#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 2.72 0.19 3.49 0.52 -1.26 -4.83 118.95 119.78 1h64 s ARG 4 Ca 0.00 1.29 -0.19 0.00 -0.52 0.00 0.00 55.73 56.31 1h64 s ARG 4 Cb 0.00 -1.95 0.15 0.00 0.52 0.00 0.00 34.95 33.67 1h64 s ARG 4 CO 0.00 -1.30 1.59 -1.35 0.02 0.00 0.00 175.30 174.26 1h64 h PRO 5 N -0.27 -0.13 -0.44 3.54 0.11 -2.05 -1.30 132.00 131.46 1h64 h PRO 5 Ca -0.46 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 1h64 h PRO 5 Cb 1.24 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 1h64 h PRO 5 CO 0.54 -0.09 0.14 -0.07 -0.21 0.00 0.00 178.00 178.32 1h64 h LEU 6 N -0.14 0.58 -0.41 2.35 -0.00 -1.99 -2.27 115.31 113.43 1h64 h LEU 6 Ca 0.25 -0.07 -0.01 0.00 -0.00 0.00 0.00 57.88 58.04 1h64 h LEU 6 Cb 0.54 -0.15 -0.02 0.00 -0.00 0.00 0.00 40.66 41.03 1h64 h LEU 6 CO -0.67 0.55 0.20 0.44 -0.00 0.00 0.00 178.44 178.97 1h64 h ASP 7 N 0.63 0.53 -0.80 -0.43 3.32 -1.62 0.07 116.42 118.12 1h64 h ASP 7 Ca 0.15 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1h64 h ASP 7 Cb 0.18 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 1h64 h ASP 7 CO -0.01 0.51 0.45 0.58 -1.72 0.00 0.00 179.24 179.05 1h64 h VAL 8 N 0.52 1.24 0.16 -1.35 2.07 -1.11 -2.25 116.25 115.54 1h64 h VAL 8 Ca 0.14 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1h64 h VAL 8 Cb 0.11 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1h64 h VAL 8 CO -0.02 0.26 -0.08 0.40 0.02 0.00 0.00 177.57 178.16 1h64 h ILE 9 N 1.13 0.97 -0.92 4.57 1.08 -1.01 -2.99 117.51 120.33 1h64 h ILE 9 Ca 0.29 -0.75 0.20 0.00 -0.39 0.00 0.00 64.86 64.20 1h64 h ILE 9 Cb 0.02 1.41 -0.11 0.00 -3.07 0.00 0.00 36.82 35.07 1h64 h ILE 9 CO -0.05 0.17 0.49 -0.74 -0.69 0.00 0.00 178.15 177.33 1h64 h HIS 10 N -0.60 0.84 0.00 1.37 2.76 -0.85 0.13 115.15 118.80 1h64 h HIS 10 Ca -0.02 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1h64 h HIS 10 Cb 0.45 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.18 1h64 h HIS 10 CO 0.04 0.10 0.00 0.00 -1.30 0.00 0.00 177.93 176.77 1h64 h ARG 11 N 0.58 0.00 -0.01 5.26 3.08 -1.37 -2.64 114.38 119.28 1h64 h ARG 11 Ca 0.55 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.60 1h64 h ARG 11 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1h64 h ARG 11 CO -0.44 0.00 -0.06 0.43 -1.07 0.00 0.00 179.97 178.83 1h64 n SER 12 N -2.44 1.10 -4.61 7.04 7.64 0.46 -4.89 113.62 117.92 1h64 n SER 12 Ca 0.02 -1.21 -0.44 0.00 1.01 0.00 0.00 58.87 58.26 1h64 n SER 12 Cb 0.27 0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.47 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 -0.27 2.09 0.00 -3.43 