#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1th7 s ALA 2 N 0.00 3.08 0.20 4.61 0.00 -1.26 -4.92 121.76 123.48 1th7 s ALA 2 Ca 0.00 1.28 -0.32 0.00 0.00 0.00 0.00 51.96 52.92 1th7 s ALA 2 Cb 0.00 -3.52 -0.12 0.00 0.00 0.00 0.00 23.12 19.47 1th7 s ALA 2 CO 0.00 -1.06 1.70 -1.33 0.00 0.00 0.00 175.76 175.07 1th7 n MET 3 N -0.38 2.67 -1.90 0.00 2.00 -0.18 -4.88 117.12 114.46 1th7 n MET 3 Ca 0.07 0.96 -0.42 0.00 0.00 0.00 0.00 57.70 58.31 1th7 n MET 3 Cb 0.44 -2.79 -0.03 0.00 0.00 0.00 0.00 33.22 30.84 1th7 n MET 3 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1th7 s ASN 4 N 1.10 6.55 0.38 7.83 3.84 -1.26 -4.88 114.94 128.49 1th7 s ASN 4 Ca 0.75 2.67 0.18 0.00 0.21 0.00 0.00 52.86 56.67 1th7 s ASN 4 Cb -0.53 -2.60 1.11 0.00 -0.55 0.00 0.00 41.25 38.68 1th7 s ASN 4 CO 0.34 -0.85 1.72 0.15 -2.79 0.00 0.00 177.10 175.66 1th7 h PHE 5 N 6.69 0.76 -0.02 0.43 3.57 -2.02 -0.59 116.94 125.77 1th7 h PHE 5 Ca -0.43 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.10 1th7 h PHE 5 Cb 1.20 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.73 1th7 h PHE 5 CO 0.64 -0.03 -0.02 1.28 -2.23 0.00 0.00 178.31 177.95 1th7 n LEU 6 N -4.77 1.95 -3.83 0.59 4.77 -1.26 -4.64 117.00 109.80 1th7 n LEU 6 Ca 0.29 -0.65 -0.42 0.00 -0.03 0.00 0.00 56.01 55.20 1th7 n LEU 6 Cb 0.96 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 1th7 n LEU 6 CO 0.20 0.33 2.56 0.00 -1.33 0.00 0.00 177.39 179.15 1th7 n ALA 7 N 0.49 5.32 -0.31 -1.18 0.00 -0.23 -4.78 120.51 119.83 1th7 n ALA 7 Ca 0.17 -3.91 0.10 0.00 0.00 0.00 0.00 53.44 49.80 1th7 n ALA 7 Cb 0.43 -3.51 0.26 0.00 0.00 0.00 0.00 19.45 16.64 1th7 n ALA 7 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1th7 h GLU 8 N 6.15 0.56 -0.71 0.00 5.08 -1.84 -2.39 114.58 121.44 1th7 h GLU 8 Ca 0.55 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.86 1th7 h GLU 8 Cb 0.66 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 1th7 h GLU 8 CO 1.83 0.37 0.39 1.15 -1.00 0.00 0.00 179.01 181.75 1th7 h THR 9 N 0.58 1.22 -0.53 1.13 2.02 -1.99 -0.10 112.91 115.24 1th7 h THR 9 Ca 0.51 -0.55 -0.07 0.00 0.77 0.00 0.00 66.41 67.07 1th7 h THR 9 Cb 0.81 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1th7 h THR 9 CO -0.41 0.24 0.06 0.00 0.37 0.00 0.00 175.52 175.78 1th7 h ALA 10 N 1.20 0.71 -0.53 6.16 0.00 -1.85 -2.21 119.26 122.73 1th7 h ALA 10 Ca 0.25 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1th7 h ALA 10 Cb 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1th7 h ALA 10 CO -0.04 0.48 0.07 0.45 0.00 0.00 0.00 179.25 180.20 1th7 h HIS 11 N 0.78 0.90 -0.65 0.00 -0.00 -1.15 -2.82 