#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h64 s ARG 4 N 0.00 2.57 0.25 3.44 0.52 -1.26 -4.74 118.95 119.72 1h64 s ARG 4 Ca 0.00 1.62 -0.06 0.00 -0.52 0.00 0.00 55.73 56.77 1h64 s ARG 4 Cb 0.00 -1.90 0.47 0.00 0.52 0.00 0.00 34.95 34.04 1h64 s ARG 4 CO 0.00 -1.47 1.65 -1.35 0.02 0.00 0.00 175.30 174.15 1h64 h PRO 5 N 0.07 0.16 -0.69 3.54 0.11 -2.05 0.13 132.00 133.27 1h64 h PRO 5 Ca -0.48 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1h64 h PRO 5 Cb 1.27 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 1h64 h PRO 5 CO 0.52 0.10 0.16 -0.07 -0.21 0.00 0.00 178.00 178.51 1h64 h LEU 6 N 0.16 1.04 0.02 2.35 3.38 -2.00 -2.34 115.31 117.92 1h64 h LEU 6 Ca 0.42 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 58.19 1h64 h LEU 6 Cb 0.76 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1h64 h LEU 6 CO -0.61 1.00 -0.09 0.44 0.09 0.00 0.00 178.44 179.27 1h64 h ASP 7 N 1.04 -0.26 -0.99 -0.43 3.45 -1.14 -0.33 116.42 117.76 1h64 h ASP 7 Ca 0.22 0.04 0.03 0.00 0.43 0.00 0.00 57.03 57.74 1h64 h ASP 7 Cb 0.37 0.11 -0.06 0.00 -0.56 0.00 0.00 39.33 39.19 1h64 h ASP 7 CO 0.00 -0.13 0.65 0.58 -1.57 0.00 0.00 179.24 178.77 1h64 h VAL 8 N -0.17 1.20 -0.13 -1.35 2.07 -1.06 -0.60 116.25 116.21 1h64 h VAL 8 Ca 0.03 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 1h64 h VAL 8 Cb 0.20 -0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1h64 h VAL 8 CO -0.08 0.23 -0.02 0.40 0.02 0.00 0.00 177.57 178.12 1h64 h ILE 9 N 1.28 1.28 -0.97 4.57 1.08 -1.11 -2.45 117.51 121.19 1h64 h ILE 9 Ca 0.39 -0.92 0.05 0.00 -0.39 0.00 0.00 64.86 63.99 1h64 h ILE 9 Cb -0.04 1.63 -0.06 0.00 -3.07 0.00 0.00 36.82 35.27 1h64 h ILE 9 CO -0.11 0.27 0.62 -0.74 -0.69 0.00 0.00 178.15 177.50 1h64 h HIS 10 N -0.05 1.16 0.00 1.37 2.76 -0.77 -0.97 115.15 118.65 1h64 h HIS 10 Ca 0.03 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1h64 h HIS 10 Cb 0.42 -0.38 0.00 0.00 1.55 0.00 0.00 27.41 29.00 1h64 h HIS 10 CO 0.05 0.63 0.00 -0.09 -1.30 0.00 0.00 177.93 177.21 1h64 h ARG 11 N 1.16 0.00 -0.17 5.26 2.43 -0.91 -2.51 114.38 119.64 1h64 h ARG 11 Ca 0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.57 1h64 h ARG 11 Cb 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1h64 h ARG 11 CO -0.15 0.00 0.00 0.43 -1.51 0.00 0.00 179.97 178.74 1h64 n SER 12 N -2.77 2.49 -4.69 -3.80 7.64 -0.38 -4.94 