4.77 -1.00 -0.13 117.00 119.04 1h64 n LEU 13 Ca 0.18 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 57.33 1h64 n LEU 13 Cb 0.31 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.08 1h64 n LEU 13 CO 0.19 -1.29 0.00 0.47 -1.33 0.00 0.00 177.39 175.44 1h64 n ASP 14 N 1.10 -1.46 -4.70 -1.43 10.43 0.26 -4.97 116.55 115.79 1h64 n ASP 14 Ca 0.09 0.00 -0.23 0.00 2.57 0.00 0.00 54.79 57.21 1h64 n ASP 14 Cb 0.33 -1.93 -0.07 0.00 1.84 0.00 0.00 41.12 41.29 1h64 n ASP 14 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1h64 s LYS 15 N -0.87 2.29 0.11 -1.24 1.02 0.82 -4.80 119.74 117.06 1h64 s LYS 15 Ca 0.00 -1.59 -0.30 0.00 0.02 0.00 0.00 55.97 54.10 1h64 s LYS 15 Cb 0.00 -2.11 -0.06 0.00 -0.52 0.00 0.00 37.83 35.14 1h64 s LYS 15 CO 0.00 0.14 1.19 0.34 -0.92 0.00 0.00 175.35 176.10 1h64 s ASP 16 N -3.80 7.10 0.10 2.83 -1.08 -1.26 -1.27 116.67 119.30 1h64 s ASP 16 Ca 0.36 2.08 0.01 0.00 -0.52 0.00 0.00 52.55 54.48 1h64 s ASP 16 Cb -0.02 -2.59 -0.04 0.00 -1.46 0.00 0.00 42.92 38.81 1h64 s ASP 16 CO 0.22 -0.42 -0.04 0.68 0.52 0.00 0.00 175.17 176.13 1h64 s VAL 17 N 0.64 0.53 -0.18 1.11 -7.23 -0.44 -1.70 120.40 113.13 1h64 s VAL 17 Ca 0.56 -1.91 -0.01 0.00 -1.81 0.00 0.00 61.98 58.81 1h64 s VAL 17 Cb -0.30 -1.75 -0.00 0.00 0.56 0.00 0.00 36.38 34.89 1h64 s VAL 17 CO 0.32 -0.80 -0.12 -0.22 -0.31 0.00 0.00 175.10 173.97 1h64 s LEU 18 N -3.04 2.61 -0.34 1.32 2.96 0.37 -2.68 118.68 119.89 1h64 s LEU 18 Ca 0.14 -0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 53.55 1h64 s LEU 18 Cb 0.06 -1.62 0.05 0.00 0.50 0.00 0.00 46.19 45.18 1h64 s LEU 18 CO -0.04 0.05 0.11 -0.69 -1.32 0.00 0.00 176.35 174.46 1h64 s VAL 19 N 1.04 3.63 -0.19 1.68 1.01 0.55 -0.54 120.40 127.57 1h64 s VAL 19 Ca -0.01 -1.28 -0.19 0.00 0.00 0.00 0.00 61.98 60.50 1h64 s VAL 19 Cb -0.15 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1h64 s VAL 19 CO -0.02 -0.24 0.55 -0.63 0.00 0.00 0.00 175.10 174.76 1h64 s ILE 20 N 1.35 5.09 0.16 2.22 1.01 0.10 -0.64 121.20 130.49 1h64 s ILE 20 Ca -0.01 1.03 -0.00 0.00 0.00 0.00 0.00 60.65 61.66 1h64 s ILE 20 Cb -0.20 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 1h64 s ILE 20 CO 0.01 0.18 0.34 -0.76 0.00 0.00 0.00 174.94 174.71 1h64 s LEU 21 N 1.59 4.28 -0.16 2.97 1.43 -0.54 0.10 118.68 128.35 1h64 s LEU 21 Ca 0.26 0.34 -0.01 0.00 -1.03 0.00 0.00 54.13 53.68 1h64 s LEU 21 Cb -0.16 -3.08 0.05 0.00 0.03 0.00 0.00 46.19 43.03 1h64 s LEU 21 CO 0.10 0.02 2.29 2.29 0.23 0.00 0.00 176.35 181.28 1h64 n LYS 22 N -0.43 1.54 0.00 1.70 2.85 -1.01 -3.39 118.16 119.42 1h64 n LYS 22 Ca -0.05 -0.90 0.00 