115.15 112.22 1th7 h HIS 11 Ca 0.16 -0.11 -0.08 0.00 -0.00 0.00 0.00 60.37 60.34 1th7 h HIS 11 Cb 0.44 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.57 1th7 h HIS 11 CO 0.03 0.79 0.10 0.87 -0.00 0.00 0.00 177.93 179.72 1th7 h LYS 12 N 0.81 1.07 -0.42 2.45 6.56 -0.76 -0.12 116.57 126.16 1th7 h LYS 12 Ca 0.17 -0.29 -0.01 0.00 -1.06 0.00 0.00 60.65 59.46 1th7 h LYS 12 Cb 0.39 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.90 1th7 h LYS 12 CO 0.01 0.99 0.24 0.28 -2.06 0.00 0.00 179.45 178.91 1th7 h VAL 13 N 1.00 1.15 -0.38 0.50 2.07 -1.20 -0.20 116.25 119.20 1th7 h VAL 13 Ca 0.20 -0.37 -0.13 0.00 0.82 0.00 0.00 66.70 67.22 1th7 h VAL 13 Cb 0.44 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1th7 h VAL 13 CO 0.01 0.15 -0.27 -0.07 0.02 0.00 0.00 177.57 177.42 1th7 h LEU 14 N 0.55 0.89 -0.87 2.57 3.38 -1.33 -2.17 115.31 118.32 1th7 h LEU 14 Ca 0.15 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1th7 h LEU 14 Cb 0.03 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1th7 h LEU 14 CO -0.03 1.13 0.50 0.00 0.09 0.00 0.00 178.44 180.14 1th7 h ALA 15 N 0.78 1.12 0.00 1.53 0.00 -0.81 -1.95 119.26 119.93 1th7 h ALA 15 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1th7 h ALA 15 Cb 0.84 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1th7 h ALA 15 CO 0.07 0.61 0.00 0.93 0.00 0.00 0.00 179.25 180.86 1th7 h GLU 16 N 1.21 0.00 0.00 0.00 5.08 -0.96 -2.94 114.58 116.97 1th7 h GLU 16 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1th7 h GLU 16 Cb -0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1th7 h GLU 16 CO -0.05 0.00 -0.56 0.77 -1.00 0.00 0.00 179.01 178.17 1th7 h SER 17 N 0.00 0.00 -2.64 1.42 0.02 -0.70 -3.46 113.55 108.20 1th7 h SER 17 Ca 0.00 -0.09 -0.58 0.00 -0.84 0.00 0.00 61.79 60.28 1th7 h SER 17 Cb 0.69 0.00 0.08 0.00 0.14 0.00 0.00 62.40 63.30 1th7 h SER 17 CO 0.00 0.04 0.68 -0.11 -1.14 0.00 0.00 176.83 176.31 1th7 n LEU 18 N -2.46 3.23 -1.29 5.07 7.94 -0.87 -1.16 117.00 127.45 1th7 n LEU 18 Ca 0.03 1.13 -0.15 0.00 -1.11 0.00 0.00 56.01 55.91 1th7 n LEU 18 Cb 0.49 -1.44 -0.05 0.00 0.53 0.00 0.00 43.42 42.95 1th7 n LEU 18 CO 0.36 -0.38 -0.15 0.59 -1.11 0.00 0.00 177.39 176.70 1th7 n ASN 19 N 2.46 -4.68 -4.34 1.96 3.02 0.28 -4.97 115.26 109.00 1th7 n ASN 19 Ca 0.13 0.25 -0.17 0.00 -0.03 0.00 0.00 54.58 54.75 1th7 n ASN 19 Cb 0.31 -3.58 -0.10 0.00 -0.61 0.00 0.00 39.78 35.80 1th7 n ASN 19 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1th7 s ASN 20 N -2.69 1.70 0.19 6.41 -0.87 -0.31 -4.89 114.94 114.49 1th7 s ASN 20 Ca 0.00 -1.28 -0.30 0.00 -1.57 0.00 0.00 52.86 