113.62 107.17 1h64 n SER 12 Ca -0.00 -1.83 -0.44 0.00 1.01 0.00 0.00 58.87 57.62 1h64 n SER 12 Cb 0.20 -0.10 -0.02 0.00 -1.01 0.00 0.00 64.21 63.28 1h64 n SER 12 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1h64 n LEU 13 N 0.90 3.43 -0.99 -3.43 4.77 -0.95 -1.34 117.00 119.39 1h64 n LEU 13 Ca 0.17 1.16 -0.13 0.00 -0.03 0.00 0.00 56.01 57.18 1h64 n LEU 13 Cb 0.48 -1.47 -0.06 0.00 -2.33 0.00 0.00 43.42 40.05 1h64 n LEU 13 CO 0.15 -0.39 -0.12 -0.67 -1.33 0.00 0.00 177.39 175.02 1h64 n ASP 14 N 1.73 -4.63 -4.42 -1.43 -0.08 0.38 -4.97 116.55 103.13 1h64 n ASP 14 Ca 0.09 0.32 -0.21 0.00 -1.51 0.00 0.00 54.79 53.48 1h64 n ASP 14 Cb 0.34 -3.27 -0.10 0.00 2.34 0.00 0.00 41.12 40.42 1h64 n ASP 14 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1h64 s LYS 15 N -3.07 1.52 0.25 -0.67 1.02 -0.45 -4.88 119.74 113.46 1h64 s LYS 15 Ca 0.00 -1.75 -0.30 0.00 0.02 0.00 0.00 55.97 53.94 1h64 s LYS 15 Cb 0.00 -1.19 -0.09 0.00 -0.52 0.00 0.00 37.83 36.03 1h64 s LYS 15 CO 0.00 0.08 1.02 0.34 -0.92 0.00 0.00 175.35 175.87 1h64 s ASP 16 N -3.43 7.45 0.05 2.83 -1.08 -1.26 -0.80 116.67 120.44 1h64 s ASP 16 Ca 0.28 2.10 -0.03 0.00 -0.52 0.00 0.00 52.55 54.38 1h64 s ASP 16 Cb 0.02 -2.62 -0.02 0.00 -1.46 0.00 0.00 42.92 38.84 1h64 s ASP 16 CO 0.11 -0.00 0.04 0.68 0.52 0.00 0.00 175.17 176.52 1h64 s VAL 17 N -1.10 0.18 -0.17 1.11 -7.23 -0.02 -0.91 120.40 112.26 1h64 s VAL 17 Ca 0.43 -1.45 -0.02 0.00 -1.81 0.00 0.00 61.98 59.13 1h64 s VAL 17 Cb -0.29 -1.24 -0.02 0.00 0.56 0.00 0.00 36.38 35.40 1h64 s VAL 17 CO 0.36 -0.80 -0.08 -0.22 -0.31 0.00 0.00 175.10 174.05 1h64 s LEU 18 N -2.61 2.90 -0.40 1.32 2.96 0.08 -2.18 118.68 120.77 1h64 s LEU 18 Ca 0.02 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 1h64 s LEU 18 Cb 0.04 -1.70 0.09 0.00 0.50 0.00 0.00 46.19 45.12 1h64 s LEU 18 CO -0.08 0.10 0.20 -0.69 -1.32 0.00 0.00 176.35 174.55 1h64 s VAL 19 N 0.77 3.69 -0.19 1.68 1.01 0.17 -1.01 120.40 126.53 1h64 s VAL 19 Ca -0.03 -1.64 -0.22 0.00 0.00 0.00 0.00 61.98 60.09 1h64 s VAL 19 Cb -0.15 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 1h64 s VAL 19 CO 0.02 -0.51 0.69 -0.63 0.00 0.00 0.00 175.10 174.66 1h64 s ILE 20 N 1.29 4.98 0.27 2.22 1.01 0.63 -1.16 121.20 130.44 1h64 s ILE 20 Ca 0.04 1.32 -0.04 0.00 0.00 0.00 0.00 60.65 61.97 1h64 s ILE 20 Cb -0.22 -4.00 -0.05 0.00 0.01 0.00 0.00 