0.00 -1.05 0.00 0.00 58.31 56.31 1h64 n LYS 22 Cb 0.53 -1.45 0.00 0.00 -0.65 0.00 0.00 35.03 33.46 1h64 n LYS 22 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1h64 n LYS 23 N 1.16 2.19 0.00 -1.58 4.76 -1.26 -5.01 118.16 118.42 1h64 n LYS 23 Ca 0.21 -0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 1h64 n LYS 23 Cb 0.59 -0.55 0.00 0.00 -1.84 0.00 0.00 35.03 33.22 1h64 n LYS 23 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1h64 n GLY 24 N 0.35 0.48 2.38 0.72 0.00 -1.22 -5.07 105.19 102.83 1h64 n GLY 24 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 1h64 n GLY 24 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1h64 n PHE 25 N -1.52 0.06 -4.01 1.61 -1.74 -1.26 -4.47 117.46 106.12 1h64 n PHE 25 Ca 0.00 -1.87 -0.10 0.00 -0.56 0.00 0.00 57.45 54.92 1h64 n PHE 25 Cb 0.00 0.01 -0.07 0.00 1.52 0.00 0.00 39.48 40.94 1h64 n PHE 25 CO 0.00 0.00 0.00 -1.83 -0.56 0.00 0.00 176.76 174.37 1h64 s GLU 26 N -3.10 1.37 0.05 3.97 -1.05 -0.38 -1.46 118.70 118.10 1h64 s GLU 26 Ca 0.16 -1.28 0.08 0.00 -0.15 0.00 0.00 54.97 53.78 1h64 s GLU 26 Cb 0.01 0.41 -0.03 0.00 -0.44 0.00 0.00 34.13 34.08 1h64 s GLU 26 CO 0.11 -0.53 -0.24 -0.06 0.95 0.00 0.00 175.26 175.49 1h64 s PHE 27 N -4.02 2.09 -0.02 4.83 0.40 0.18 -0.13 117.98 121.32 1h64 s PHE 27 Ca 0.23 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 1h64 s PHE 27 Cb 0.02 -1.24 0.01 0.00 0.51 0.00 0.00 43.02 42.32 1h64 s PHE 27 CO 0.07 0.12 -0.03 0.50 0.70 0.00 0.00 175.22 176.58 1h64 s ARG 28 N -1.27 0.38 0.00 0.44 3.52 -0.40 -0.33 118.95 121.29 1h64 s ARG 28 Ca 0.10 -0.06 0.00 0.00 -0.13 0.00 0.00 55.73 55.64 1h64 s ARG 28 Cb -0.09 -0.44 0.00 0.00 -1.56 0.00 0.00 34.95 32.86 1h64 s ARG 28 CO 0.02 -0.01 0.00 0.41 -0.81 0.00 0.00 175.30 174.91 1h64 n GLY 29 N 3.52 -1.27 3.69 8.12 0.00 -1.09 0.26 105.19 118.41 1h64 n GLY 29 Ca -0.19 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.40 4.24 -0.39 1.61 3.52 -0.48 -1.32 118.95 125.73 1h64 s ARG 30 Ca 0.00 0.35 -0.29 0.00 -0.13 0.00 0.00 55.73 55.66 1h64 s ARG 30 Cb 0.00 -3.50 0.01 0.00 -1.56 0.00 0.00 34.95 29.90 1h64 s ARG 30 CO 0.00 0.01 1.29 -1.17 -0.81 0.00 0.00 175.30 174.62 1h64 s LEU 31 N 1.13 3.71 0.00 -0.88 2.96 -0.39 0.13 118.68 125.34 1h64 s LEU 31 Ca 0.23 0.88 0.09 0.00 -0.22 0.00 0.00 54.13 55.10 1h64 s LEU 31 Cb -0.15 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.09 1h64 s LEU 31 CO 0.09 -1.25 0.84 2.30 -1.32 0.00 0.00 176.35 177.01 1h64 n ILE 32 N 6.68 0.15 -3.58 6.68 -5.35 -0.55 0.91 119.36 124.29 1h64 n ILE 32 Ca 0.15 -0.57 0.02 0.00 -0.27 0.00 0.00 62.75 62.07 