49.72 1th7 s ASN 20 Cb 0.00 0.04 -0.08 0.00 -0.02 0.00 0.00 41.25 41.19 1th7 s ASN 20 CO 0.00 -0.58 1.10 -0.76 -2.57 0.00 0.00 177.10 174.29 1th7 s LEU 21 N -3.32 4.50 0.11 0.60 1.43 -1.26 -1.36 118.68 119.38 1th7 s LEU 21 Ca 0.31 2.13 -0.03 0.00 -1.03 0.00 0.00 54.13 55.51 1th7 s LEU 21 Cb 0.07 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 1th7 s LEU 21 CO 0.10 -0.21 0.07 0.68 0.23 0.00 0.00 176.35 177.22 1th7 s VAL 22 N -0.38 0.13 0.04 -1.59 -7.23 -0.10 0.46 120.40 111.72 1th7 s VAL 22 Ca 0.49 -1.76 0.09 0.00 -1.81 0.00 0.00 61.98 58.98 1th7 s VAL 22 Cb -0.30 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.78 1th7 s VAL 22 CO 0.36 -0.59 -0.25 -1.48 -0.31 0.00 0.00 175.10 172.83 1th7 s LEU 23 N -2.99 2.15 -0.13 1.32 0.05 -0.17 -1.55 118.68 117.36 1th7 s LEU 23 Ca 0.17 -0.56 -0.00 0.00 0.05 0.00 0.00 54.13 53.80 1th7 s LEU 23 Cb 0.07 -1.22 0.03 0.00 -2.05 0.00 0.00 46.19 43.01 1th7 s LEU 23 CO -0.02 0.25 -0.10 -0.69 -0.55 0.00 0.00 176.35 175.24 1th7 s VAL 24 N -0.77 1.22 -0.02 1.48 1.01 0.31 -1.35 120.40 122.28 1th7 s VAL 24 Ca 0.11 -0.44 -0.25 0.00 0.00 0.00 0.00 61.98 61.40 1th7 s VAL 24 Cb -0.10 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1th7 s VAL 24 CO 0.02 0.38 0.75 -0.54 0.00 0.00 0.00 175.10 175.70 1th7 s LYS 25 N 1.63 4.46 0.36 2.72 -0.14 -0.16 -2.01 119.74 126.60 1th7 s LYS 25 Ca 0.05 0.99 0.08 0.00 -1.36 0.00 0.00 55.97 55.73 1th7 s LYS 25 Cb -0.13 -3.42 -0.06 0.00 -1.68 0.00 0.00 37.83 32.54 1th7 s LYS 25 CO -0.09 0.13 0.02 -0.51 -0.76 0.00 0.00 175.35 174.14 1th7 s LEU 26 N 0.53 2.95 0.87 3.17 1.43 0.21 -0.19 118.68 127.65 1th7 s LEU 26 Ca 0.39 -1.09 -0.10 0.00 -1.03 0.00 0.00 54.13 52.29 1th7 s LEU 26 Cb -0.19 -1.25 0.12 0.00 0.03 0.00 0.00 46.19 44.90 1th7 s LEU 26 CO 0.21 -0.32 1.14 -0.54 0.23 0.00 0.00 176.35 177.07 1th7 s LYS 27 N -3.73 1.40 -0.54 1.70 1.02 -0.12 -2.63 119.74 116.84 1th7 s LYS 27 Ca 0.36 1.46 0.00 0.00 0.02 0.00 0.00 55.97 57.81 1th7 s LYS 27 Cb 0.03 -1.78 0.00 0.00 -0.52 0.00 0.00 37.83 35.56 1th7 s LYS 27 CO 0.19 -2.33 0.00 0.41 -0.92 0.00 0.00 175.35 172.70 1th7 n GLY 28 N -0.15 0.66 3.90 -3.33 0.00 -1.26 -3.37 105.19 101.63 1th7 n GLY 28 Ca 0.11 -0.79 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 1th7 n GLY 28 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1th7 n ASN 29 N 1.11 -4.45 -4.93 1.61 3.02 -1.19 -4.99 115.26 105.44 1th7 n ASN 29 Ca -0.06 -0.78 -0.20 0.00 -0.03 0.00 0.00 54.58 53.51 1th7 n ASN 29 Cb 0.25 -3.89 -0.02 0.00 -0.61 0.00 0.00 39.78 35.51 1th7 n ASN 29 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1th7 s LYS 30 N -6.57 