42.46 38.19 1h64 s ILE 20 CO -0.01 0.08 0.51 -0.76 0.00 0.00 0.00 174.94 174.77 1h64 s LEU 21 N 1.99 4.10 0.00 2.97 2.01 -0.32 -0.04 118.68 129.40 1h64 s LEU 21 Ca 0.31 0.63 0.00 0.00 0.01 0.00 0.00 54.13 55.08 1h64 s LEU 21 Cb -0.16 -3.43 0.00 0.00 0.01 0.00 0.00 46.19 42.61 1h64 s LEU 21 CO 0.11 -0.16 0.07 0.29 1.01 0.00 0.00 176.35 177.67 1h64 n LYS 22 N -0.90 0.00 0.00 1.70 5.02 -1.23 -4.19 118.16 118.56 1h64 n LYS 22 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1h64 n LYS 22 Cb 0.54 -1.06 0.00 0.00 -0.02 0.00 0.00 35.03 34.49 1h64 n LYS 22 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1h64 n LYS 23 N 1.75 0.00 -2.77 1.97 -0.00 -1.26 -4.99 118.16 112.86 1h64 n LYS 23 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 58.31 58.13 1h64 n LYS 23 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.00 1h64 n LYS 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1h64 n GLY 24 N 0.00 -0.20 2.86 2.58 0.00 -1.26 -4.83 105.19 104.34 1h64 n GLY 24 Ca 0.00 0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 1h64 n GLY 24 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1h64 s PHE 25 N -1.93 0.75 0.25 1.61 5.36 -1.26 -3.77 117.98 118.98 1h64 s PHE 25 Ca 0.35 -0.21 -0.12 0.00 -0.96 0.00 0.00 56.93 55.98 1h64 s PHE 25 Cb -0.20 -0.71 -0.00 0.00 -0.34 0.00 0.00 43.02 41.76 1h64 s PHE 25 CO 0.43 -0.23 0.47 -1.83 -1.46 0.00 0.00 175.22 172.60 1h64 s GLU 26 N 1.20 1.56 0.06 10.12 -1.05 -0.32 -1.17 118.70 129.09 1h64 s GLU 26 Ca -0.07 -1.28 0.09 0.00 -0.15 0.00 0.00 54.97 53.56 1h64 s GLU 26 Cb -0.14 0.47 -0.03 0.00 -0.44 0.00 0.00 34.13 33.99 1h64 s GLU 26 CO -0.02 -0.65 -0.25 -0.06 0.95 0.00 0.00 175.26 175.24 1h64 s PHE 27 N -3.98 2.15 -0.00 4.83 0.40 -0.31 0.64 117.98 121.71 1h64 s PHE 27 Ca 0.23 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 1h64 s PHE 27 Cb -0.01 -1.27 -0.00 0.00 0.51 0.00 0.00 43.02 42.25 1h64 s PHE 27 CO 0.09 0.15 -0.04 0.50 0.70 0.00 0.00 175.22 176.62 1h64 s ARG 28 N -1.36 0.33 0.00 0.44 3.52 -0.52 0.46 118.95 121.82 1h64 s ARG 28 Ca 0.11 -0.15 0.00 0.00 -0.13 0.00 0.00 55.73 55.56 1h64 s ARG 28 Cb -0.10 -0.32 0.00 0.00 -1.56 0.00 0.00 34.95 32.97 1h64 s ARG 28 CO 0.03 0.09 0.00 0.41 -0.81 0.00 0.00 175.30 175.01 1h64 n GLY 29 N 2.98 -1.71 3.68 8.12 0.00 -0.93 -0.99 105.19 116.34 1h64 n GLY 29 Ca -0.13 