1h64 n ILE 32 Cb 0.48 1.08 -0.01 0.00 -1.74 0.00 0.00 39.64 39.45 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 -0.78 -0.41 0.04 3.28 0.00 -1.23 -4.92 107.32 103.32 1h64 s GLY 33 Ca 0.12 1.27 -0.28 0.00 0.00 0.00 0.00 44.72 45.82 1h64 s GLY 33 CO 0.11 0.32 1.18 -2.52 0.00 0.00 0.00 173.10 172.20 1h64 s TYR 34 N -2.03 -0.06 0.28 1.90 -0.85 -1.26 -1.38 117.35 113.95 1h64 s TYR 34 Ca 0.14 -0.12 0.03 0.00 -0.52 0.00 0.00 57.07 56.60 1h64 s TYR 34 Cb 0.05 0.58 -0.04 0.00 0.38 0.00 0.00 41.96 42.94 1h64 s TYR 34 CO -0.05 -0.47 0.18 0.16 -1.52 0.00 0.00 175.55 173.85 1h64 s ASP 35 N -3.05 1.15 0.43 -0.18 1.47 -0.75 -4.98 116.67 110.76 1h64 s ASP 35 Ca 0.15 -1.56 0.29 0.00 1.18 0.00 0.00 52.55 52.61 1h64 s ASP 35 Cb 0.02 0.43 1.53 0.00 -0.34 0.00 0.00 42.92 44.57 1h64 s ASP 35 CO -0.01 -0.92 1.88 0.16 0.68 0.00 0.00 175.17 176.96 1h64 h ILE 36 N 2.32 0.00 -0.01 2.11 3.07 -2.03 -0.29 117.51 122.67 1h64 h ILE 36 Ca -0.32 -0.04 0.00 0.00 1.55 0.00 0.00 64.86 66.05 1h64 h ILE 36 Cb 1.24 0.71 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 1h64 h ILE 36 CO 0.48 0.00 -0.02 1.41 -1.05 0.00 0.00 178.15 178.96 1h64 n HIS 37 N -2.53 0.00 -1.59 0.16 8.25 -1.26 -4.90 115.22 113.36 1h64 n HIS 37 Ca -0.02 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.38 1h64 n HIS 37 Cb 0.07 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.14 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 -0.28 -0.83 -4.78 2.41 4.32 -0.12 -4.50 117.00 113.24 1h64 n LEU 38 Ca 0.19 0.09 -0.37 0.00 -0.02 0.00 0.00 56.01 55.90 1h64 n LEU 38 Cb 0.28 -1.26 -0.04 0.00 -1.62 0.00 0.00 43.42 40.79 1h64 n LEU 38 CO 0.18 -0.23 0.74 0.20 -1.22 0.00 0.00 177.39 177.06 1h64 s ASN 39 N -2.83 6.95 0.08 -1.43 0.01 -1.26 -3.51 114.94 112.95 1h64 s ASN 39 Ca 0.00 2.07 0.01 0.00 -0.71 0.00 0.00 52.86 54.23 1h64 s ASN 39 Cb 0.00 -2.59 -0.04 0.00 0.41 0.00 0.00 41.25 39.03 1h64 s ASN 39 CO 0.00 -0.36 -0.06 0.68 -1.51 0.00 0.00 177.10 175.85 1h64 s VAL 40 N -1.53 0.58 -0.08 1.60 -7.23 -0.38 -1.81 120.40 111.55 1h64 s VAL 40 Ca 0.54 -1.69 0.04 0.00 -1.81 0.00 0.00 61.98 59.05 1h64 s VAL 40 Cb -0.24 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.31 1h64 s VAL 40 CO 0.30 -0.77 -0.21 -0.69 -0.31 0.00 0.00 175.10 173.42 1h64 s VAL 41 N -3.09 2.35 0.04 1.32 1.01 -0.48 -0.19 120.40 121.36 1h64 s VAL 41 Ca 0.05 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.15 1h64 s VAL 41 Cb 0.02 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 1h64 s VAL 41 CO -0.04 0.56 -0.18 -0.76 0.00 0.00 0.00 175.10 174.68 1h64 s LEU 42 N -0.01 2.17 0.09 3.92 