS 86 Ca 0.13 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 3da5 h LYS 86 Cb 0.48 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 3da5 h LYS 86 CO 0.02 0.27 0.12 1.49 -2.27 0.00 0.00 179.45 179.09 3da5 h GLU 87 N 0.19 0.55 -0.24 1.90 4.81 -1.18 0.30 114.58 120.91 3da5 h GLU 87 Ca 0.06 -0.11 0.05 0.00 -0.13 0.00 0.00 59.36 59.23 3da5 h GLU 87 Cb 0.09 -0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 3da5 h GLU 87 CO -0.01 0.56 -0.45 0.35 -0.73 0.00 0.00 179.01 178.73 3da5 h PHE 88 N 0.43 -1.31 -0.84 0.92 3.57 -0.85 -0.11 116.94 118.75 3da5 h PHE 88 Ca 0.12 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 3da5 h PHE 88 Cb 0.23 0.60 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 3da5 h PHE 88 CO 0.01 -0.48 0.45 -0.92 -2.23 0.00 0.00 178.31 175.14 3da5 h TYR 89 N -0.45 1.17 -0.51 0.41 3.20 -0.80 0.84 116.97 120.85 3da5 h TYR 89 Ca 0.09 -0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.86 3da5 h TYR 89 Cb 0.62 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 3da5 h TYR 89 CO -0.56 0.82 0.04 0.87 -1.64 0.00 0.00 178.16 177.69 3da5 h LYS 90 N 1.18 0.82 0.11 1.82 1.57 -0.43 0.51 116.57 122.14 3da5 h LYS 90 Ca 0.30 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 3da5 h LYS 90 Cb 0.05 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3da5 h LYS 90 CO -0.05 0.80 -0.05 -0.22 -0.57 0.00 0.00 179.45 179.36 3da5 h LYS 91 N 0.77 -0.14 0.00 3.15 3.64 -0.72 -3.39 116.57 119.88 3da5 h LYS 91 Ca 0.16 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.41 3da5 h LYS 91 Cb 0.41 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 3da5 h LYS 91 CO 0.01 0.36 -2.11 1.19 -2.27 0.00 0.00 179.45 176.63 3da5 n PHE 92 N -4.88 0.00 -0.16 1.91 3.72 0.26 -5.10 117.46 113.21 3da5 n PHE 92 Ca -0.08 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.34 3da5 n PHE 92 Cb 0.28 -0.67 -0.01 0.00 -0.94 0.00 0.00 39.48 38.15 3da5 n PHE 92 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3da5 n GLY 93 N 1.49 -1.39 3.75 1.37 0.00 0.18 -4.88 105.19 105.71 3da5 n GLY 93 Ca -0.15 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.05 3da5 n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3da5 s PRO 94 N -1.21 2.51 0.31 1.61 0.04 -1.26 -4.88 135.00 132.11 3da5 s PRO 94 Ca 0.00 1.47 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 3da5 s PRO 94 Cb 0.00 -1.91 -0.12 0.00 0.04 0.00 0.00 34.50 32.52 3da5 s PRO 94 CO 0.00 -1.49 1.54 1.55 0.04 0.00 0.00 177.00 178.64 3da5 n VAL 95 N -2.67 1.26 -3.39 -0.36 3.14 -1.26 -4.97 118.33 110.09 3da5 n VAL 95 Ca 0.11 -0.31 -0.44 0.00 -2.96 0.00 0.00 64.34 60.73 3da5 n VAL 95 Cb 0.52 -1.90 -0.07 0.00 -1.06 0.00 0.00 33.84 31.33 3da5 n VAL 95 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3da5 s ASP 96 N 0.31 6.11 0.12 6.55 -1.08 -1.26 -4.94 116.67 122.49 3da5 s ASP 96 Ca 0.62 -1.48 0.16 0.00 -0.52 0.00 0.00 52.55 51.33 3da5 s ASP 96 Cb -0.51 -2.17 0.72 0.00 -1.46 0.00 0.00 