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 1h64 n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1h64 s ARG 30 N -1.77 4.34 -0.22 1.61 3.52 -0.80 -0.84 118.95 124.79 1h64 s ARG 30 Ca 0.00 1.17 -0.29 0.00 -0.13 0.00 0.00 55.73 56.48 1h64 s ARG 30 Cb 0.00 -3.57 -0.01 0.00 -1.56 0.00 0.00 34.95 29.82 1h64 s ARG 30 CO 0.00 -0.34 1.24 -1.17 -0.81 0.00 0.00 175.30 174.22 1h64 s LEU 31 N 2.15 4.07 0.00 -0.88 2.96 0.02 -0.80 118.68 126.21 1h64 s LEU 31 Ca 0.42 1.48 0.03 0.00 -0.22 0.00 0.00 54.13 55.85 1h64 s LEU 31 Cb -0.17 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 42.99 1h64 s LEU 31 CO 0.14 -0.85 0.47 2.30 -1.32 0.00 0.00 176.35 177.09 1h64 n ILE 32 N 5.63 0.00 -3.61 6.68 -5.35 -0.57 0.14 119.36 122.28 1h64 n ILE 32 Ca 0.14 -0.48 -0.01 0.00 -0.27 0.00 0.00 62.75 62.13 1h64 n ILE 32 Cb 0.46 1.05 -0.01 0.00 -1.74 0.00 0.00 39.64 39.40 1h64 n ILE 32 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1h64 s GLY 33 N -0.61 -0.35 0.07 3.28 0.00 -1.20 -4.92 107.32 103.59 1h64 s GLY 33 Ca 0.03 1.23 -0.27 0.00 0.00 0.00 0.00 44.72 45.71 1h64 s GLY 33 CO 0.07 0.35 1.05 -2.52 0.00 0.00 0.00 173.10 172.05 1h64 s TYR 34 N -2.31 -0.13 0.35 1.90 -0.85 -1.26 -1.44 117.35 113.61 1h64 s TYR 34 Ca 0.12 -0.09 0.04 0.00 -0.52 0.00 0.00 57.07 56.62 1h64 s TYR 34 Cb 0.02 0.60 -0.03 0.00 0.38 0.00 0.00 41.96 42.93 1h64 s TYR 34 CO -0.04 -0.61 0.14 0.16 -1.52 0.00 0.00 175.55 173.67 1h64 s ASP 35 N -2.86 2.15 0.64 -0.18 1.47 -0.81 -5.00 116.67 112.08 1h64 s ASP 35 Ca 0.12 -1.59 0.39 0.00 1.18 0.00 0.00 52.55 52.65 1h64 s ASP 35 Cb 0.00 0.38 2.19 0.00 -0.34 0.00 0.00 42.92 45.16 1h64 s ASP 35 CO -0.01 -0.88 2.32 -0.29 0.68 0.00 0.00 175.17 176.99 1h64 h ILE 36 N 2.03 0.19 -0.00 2.11 6.09 -2.03 -1.14 117.51 124.76 1h64 h ILE 36 Ca -0.35 -0.03 0.00 0.00 -1.37 0.00 0.00 64.86 63.12 1h64 h ILE 36 Cb 1.26 1.02 0.00 0.00 0.47 0.00 0.00 36.82 39.57 1h64 h ILE 36 CO 0.55 0.00 -0.01 1.41 -3.07 0.00 0.00 178.15 177.04 1h64 n HIS 37 N -3.35 0.00 -1.60 2.19 8.25 -1.26 -4.88 115.22 114.58 1h64 n HIS 37 Ca -0.03 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.36 1h64 n HIS 37 Cb 0.08 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.12 1h64 n HIS 37 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1h64 n LEU 38 N -0.91 -0.87 -4.75 2.41 4.32 -0.43 -4.45 117.00 112.32 1h64 n LEU 38 Ca 0.21 0.11 -0.40 