2.86 -0.19 3.52 -0.14 -1.08 -4.97 119.74 113.17 1th7 s LYS 30 Ca 0.60 -1.22 -0.23 0.00 -1.36 0.00 0.00 55.97 53.76 1th7 s LYS 30 Cb -0.30 -2.64 0.06 0.00 -1.68 0.00 0.00 37.83 33.27 1th7 s LYS 30 CO 0.83 -0.02 0.61 -2.00 -0.76 0.00 0.00 175.35 174.01 1th7 s GLU 31 N -4.14 0.77 0.09 1.68 2.12 -1.26 -0.62 118.70 117.34 1th7 s GLU 31 Ca 0.46 0.72 0.03 0.00 0.36 0.00 0.00 54.97 56.54 1th7 s GLU 31 Cb -0.07 0.37 -0.04 0.00 0.26 0.00 0.00 34.13 34.65 1th7 s GLU 31 CO 0.30 -0.13 -0.10 0.14 -0.54 0.00 0.00 175.26 174.93 1th7 s VAL 32 N 0.02 0.90 0.03 3.70 -7.23 -0.85 -1.07 120.40 115.90 1th7 s VAL 32 Ca -0.02 -1.60 0.02 0.00 -1.81 0.00 0.00 61.98 58.57 1th7 s VAL 32 Cb -0.04 -1.31 -0.02 0.00 0.56 0.00 0.00 36.38 35.57 1th7 s VAL 32 CO 0.02 -0.55 -0.08 -0.13 -0.31 0.00 0.00 175.10 174.05 1th7 s ARG 33 N -2.73 0.52 0.00 4.82 0.52 -0.54 -0.53 118.95 121.02 1th7 s ARG 33 Ca 0.04 -0.67 0.00 0.00 -0.52 0.00 0.00 55.73 54.59 1th7 s ARG 33 Cb -0.03 -0.33 0.00 0.00 0.52 0.00 0.00 34.95 35.11 1th7 s ARG 33 CO -0.00 0.07 0.00 0.41 0.02 0.00 0.00 175.30 175.79 1th7 n GLY 34 N 1.71 -1.61 3.67 -3.53 0.00 -0.60 -1.02 105.19 103.82 1th7 n GLY 34 Ca -0.21 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1th7 n GLY 34 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1th7 s MET 35 N -1.52 4.29 -0.07 1.61 -1.94 -0.54 -0.93 119.30 120.21 1th7 s MET 35 Ca 0.00 1.08 -0.30 0.00 -1.71 0.00 0.00 55.69 54.77 1th7 s MET 35 Cb 0.00 -3.59 -0.04 0.00 2.01 0.00 0.00 34.83 33.22 1th7 s MET 35 CO 0.00 -0.38 1.33 -1.17 -0.01 0.00 0.00 175.02 174.79 1th7 s LEU 36 N 2.32 4.27 -0.00 -0.03 2.96 -0.46 -0.98 118.68 126.75 1th7 s LEU 36 Ca 0.40 1.91 0.03 0.00 -0.22 0.00 0.00 54.13 56.25 1th7 s LEU 36 Cb -0.16 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1th7 s LEU 36 CO 0.12 -0.72 0.09 0.54 -1.32 0.00 0.00 176.35 175.06 1th7 n ARG 37 N 5.89 2.25 -3.55 1.98 5.12 0.08 0.99 116.66 129.42 1th7 n ARG 37 Ca 0.13 -0.02 -0.15 0.00 -1.93 0.00 0.00 57.85 55.88 1th7 n ARG 37 Cb 0.45 -0.92 -0.06 0.00 -1.16 0.00 0.00 32.46 30.77 1th7 n ARG 37 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1th7 s SER 38 N -1.96 -0.59 0.03 0.55 0.15 -1.16 -4.91 113.70 105.80 1th7 s SER 38 Ca -0.00 0.74 -0.26 0.00 0.70 0.00 0.00 55.95 57.12 1th7 s SER 38 Cb 0.02 0.61 0.06 0.00 -1.71 0.00 0.00 66.02 65.00 1th7 s SER 38 CO 0.13 -0.48 0.60 -0.72 1.20 0.00 0.00 173.24 173.97 1th7 s TYR 39 N -0.92 -0.55 0.30 3.44 -0.85 -1.26 -1.82 117.35 115.69 1th7 s TYR 39 Ca -0.07 0.73 0.05 0.00 -0.52 0.00 0.00 57.07 57.27 1th7 s TYR 39 Cb -0.01 0.41 -0.02 0.00 0.38 0.00 0.00 41.96 42.72 