42.92 39.50 3da5 s ASP 96 CO 0.52 -0.70 1.51 0.18 0.52 0.00 0.00 175.17 177.21 3da5 n LEU 97 N 5.19 0.29 0.05 -1.34 4.77 -1.26 -2.64 117.00 122.05 3da5 n LEU 97 Ca -0.13 0.58 0.13 0.00 -0.03 0.00 0.00 56.01 56.57 3da5 n LEU 97 Cb 0.43 -0.56 0.47 0.00 -2.33 0.00 0.00 43.42 41.43 3da5 n LEU 97 CO 0.48 -0.46 0.85 0.59 -1.33 0.00 0.00 177.39 177.53 3da5 n ASN 98 N -1.83 0.45 -4.77 -1.43 3.02 -1.26 -4.70 115.26 104.74 3da5 n ASN 98 Ca 0.02 0.46 -0.39 0.00 -0.03 0.00 0.00 54.58 54.65 3da5 n ASN 98 Cb 0.16 -0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 38.76 3da5 n ASN 98 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3da5 s GLN 99 N -3.06 4.20 0.74 3.52 -2.07 -1.08 -4.79 119.66 117.12 3da5 s GLN 99 Ca 0.12 1.85 -0.11 0.00 -1.82 0.00 0.00 55.36 55.40 3da5 s GLN 99 Cb 0.15 -2.80 0.04 0.00 -1.09 0.00 0.00 33.01 29.31 3da5 s GLN 99 CO 0.58 -0.19 1.09 -1.25 -1.32 0.00 0.00 175.29 174.20 3da5 s PRO 100 N -2.10 2.56 -0.12 9.60 0.04 -1.26 -4.95 135.00 138.76 3da5 s PRO 100 Ca 0.54 0.63 -0.13 0.00 0.04 0.00 0.00 61.00 62.08 3da5 s PRO 100 Cb -0.31 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 3da5 s PRO 100 CO 0.40 -1.28 0.30 0.42 0.04 0.00 0.00 177.00 176.87 3da5 s ILE 101 N -3.21 5.28 -0.28 0.56 1.01 0.36 -4.26 121.20 120.65 3da5 s ILE 101 Ca 0.59 0.57 -0.12 0.00 0.00 0.00 0.00 60.65 61.68 3da5 s ILE 101 Cb -0.13 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 3da5 s ILE 101 CO 0.53 0.46 0.25 -0.63 0.00 0.00 0.00 174.94 175.55 3da5 s ILE 102 N -0.03 5.27 0.04 2.92 1.01 0.10 -0.93 121.20 129.57 3da5 s ILE 102 Ca 0.18 0.27 -0.30 0.00 0.00 0.00 0.00 60.65 60.79 3da5 s ILE 102 Cb -0.14 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 3da5 s ILE 102 CO 0.06 0.21 1.06 -0.76 0.00 0.00 0.00 174.94 175.50 3da5 s LEU 103 N 1.85 4.39 0.08 2.97 1.02 -0.99 -0.96 118.68 127.04 3da5 s LEU 103 Ca 0.09 1.81 -0.08 0.00 0.02 0.00 0.00 54.13 55.98 3da5 s LEU 103 Cb -0.16 -3.58 -0.00 0.00 0.02 0.00 0.00 46.19 42.47 3da5 s LEU 103 CO 0.11 -0.31 0.17 0.00 0.02 0.00 0.00 176.35 176.34 3da5 s ALA 104 N 0.87 -0.18 0.07 4.21 0.00 -0.26 -0.89 121.76 125.59 3da5 s ALA 104 Ca 0.54 -0.63 0.05 0.00 0.00 0.00 0.00 51.96 51.92 3da5 s ALA 104 Cb -0.24 0.45 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 3da5 s ALA 104 CO 0.29 -0.48 -0.14 -1.59 0.00 0.00 0.00 175.76 173.84 3da5 s LYS 105 N -3.73 0.83 0.62 0.00 -2.85 -0.01 -0.70 119.74 113.89 3da5 s LYS 105 Ca 0.04 -0.97 -0.17 0.00 -1.00 0.00 0.00 55.97 53.88 3da5 s LYS 105 Cb 0.04 -0.83 -0.02 0.00 -2.06 0.00 0.00 37.83 34.96 3da5 s LYS 105 CO -0.10 0.18 1.12 -1.25 0.10 0.00 0.00 175.35 175.40 3da5 s PRO 106 N -1.79 3.00 0.00 1.78 0.04 -1.26 -0.83 135.00 135.94 3da5 s PRO 106 Ca -0.02 1.48 0.24 0.00 0.04 0.00 0.00 61.00 62.75 3da5 s PRO 106 Cb -0.10 -1.97 1.03 0.00 0.04 0.00 0.00 34.50 33.51 3da5 s PRO 106 CO 0.02 -1.11 1.78 1.28 0.04 0.00 0.00 177.00 179.01 3da5 n LEU 107 N -2.00 0.01 0.00 -3.56 4.77 -1.26 -4.83 117.00 110.13 3da5 n LEU 107 Ca 0.11 0.50 -0.10 0.00 -0.03 0.00 0.00 56.01 56.49 3da5 n LEU 107 Cb 0.52 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 41.12 3da5 n LEU 107 CO 0.46 -0.09 0.40 -2.11 -1.33 0.00 0.00 177.39 174.72 3da5 n ARG 108 N -1.51 0.94 -1.86 3.23 -4.01 -1.26 -5.13 116.66 107.05 3da5 n ARG 108 Ca 0.06 -2.23 -0.42 0.00 -1.04 0.00 0.00 57.85 54.22 3da5 n ARG 108 Cb 0.28 2.57 -0.03 0.00 -3.04 0.00 0.00 32.46 32.25 3da5 n ARG 108 CO 0.00 0.00 0.00 -1.14 -3.04 0.00 0.00 177.63 173.45 3da5 s GLN 109 N -2.28 4.18 0.01 2.89 2.00 -1.26 -4.97 119.66 120.23 3da5 s GLN 109 Ca 0.18 2.46 0.06 0.00 -2.00 0.00 0.00 55.36 56.06 3da5 s GLN 109 Cb -0.04 -3.10 -0.02 0.00 0.80 0.00 0.00 33.01 30.66 3da5 s GLN 109 CO 0.14 -0.61 -0.18 -1.58 -0.50 0.00 0.00 175.29 172.56 3da5 s HIS 110 N 0.67 1.55 0.47 1.67 5.65 -1.26 -5.06 115.29 118.98 3da5 s HIS 110 Ca 0.68 -0.32 0.20 0.00 0.25 0.00 0.00 55.06 55.86 3da5 s HIS 110 Cb -0.46 -0.96 1.27 0.00 -1.18 0.00 0.00 32.58 31.25 3da5 s HIS 110 CO 0.38 0.02 2.07 -0.91 -0.65 0.00 0.00 174.74 175.64 3da5 h ASN 111 N 5.32 0.00 -0.46 9.88 -0.26 -2.06 -2.25 115.58 125.77 3da5 h ASN 111 Ca -0.39 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.35 3da5 h ASN 111 Cb 1.16 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.42 3da5 h ASN 111 CO 0.46 0.12 0.00 0.54 -1.06 0.00 0.00 177.43 177.49 3da5 n ARG 112 N -4.09 2.70 0.00 0.81 5.12 -1.26 -5.04 116.66 114.90 3da5 n ARG 112 Ca -0.02 -1.91 0.00 0.00 -1.93 0.00 0.00 57.85 53.99 3da5 n ARG 112 Cb 0.20 -1.62 0.00 0.00 -1.16 0.00 0.00 32.46 29.88 3da5 n ARG 112 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3da5 n GLY 113 N 0.97 -1.84 1.09 -0.13 0.00 -0.85 -4.61 105.19 99.82 3da5 n GLY 113 Ca 0.17 -1.75 0.04 0.00 0.00 0.00 0.00 46.02 44.49 3da5 n GLY 113 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3da5 n ASP 114 N 0.35 3.70 -3.68 1.61 9.92 -1.26 -4.50 116.55 122.68 3da5 n ASP 114 Ca 0.00 -3.21 -0.10 0.00 -0.53 0.00 0.00 54.79 50.95 3da5 n ASP 114 Cb 0.00 -0.59 -0.11 0.00 -0.64 0.00 0.00 41.12 39.78 3da5 n ASP 114 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 3da5 s LEU 115 N -2.95 -0.29 0.24 0.64 2.96 -1.26 -4.53 118.68 113.49 3da5 s LEU 115 Ca 0.44 0.87 0.10 0.00 -0.22 0.00 0.00 54.13 55.32 3da5 s LEU 115 Cb 0.37 1.22 -0.05 0.00 0.50 0.00 0.00 46.19 48.23 3da5 s LEU 115 CO 0.07 -0.21 -0.17 0.68 -1.32 0.00 0.00 176.35 175.40 3da5 s VAL 116 N 1.98 2.09 -0.19 1.68 -7.23 0.12 -4.99 120.40 113.86 3da5 s VAL 116 Ca -0.05 -2.30 -0.03 0.00 -1.81 0.00 0.00 61.98 57.79 3da5 s VAL 116 Cb -0.10 -2.16 -0.01 0.00 0.56 0.00 0.00 36.38 34.67 3da5 s VAL 116 CO -0.12 -0.50 -0.08 -1.00 -0.31 0.00 0.00 175.10 173.10 3da5 s HIS 117 N -2.73 2.91 -0.03 2.82 0.09 -1.26 -1.10 115.29 115.99 3da5 s HIS 117 Ca 0.26 -0.92 0.07 0.00 -0.00 0.00 0.00 55.06 54.47 3da5 s HIS 117 Cb -0.03 -2.03 -0.02 0.00 -0.00 0.00 0.00 32.58 30.51 3da5 s