0.00 -0.02 0.00 0.00 56.01 55.91 1h64 n LEU 38 Cb 0.17 -1.37 -0.06 0.00 -1.62 0.00 0.00 43.42 40.54 1h64 n LEU 38 CO 0.19 -0.27 0.69 0.20 -1.22 0.00 0.00 177.39 176.98 1h64 s ASN 39 N -2.81 7.53 0.21 -1.43 0.01 -1.26 -3.29 114.94 113.89 1h64 s ASN 39 Ca 0.00 2.04 0.05 0.00 -0.71 0.00 0.00 52.86 54.24 1h64 s ASN 39 Cb 0.00 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 39.00 1h64 s ASN 39 CO 0.00 0.06 -0.06 0.68 -1.51 0.00 0.00 177.10 176.27 1h64 s VAL 40 N -1.19 1.27 -0.12 1.60 -7.23 -0.39 -1.92 120.40 112.42 1h64 s VAL 40 Ca 0.42 -2.08 0.02 0.00 -1.81 0.00 0.00 61.98 58.53 1h64 s VAL 40 Cb -0.27 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.52 1h64 s VAL 40 CO 0.34 -0.49 -0.17 -0.69 -0.31 0.00 0.00 175.10 173.78 1h64 s VAL 41 N -3.27 1.63 0.05 1.32 1.01 -0.52 -0.68 120.40 119.93 1h64 s VAL 41 Ca 0.24 -0.72 0.07 0.00 0.00 0.00 0.00 61.98 61.58 1h64 s VAL 41 Cb 0.03 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 1h64 s VAL 41 CO 0.06 0.47 -0.19 -0.76 0.00 0.00 0.00 175.10 174.68 1h64 s LEU 42 N 0.97 2.56 0.06 3.92 1.43 0.02 -1.51 118.68 126.13 1h64 s LEU 42 Ca -0.06 -0.46 0.05 0.00 -1.03 0.00 0.00 54.13 52.63 1h64 s LEU 42 Cb -0.15 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 1h64 s LEU 42 CO -0.02 0.25 -0.07 0.00 0.23 0.00 0.00 176.35 176.74 1h64 s ALA 43 N -0.93 3.05 -1.25 4.21 0.00 0.02 -1.01 121.76 125.85 1h64 s ALA 43 Ca 0.14 -1.12 -0.17 0.00 0.00 0.00 0.00 51.96 50.81 1h64 s ALA 43 Cb -0.10 -1.06 0.01 0.00 0.00 0.00 0.00 23.12 21.97 1h64 s ALA 43 CO 0.05 0.64 0.62 -0.25 0.00 0.00 0.00 175.76 176.82 1h64 n ASP 44 N 1.04 -3.32 -4.98 0.00 10.43 0.10 -1.91 116.55 117.91 1h64 n ASP 44 Ca -0.14 -1.10 -0.20 0.00 2.57 0.00 0.00 54.79 55.93 1h64 n ASP 44 Cb 0.52 -2.80 0.01 0.00 1.84 0.00 0.00 41.12 40.70 1h64 n ASP 44 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1h64 s ALA 45 N -3.67 4.08 -0.06 2.24 0.00 0.29 -4.50 121.76 120.13 1h64 s ALA 45 Ca 0.32 -1.36 -0.08 0.00 0.00 0.00 0.00 51.96 50.85 1h64 s ALA 45 Cb -0.14 -1.90 0.02 0.00 0.00 0.00 0.00 23.12 21.10 1h64 s ALA 45 CO 0.90 -0.36 0.20 -1.83 0.00 0.00 0.00 175.76 174.68 1h64 s GLU 46 N -4.46 0.30 -0.07 0.00 -1.05 -0.16 -0.54 118.70 112.71 1h64 s GLU 46 Ca 0.51 0.18 -0.18 0.00 -0.15 0.00 0.00 54.97 55.32 1h64 s GLU 46 Cb -0.10 0.14 -0.05 0.00 -0.44 0.00 0.00 34.13 33.68 1h64 s GLU 46 