1th7 s TYR 39 CO 0.06 -0.66 0.19 -0.40 -1.52 0.00 0.00 175.55 173.22 1th7 n ASP 40 N 0.49 0.04 0.23 -0.18 5.68 -1.05 -4.96 116.55 116.82 1th7 n ASP 40 Ca -0.18 -2.80 0.16 0.00 -0.50 0.00 0.00 54.79 51.46 1th7 n ASP 40 Cb 0.60 1.19 0.81 0.00 -1.14 0.00 0.00 41.12 42.57 1th7 n ASP 40 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 1th7 h GLN 41 N 0.00 0.00 -0.42 0.11 -0.00 -1.91 -0.07 115.11 112.82 1th7 h GLN 41 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.43 1th7 h GLN 41 Cb 0.99 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.47 1th7 h GLN 41 CO 0.33 0.00 0.00 0.72 -0.00 0.00 0.00 178.83 179.88 1th7 n HIS 42 N -2.60 0.54 -2.44 0.06 8.25 -1.26 -1.01 115.22 116.76 1th7 n HIS 42 Ca -0.02 -0.27 -0.16 0.00 -0.26 0.00 0.00 57.72 57.01 1th7 n HIS 42 Cb 0.08 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.19 1th7 n HIS 42 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1th7 n MET 43 N 1.52 -1.92 -2.53 -0.41 2.81 -0.04 -4.28 117.12 112.27 1th7 n MET 43 Ca 0.20 0.73 -0.42 0.00 -1.81 0.00 0.00 57.70 56.40 1th7 n MET 43 Cb 0.61 -5.09 -0.03 0.00 -0.71 0.00 0.00 33.22 28.00 1th7 n MET 43 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1th7 s ASN 44 N -2.44 7.20 0.29 7.83 0.01 -1.26 -3.60 114.94 122.97 1th7 s ASN 44 Ca 0.06 1.91 0.05 0.00 -0.71 0.00 0.00 52.86 54.17 1th7 s ASN 44 Cb -0.03 -2.58 -0.06 0.00 0.41 0.00 0.00 41.25 38.99 1th7 s ASN 44 CO 0.08 -0.37 -0.01 -0.76 -1.51 0.00 0.00 177.10 174.53 1th7 s LEU 45 N 0.89 2.37 -0.05 0.60 1.43 -0.33 -2.51 118.68 121.06 1th7 s LEU 45 Ca 0.55 -1.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.40 1th7 s LEU 45 Cb -0.27 -0.51 0.02 0.00 0.03 0.00 0.00 46.19 45.46 1th7 s LEU 45 CO 0.29 -0.45 -0.04 -0.69 0.23 0.00 0.00 176.35 175.68 1th7 s VAL 46 N -3.15 0.58 -0.01 -1.59 1.01 -0.75 -0.25 120.40 116.24 1th7 s VAL 46 Ca 0.32 -0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.24 1th7 s VAL 46 Cb 0.06 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 1th7 s VAL 46 CO 0.13 0.25 -0.20 -0.76 0.00 0.00 0.00 175.10 174.51 1th7 s LEU 47 N 1.11 2.06 0.29 3.92 1.43 -0.59 -0.74 118.68 126.16 1th7 s LEU 47 Ca -0.08 -0.39 0.09 0.00 -1.03 0.00 0.00 54.13 52.72 1th7 s LEU 47 Cb -0.14 -1.03 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 1th7 s LEU 47 CO -0.01 0.23 0.05 -0.94 0.23 0.00 0.00 176.35 175.91 1th7 s SER 48 N -0.58 4.58 -1.67 2.29 1.04 -0.15 -1.06 113.70 118.14 1th7 s SER 48 Ca 0.08 -0.70 -0.16 0.00 0.48 0.00 0.00 55.95 55.65 1th7 s SER 48 Cb -0.08 -0.80 0.14 0.00 0.10 0.00 0.00 66.02 65.38 1th7 s SER 48 CO -0.00 -0.11 0.71 0.47 0.98 0.00 