HIS 117 CO 0.11 -0.48 -0.24 -0.51 -0.00 0.00 0.00 174.74 173.61 3da5 s LEU 118 N 1.18 2.05 -0.04 0.89 1.43 -0.13 -4.94 118.68 119.11 3da5 s LEU 118 Ca 0.02 -0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 52.44 3da5 s LEU 118 Cb -0.14 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.75 3da5 s LEU 118 CO -0.02 0.27 0.65 -0.76 0.23 0.00 0.00 176.35 176.72 3da5 s LEU 119 N -0.39 4.36 0.46 1.79 1.43 -1.26 -0.72 118.68 124.35 3da5 s LEU 119 Ca 0.04 1.17 0.20 0.00 -1.03 0.00 0.00 54.13 54.51 3da5 s LEU 119 Cb -0.11 -3.01 1.19 0.00 0.03 0.00 0.00 46.19 44.29 3da5 s LEU 119 CO 0.01 -0.02 1.93 -0.65 0.23 0.00 0.00 176.35 177.85 3da5 h PRO 120 N 6.26 0.25 0.00 1.29 0.11 -1.93 0.64 132.00 138.62 3da5 h PRO 120 Ca -0.43 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3da5 h PRO 120 Cb 1.20 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3da5 h PRO 120 CO 0.73 0.17 -0.06 0.37 -0.21 0.00 0.00 178.00 179.00 3da5 h GLN 121 N 0.26 0.00 -0.35 1.05 4.15 -1.93 -2.28 115.11 116.01 3da5 h GLN 121 Ca 0.36 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.78 3da5 h GLN 121 Cb 1.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.71 3da5 h GLN 121 CO -0.08 0.06 0.00 1.19 -1.93 0.00 0.00 178.83 178.07 3da5 n PHE 122 N -4.10 0.46 -4.31 3.99 3.72 0.21 -4.90 117.46 112.52 3da5 n PHE 122 Ca -0.03 -0.28 -0.25 0.00 -0.05 0.00 0.00 57.45 56.85 3da5 n PHE 122 Cb 0.15 -0.01 -0.13 0.00 -0.94 0.00 0.00 39.48 38.56 3da5 n PHE 122 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 3da5 s VAL 123 N -1.27 1.78 -0.01 -4.37 -7.23 -1.17 -0.28 120.40 107.85 3da5 s VAL 123 Ca 0.33 -1.56 0.06 0.00 -1.81 0.00 0.00 61.98 59.00 3da5 s VAL 123 Cb 0.19 -1.61 -0.02 0.00 0.56 0.00 0.00 36.38 35.50 3da5 s VAL 123 CO 0.26 -0.03 -0.20 0.68 -0.31 0.00 0.00 175.10 175.50 3da5 s VAL 124 N -1.14 1.60 0.43 1.32 -7.23 -0.77 -0.21 120.40 114.40 3da5 s VAL 124 Ca 0.07 -0.90 -0.23 0.00 -1.81 0.00 0.00 61.98 59.11 3da5 s VAL 124 Cb -0.10 -1.33 -0.08 0.00 0.56 0.00 0.00 36.38 35.42 3da5 s VAL 124 CO 0.04 0.42 1.08 -2.16 -0.31 0.00 0.00 175.10 174.18 3da5 s PRO 125 N -0.55 4.00 -0.12 4.82 0.04 -1.26 -0.62 135.00 141.31 3da5 s PRO 125 Ca 0.08 1.58 0.02 0.00 0.04 0.00 0.00 61.00 62.72 3da5 s PRO 125 Cb -0.08 -2.45 0.01 0.00 0.04 0.00 0.00 34.50 32.02 3da5 s PRO 125 CO -0.00 -0.30 -0.19 0.08 0.04 0.00 0.00 177.00 176.62 3da5 s VAL 126 N -1.66 1.82 -0.13 -0.36 1.01 0.17 -4.84 120.40 116.42 3da5 s VAL 126 Ca 0.61 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 3da5 s VAL 126 Cb -0.23 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 3da5 s VAL 126 CO 0.29 0.50 0.02 -0.31 0.00 0.00 0.00 175.10 175.60 3da5 s TYR 127 N 0.86 3.19 0.00 5.22 1.51 -1.26 -0.40 117.35 126.47 3da5 s TYR 127 Ca -0.08 0.09 0.00 0.00 -1.01 0.00 0.00 57.07 56.07 3da5 s TYR 127 Cb -0.15 -1.91 0.00 0.00 -0.11 0.00 0.00 41.96 39.78 3da5 s TYR 127 CO -0.01 0.30 0.26 0.09 -1.11 0.00 0.00 175.55 175.09