CO 0.35 -0.05 0.49 1.41 0.95 0.00 0.00 175.26 178.42 1h64 s MET 47 N -0.16 4.27 -0.09 -4.83 -2.45 0.40 -1.44 119.30 115.00 1h64 s MET 47 Ca -0.03 0.51 0.04 0.00 -1.25 0.00 0.00 55.69 54.96 1h64 s MET 47 Cb -0.02 -3.38 0.00 0.00 1.25 0.00 0.00 34.83 32.68 1h64 s MET 47 CO 0.01 0.29 -0.21 0.42 1.05 0.00 0.00 175.02 176.58 1h64 s ILE 48 N 0.16 1.83 -0.08 10.11 1.01 0.21 -0.72 121.20 133.71 1h64 s ILE 48 Ca 0.27 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 60.03 1h64 s ILE 48 Cb -0.16 -1.59 0.02 0.00 0.01 0.00 0.00 42.46 40.74 1h64 s ILE 48 CO 0.12 0.51 -0.08 -1.58 0.00 0.00 0.00 174.94 173.91 1h64 s GLN 49 N 0.36 1.34 -1.50 2.79 0.74 -0.29 -1.17 119.66 121.93 1h64 s GLN 49 Ca -0.16 -0.24 0.00 0.00 0.05 0.00 0.00 55.36 55.01 1h64 s GLN 49 Cb -0.17 -1.29 0.00 0.00 1.10 0.00 0.00 33.01 32.65 1h64 s GLN 49 CO 0.07 -0.12 0.00 -3.47 -0.55 0.00 0.00 175.29 171.22 1h64 n ASP 50 N 4.35 -4.81 0.00 6.67 2.03 -1.25 -1.42 116.55 122.13 1h64 n ASP 50 Ca -0.19 0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.29 1h64 n ASP 50 Cb 0.51 -3.83 0.00 0.00 -0.72 0.00 0.00 41.12 37.08 1h64 n ASP 50 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1h64 n GLY 51 N -1.02 0.55 3.52 0.27 0.00 -1.26 -5.00 105.19 102.24 1h64 n GLY 51 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 1h64 n GLY 51 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h64 s GLU 52 N -0.39 3.41 -0.13 1.61 2.12 -0.50 -5.07 118.70 119.74 1h64 s GLU 52 Ca 0.00 -0.53 -0.29 0.00 0.36 0.00 0.00 54.97 54.51 1h64 s GLU 52 Cb 0.00 -2.82 -0.04 0.00 0.26 0.00 0.00 34.13 31.53 1h64 s GLU 52 CO 0.00 0.37 1.60 0.08 -0.54 0.00 0.00 175.26 176.77 1h64 s VAL 53 N 0.01 3.70 -0.54 3.70 1.01 -1.26 -1.14 120.40 125.88 1h64 s VAL 53 Ca 0.00 0.83 0.15 0.00 0.00 0.00 0.00 61.98 62.96 1h64 s VAL 53 Cb -0.13 -3.61 -0.18 0.00 0.00 0.00 0.00 36.38 32.46 1h64 s VAL 53 CO 0.03 -0.15 0.56 1.33 0.00 0.00 0.00 175.10 176.87 1h64 n VAL 54 N 5.83 0.00 -3.53 2.92 0.24 0.10 -4.97 118.33 118.93 1h64 n VAL 54 Ca 0.18 -0.20 -0.12 0.00 -2.04 0.00 0.00 64.34 62.16 1h64 n VAL 54 Cb 0.44 0.80 -0.04 0.00 -1.47 0.00 0.00 33.84 33.56 1h64 n VAL 54 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1h64 s LYS 55 N -2.57 0.85 0.11 7.34 2.47 -1.21 -4.98 119.74 121.76 1h64 s LYS 55 Ca 0.03 0.02 0.07 0.00 -1.56 0.00 0.00 55.97 54.53 1h64 s LYS 55 Cb 