0.00 173.24 175.29 1th7 n ASP 49 N -0.98 -2.74 -4.93 7.02 10.43 -1.06 -1.46 116.55 122.82 1th7 n ASP 49 Ca -0.05 -1.03 -0.25 0.00 2.57 0.00 0.00 54.79 56.02 1th7 n ASP 49 Cb 0.60 -2.70 0.04 0.00 1.84 0.00 0.00 41.12 40.90 1th7 n ASP 49 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1th7 s SER 50 N -3.46 5.33 -0.02 -2.24 1.04 -0.02 -4.56 113.70 109.77 1th7 s SER 50 Ca 0.63 0.48 -0.12 0.00 0.48 0.00 0.00 55.95 57.43 1th7 s SER 50 Cb -0.35 -1.38 0.02 0.00 0.10 0.00 0.00 66.02 64.41 1th7 s SER 50 CO 0.93 -1.21 0.24 -1.83 0.98 0.00 0.00 173.24 172.36 1th7 s GLU 51 N -4.99 0.57 -0.23 4.02 -1.05 -0.19 -0.95 118.70 115.88 1th7 s GLU 51 Ca 0.56 -0.22 -0.11 0.00 -0.15 0.00 0.00 54.97 55.05 1th7 s GLU 51 Cb -0.11 0.25 -0.05 0.00 -0.44 0.00 0.00 34.13 33.79 1th7 s GLU 51 CO 0.43 -0.15 0.18 -2.00 0.95 0.00 0.00 175.26 174.67 1th7 s GLU 52 N -1.22 4.09 0.14 -4.83 2.12 0.39 -1.46 118.70 117.92 1th7 s GLU 52 Ca -0.13 -0.22 -0.30 0.00 0.36 0.00 0.00 54.97 54.68 1th7 s GLU 52 Cb -0.06 -3.53 -0.07 0.00 0.26 0.00 0.00 34.13 30.74 1th7 s GLU 52 CO 0.03 0.08 1.05 0.42 -0.54 0.00 0.00 175.26 176.30 1th7 s ILE 53 N 1.01 4.16 0.53 -3.70 -1.09 -0.24 -1.34 121.20 120.53 1th7 s ILE 53 Ca 0.09 1.79 0.02 0.00 -2.23 0.00 0.00 60.65 60.32 1th7 s ILE 53 Cb -0.13 -4.14 0.03 0.00 -1.58 0.00 0.00 42.46 36.63 1th7 s ILE 53 CO 0.04 0.27 0.74 -1.10 -1.23 0.00 0.00 174.94 173.67 1th7 s GLN 54 N -0.05 2.61 0.26 2.79 -1.52 0.13 -4.62 119.66 119.26 1th7 s GLN 54 Ca 0.49 -0.81 -0.02 0.00 -1.95 0.00 0.00 55.36 53.07 1th7 s GLN 54 Cb -0.27 -2.52 0.49 0.00 -0.22 0.00 0.00 33.01 30.49 1th7 s GLN 54 CO 0.32 -0.63 1.77 1.03 -0.25 0.00 0.00 175.29 177.53 1th7 h SER 55 N 0.16 0.55 0.00 5.90 0.87 -1.96 0.92 113.55 119.99 1th7 h SER 55 Ca -0.42 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 1th7 h SER 55 Cb 1.29 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 1th7 h SER 55 CO 0.52 0.26 0.00 -0.90 -0.53 0.00 0.00 176.83 176.18 1th7 n ASP 56 N -4.84 0.13 0.00 6.23 5.68 -1.26 -4.86 116.55 117.63 1th7 n ASP 56 Ca 0.16 -1.90 0.00 0.00 -0.50 0.00 0.00 54.79 52.55 1th7 n ASP 56 Cb 0.39 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.30 1th7 n ASP 56 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1th7 n GLY 57 N 0.39 2.31 3.86 6.12 0.00 0.32 -5.03 105.19 113.16 1th7 n GLY 57 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1th7 n GLY 57 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1th7 s SER 58 N -3.62 5.38 0.03 1.61 1.04 -1.26 -4.65 113.70 112.22 1th7 s SER 58 Ca 0.00 1.22 0.07 0.00 0.48 0.00 0.00 55.95 57.72 1th7 s SER 58 Cb 0.00 -2.05 -0.03 0.00 0.10 0.00 0.00 66.02 64.04 1th7 s SER 58 CO 0.00 -1.40 -0.19 -0.83 0.98 0.00 0.00 173.24 171.80 1th7 s GLY 59 N -4.23 1.53 -0.19 7.32 0.00 -1.26 0.19 107.32 110.69 1th7 s GLY 59 Ca 0.58 -1.17 -0.03 0.00 0.00 0.00 0.00 44.72 44.11 1th7 s GLY 59 CO 0.53 -1.04 -0.08 0.54 0.00 0.00 0.00 173.10 173.05 1th7 s LYS 60 N -1.28 3.38 0.23 2.90 1.02 -0.45 -4.90 119.74 120.64 1th7 s LYS 60 Ca 0.14 -0.64 -0.31 0.00 0.02 0.00 0.00 55.97 55.17 1th7 s LYS 60 Cb -0.10 -2.87 -0.11 0.00 -0.52 0.00 0.00 37.83 34.23 1th7 s LYS 60 CO 0.04 -0.05 1.55 0.15 -0.92 0.00 0.00 175.35 176.12 1th7 s LYS 61 N 1.07 4.20 0.00 1.68 1.02 -1.26 -0.46 119.74 125.98 1th7 s LYS 61 Ca 0.00 2.42 0.00 0.00 0.02 0.00 0.00 55.97 58.42 1th7 s LYS 61 Cb -0.15 -3.10 0.00 0.00 -0.52 0.00 0.00 37.83 34.06 1th7 s LYS 61 CO -0.01 -0.57 0.00 1.28 -0.92 0.00 0.00 175.35 175.13 1th7 n LEU 62 N 3.03 0.00 0.00 3.17 4.32 -0.13 -4.89 117.00 122.50 1th7 n LEU 62 Ca 0.10 -0.36 0.00 0.00 -0.02 0.00 0.00 56.01 55.74 1th7 n LEU 62 Cb 0.38 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.18 1th7 n LEU 62 CO 0.62 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.40 1th7 n GLY 63 N 1.38 2.13 3.76 -0.72 0.00 -1.10 -4.64 105.19 106.01 1th7 n GLY 63 Ca 0.00 -0.37 -0.38 0.00 0.00 0.00 0.00 46.02 45.26 1th7 n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1th7 s THR 64 N 0.00 5.03 0.02 2.61 2.01 -1.26 -0.84 115.64 123.20 1th7 s THR 64 Ca 0.00 1.07 0.01 0.00 0.31 0.00 0.00 61.69 63.08 1th7 s THR 64 Cb 0.00 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.64 1th7 s THR 64 CO 0.00 0.41 -0.04 0.27 -0.69 0.00 0.00 174.62 174.58 1th7 s ILE 65 N -0.05 0.23 -0.23 1.82 -4.36 -0.23 -5.00 121.20 113.38 1th7 s ILE 65 Ca 0.28 -0.60 -0.05 0.00 -0.26 0.00 0.00 60.65 60.02 1th7 s ILE 65 Cb -0.17 -0.29 -0.01 0.00 1.25 0.00 0.00 42.46 43.24 1th7 s ILE 65 CO 0.14 -0.24 -0.01 -0.69 0.24 0.00 0.00 174.94 174.38 1th7 s VAL 66 N -0.85 3.65 -0.19 8.37 1.01 -1.26 -1.55 120.40 129.59 1th7 s VAL 66 Ca -0.08 -0.40 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 1th7 s VAL 66 Cb -0.06 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1th7 s VAL 66 CO -0.00 0.39 0.05 -0.63 0.00 0.00 0.00 175.10 174.91 1th7 s ILE 67 N 1.52 4.65 -0.12 2.22 1.01 0.66 -4.97 121.20 126.17 1th7 s ILE 67 Ca 0.06 -0.08 -0.30 0.00 0.00 0.00 0.00 60.65 60.33 1th7 s ILE 67 Cb -0.14 -3.10 -0.01 0.00 0.01 0.00 0.00 42.46 39.21 1th7 s ILE 67 CO -0.01 0.45 1.09 -0.60 0.00 0.00 0.00 174.94 175.87 1th7 s ARG 68 N 0.49 4.36 0.52 2.79 3.52 -1.26 -1.19 118.95 128.17 1th7 s ARG 68 Ca 0.02 1.48 0.29 0.00 -0.13 0.00 0.00 55.73 57.40 1th7 s ARG 68 Cb -0.13 -3.58 1.42 0.00 -1.56 0.00 0.00 34.95 31.10 1th7 s ARG 68 CO 0.01 -0.44 1.88 0.78 -0.81 0.00 0.00 175.30 176.72 1th7 h GLY 69 N 8.47 0.14 1.90 8.12 0.00 -1.74 -1.90 103.07 118.06 1th7 h GLY 69 Ca -0.29 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1th7 h GLY 69 CO 0.89 -0.01 0.05 -1.80 0.00 0.00 0.00 176.54 175.67 1th7 h ASP 70 N 0.06 0.00 0.27 0.19 1.82 -1.87 -1.00 116.42 115.89 1th7 h ASP 70 Ca 0.43 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.07 1th7 h ASP 70 Cb 1.62 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.63 1th7 h ASP 70 CO -0.03 0.00 -0.38 0.59 -1.61 0.00 0.00 179.24 177.81 1th7 n ASN 71 N -3.30 0.97 -4.71 2.28 3.02 -0.71 -4.92 115.26 107.90 1th7 n ASN 71 Ca -0.03 -0.78 -0.42 0.00 -0.03 0.00 0.00 54.58 53.32 1th7 n ASN 71 Cb 0.12 0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.50 1th7 n ASN 71 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1th7 s VAL 72 N -2.65 4.88 -0.21 2.41 1.01 -0.38 -0.95 120.40 124.51 1th7 s VAL 72 Ca 0.20 1.99 -0.16 0.00 0.00 0.00 0.00 61.98 64.01 1th7 s VAL 72 Cb 0.19 -4.29 -0.11 0.00 0.00 0.00 0.00 36.38 32.16 1th7 s VAL 72 CO 0.59 0.16 -0.16 -0.38 0.00 0.00 0.00 175.10 175.31 1th7 n ILE 73 N 3.95 1.50 -3.53 2.22 2.08 0.74 -4.90 119.36 121.42 1th7 n ILE 73 Ca 0.05 -0.06 -0.12 0.00 0.56 0.00 0.00 62.75 63.18 1th7 n ILE 73 Cb 0.51 -2.12 -0.04 0.00 -0.75 0.00 0.00 39.64 37.24 1th7 n ILE 73 CO 0.00 0.00 0.00 -1.48 0.56 0.00 0.00 176.55 175.63 1th7 s LEU 74 N -7.83 -0.14 -0.04 1.39 0.05 -1.17 -5.00 118.68 105.95 1th7 s LEU 74 Ca -0.29 -0.04 0.05 0.00 0.05 0.00 0.00 54.13 53.89 1th7 s LEU 74 Cb 0.08 2.24 -0.01 0.00 -2.05 0.00 0.00 46.19 46.45 1th7 s LEU 74 CO 0.46 -0.86 -0.18 -0.63 -0.55 0.00 0.00 176.35 174.58 1th7 s ILE 75 N -3.39 1.49 -0.03 1.48 1.01 -1.26 -0.99 121.20 119.51 1th7 s ILE 75 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.89 1th7 s ILE 75 Cb 0.00 -1.27 0.03 0.00 0.01 0.00 0.00 42.46 41.23 1th7 s ILE 75 CO -0.09 0.43 0.00 -0.55 0.00 0.00 0.00 174.94 174.72 1th7 s SER 76 N -0.07 0.58 0.25 3.58 0.15 -0.46 -4.99 113.70 112.74 1th7 s SER 76 Ca -0.02 -0.03 -0.30 0.00 0.70 0.00 0.00 55.95 56.31 1th7 s SER 76 Cb -0.11 -0.24 -0.10 0.00 -1.71 0.00 0.00 66.02 63.86 1th7 s SER 76 CO 0.02 -0.12 1.35 -2.84 1.20 0.00 0.00 173.24 172.85 1th7 s PRO 77 N 1.16 4.35 0.00 5.44 0.02 -1.26 -0.99 135.00 143.71 1th7 s PRO 77 Ca -0.08 2.17 0.07 0.00 0.02 0.00 0.00 61.00 63.18 1th7 s PRO 77 Cb -0.13 -3.13 0.06 0.00 0.02 0.00 0.00 34.50 31.31 1th7 s PRO 77 CO -0.02 -0.28 0.73 1.28 -0.33 0.00 0.00 177.00 178.38