0.11 0.40 -0.04 0.00 -1.46 0.00 0.00 37.83 36.84 1h64 s LYS 55 CO 0.62 -0.30 -0.17 1.03 0.16 0.00 0.00 175.35 176.69 1h64 s ARG 56 N -1.83 1.06 -0.01 4.03 0.52 -1.26 -0.45 118.95 121.01 1h64 s ARG 56 Ca -0.03 -1.18 -0.02 0.00 -0.52 0.00 0.00 55.73 53.98 1h64 s ARG 56 Cb -0.00 -1.13 0.00 0.00 0.52 0.00 0.00 34.95 34.34 1h64 s ARG 56 CO 0.00 0.24 0.05 0.71 0.02 0.00 0.00 175.30 176.32 1h64 s TYR 57 N -1.60 -0.01 0.16 -0.53 1.51 0.30 -4.96 117.35 112.22 1h64 s TYR 57 Ca 0.07 0.03 -0.09 0.00 -1.01 0.00 0.00 57.07 56.08 1h64 s TYR 57 Cb -0.08 -0.01 0.02 0.00 -0.11 0.00 0.00 41.96 41.78 1h64 s TYR 57 CO 0.04 -0.07 1.50 0.78 -1.11 0.00 0.00 175.55 176.70 1h64 h GLY 58 N 5.76 0.94 -5.33 0.71 0.00 -1.93 0.84 103.07 104.06 1h64 h GLY 58 Ca -0.26 -0.95 -0.13 0.00 0.00 0.00 0.00 47.33 45.99 1h64 h GLY 58 CO 0.46 0.86 -0.29 1.25 0.00 0.00 0.00 176.54 178.82 1h64 s LYS 59 N -4.37 0.42 -0.12 4.80 2.20 -1.26 0.02 119.74 121.43 1h64 s LYS 59 Ca -0.10 0.53 -0.09 0.00 -0.36 0.00 0.00 55.97 55.95 1h64 s LYS 59 Cb 0.11 0.18 0.04 0.00 -1.51 0.00 0.00 37.83 36.65 1h64 s LYS 59 CO 0.87 -0.06 0.31 -1.50 -0.36 0.00 0.00 175.35 174.60 1h64 s ILE 60 N 0.33 -0.01 -0.27 5.43 2.07 -0.18 -4.99 121.20 123.58 1h64 s ILE 60 Ca -0.01 0.04 -0.10 0.00 -1.41 0.00 0.00 60.65 59.17 1h64 s ILE 60 Cb -0.03 -0.44 -0.04 0.00 0.13 0.00 0.00 42.46 42.08 1h64 s ILE 60 CO -0.01 0.02 0.15 -0.69 -1.91 0.00 0.00 174.94 172.50 1h64 s VAL 61 N 0.54 4.94 -0.15 4.00 1.01 -1.26 -0.79 120.40 128.68 1h64 s VAL 61 Ca -0.03 0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 1h64 s VAL 61 Cb -0.05 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 1h64 s VAL 61 CO -0.03 0.26 -0.06 -0.63 0.00 0.00 0.00 175.10 174.64 1h64 s ILE 62 N 1.70 3.68 -0.11 2.22 1.01 0.14 -4.97 121.20 124.86 1h64 s ILE 62 Ca 0.07 -0.43 -0.30 0.00 0.00 0.00 0.00 60.65 59.99 1h64 s ILE 62 Cb -0.16 -2.60 -0.02 0.00 0.01 0.00 0.00 42.46 39.70 1h64 s ILE 62 CO 0.08 0.50 1.12 -0.13 0.00 0.00 0.00 174.94 176.51 1h64 s ARG 63 N 0.38 4.35 0.55 2.79 0.52 -1.26 -1.27 118.95 125.01 1h64 s ARG 63 Ca -0.06 1.53 0.26 0.00 -0.52 0.00 0.00 55.73 56.94 1h64 s ARG 63 Cb -0.15 -3.59 1.47 0.00 0.52 0.00 0.00 34.95 33.20 1h64 s ARG 63 CO 0.04 -0.46 2.03 0.78 0.02 0.00 0.00 175.30 177.71 1h64 h GLY 64 N 8.52 0.00 1.41 -3.53 0.00 -1.77 -2.65 103.07 105.06 1h64 h GLY 64 Ca -0.30 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.09 1h64 h GLY 64 CO 0.90 0.00 0.24 -1.80 0.00 0.00 0.00 176.54 175.88 1h64 h ASP 65 N 0.00 0.00 -0.50 0.19 3.58 -1.87 -0.25 116.42 117.56 1h64 h ASP 65 Ca 0.17 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.62 1h64 h ASP 65 Cb 0.76 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.81 1h64 h ASP 65 CO -0.00 0.00 0.00 0.59 -2.88 0.00 0.00 179.24 176.95 1h64 n ASN 66 N -3.74 3.47 -4.76 2.28 3.02 -1.00 -4.97 115.26 109.56 1h64 n ASN 66 Ca 0.02 -1.97 -0.38 0.00 -0.03 0.00 0.00 54.58 52.22 1h64 n ASN 66 Cb 0.36 -0.33 -0.06 0.00 -0.61 0.00 0.00 39.78 39.14 1h64 n ASN 66 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1h64 s VAL 67 N -1.15 5.01 -0.19 2.41 1.01 -0.11 -3.57 120.40 123.81 1h64 s VAL 67 Ca 0.38 1.11 -0.23 0.00 0.00 0.00 0.00 61.98 63.23 1h64 s VAL 67 Cb 0.21 -3.87 -0.21 0.00 0.00 0.00 0.00 36.38 32.51 1h64 s VAL 67 CO 0.28 0.41 0.37 0.25 0.00 0.00 0.00 175.10 176.41 1h64 h LEU 68 N 5.84 0.00 -7.40 3.92 5.85 -0.75 -3.47 115.31 119.31 1h64 h LEU 68 Ca -0.45 -0.64 -0.00 0.00 0.84 0.00 0.00 57.88 57.63 1h64 h LEU 68 Cb 1.20 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 42.13 1h64 h LEU 68 CO 0.70 1.33 0.16 0.00 -0.34 0.00 0.00 178.44 180.29 1h64 s ALA 69 N -2.33 -1.34 -0.05 1.25 0.00 -1.05 -5.03 121.76 113.22 1h64 s ALA 69 Ca -0.25 0.13 0.01 0.00 0.00 0.00 0.00 51.96 51.84 1h64 s ALA 69 Cb 0.03 0.86 0.02 0.00 0.00 0.00 0.00 23.12 24.04 1h64 s ALA 69 CO 0.61 -0.83 -0.04 0.42 0.00 0.00 0.00 175.76 175.92 1h64 s ILE 70 N -3.82 0.53 -0.12 0.00 1.01 -1.26 -0.27 121.20 117.27 1h64 s ILE 70 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.60 1h64 s ILE 70 Cb -0.02 -0.57 0.02 0.00 0.01 0.00 0.00 42.46 41.91 1h64 s ILE 70 CO -0.06 0.23 -0.10 -0.55 0.00 0.00 0.00 174.94 174.46 1h64 s SER 71 N 1.04 2.32 0.27 3.58 0.15 -0.18 -4.96 113.70 115.92 1h64 s SER 71 Ca -0.09 -0.36 -0.29 0.00 0.70 0.00 0.00 55.95 55.90 1h64 s SER 71 Cb -0.14 -0.96 -0.10 0.00 -1.71 0.00 0.00 66.02 63.12 1h64 s SER 71 CO -0.01 -0.08 1.33 -2.16 1.20 0.00 0.00 173.24 173.52 1h64 s PRO 72 N 1.53 4.36 0.00 5.44 0.04 -1.26 -0.74 135.00 144.36 1h64 s PRO 72 Ca 0.03 2.17 0.26 0.00 0.04 0.00 0.00 61.00 63.50 1h64 s PRO 72 Cb -0.13 -3.12 1.55 0.00 0.04 0.00 0.00 34.50 32.83 1h64 s PRO 72 CO -0.08 -0.25 1.90 2.41 0.04 0.00 0.00 177.00 181.03