1.43 0.07 -1.49 118.68 124.86 1h64 s LEU 42 Ca -0.07 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 52.61 1h64 s LEU 42 Cb -0.15 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.19 1h64 s LEU 42 CO 0.05 0.12 -0.16 0.00 0.23 0.00 0.00 176.35 176.59 1h64 s ALA 43 N -0.82 2.74 -1.29 4.21 0.00 0.12 -0.95 121.76 125.77 1h64 s ALA 43 Ca 0.05 -1.27 -0.07 0.00 0.00 0.00 0.00 51.96 50.67 1h64 s ALA 43 Cb -0.08 -0.75 -0.00 0.00 0.00 0.00 0.00 23.12 22.28 1h64 s ALA 43 CO 0.02 0.60 0.61 -0.25 0.00 0.00 0.00 175.76 176.74 1h64 n ASP 44 N 0.99 -2.17 -4.87 0.00 8.00 0.67 -1.38 116.55 117.79 1h64 n ASP 44 Ca -0.15 -0.96 -0.31 0.00 0.71 0.00 0.00 54.79 54.08 1h64 n ASP 44 Cb 0.52 -3.43 -0.05 0.00 -0.02 0.00 0.00 41.12 38.15 1h64 n ASP 44 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h64 s ALA 45 N -3.73 3.44 -0.10 2.24 0.00 0.11 -4.47 121.76 119.26 1h64 s ALA 45 Ca 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1h64 s ALA 45 Cb -0.05 -2.59 0.02 0.00 0.00 0.00 0.00 23.12 20.50 1h64 s ALA 45 CO 0.86 0.27 -0.09 -1.21 0.00 0.00 0.00 175.76 175.59 1h64 s GLU 46 N -3.27 1.62 -0.21 0.00 2.02 0.14 0.32 118.70 119.32 1h64 s GLU 46 Ca 0.50 -0.32 -0.23 0.00 0.02 0.00 0.00 54.97 54.94 1h64 s GLU 46 Cb -0.11 -1.55 -0.01 0.00 0.10 0.00 0.00 34.13 32.56 1h64 s GLU 46 CO 0.24 -0.17 0.74 1.41 0.02 0.00 0.00 175.26 177.51 1h64 s MET 47 N 1.35 4.21 -0.11 1.61 -2.45 0.73 -1.27 119.30 123.37 1h64 s MET 47 Ca -0.01 0.81 -0.01 0.00 -1.25 0.00 0.00 55.69 55.22 1h64 s MET 47 Cb -0.14 -3.61 -0.03 0.00 1.25 0.00 0.00 34.83 32.31 1h64 s MET 47 CO -0.04 -0.38 -0.06 0.42 1.05 0.00 0.00 175.02 176.00 1h64 s ILE 48 N 2.37 3.71 -0.08 10.11 1.01 0.82 -0.52 121.20 138.62 1h64 s ILE 48 Ca 0.33 -0.45 -0.02 0.00 0.00 0.00 0.00 60.65 60.51 1h64 s ILE 48 Cb -0.16 -2.57 0.03 0.00 0.01 0.00 0.00 42.46 39.78 1h64 s ILE 48 CO 0.10 0.55 0.02 -1.10 0.00 0.00 0.00 174.94 174.50 1h64 s GLN 49 N -0.21 0.45 -1.45 2.79 -0.21 -0.07 -1.25 119.66 119.71 1h64 s GLN 49 Ca 0.03 0.11 -0.08 0.00 0.02 0.00 0.00 55.36 55.44 1h64 s GLN 49 Cb -0.13 -1.02 0.02 0.00 1.00 0.00 0.00 33.01 32.88 1h64 s GLN 49 CO 0.03 -0.35 0.93 -0.25 -2.12 0.00 0.00 175.29 173.52 1h64 n ASP 50 N 5.18 -6.04 0.00 5.90 8.00 -1.26 -2.01 116.55 126.31 1h64 n ASP 50 Ca -0.06 -0.47 0.00 0.00 0.71 0.00 0.00 54.79 54.97 1h64 n ASP 50 Cb 0.50 -4.81 0.00 0.00 -0.02 0.00 0.00 41.12 36.79 1h64 n ASP 50 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h64 n GLY 51 N -1.77 1.95 3.55 0.44 0.00 -1.26 -5.03 105.19 103.07 1h64 n GLY 51 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1h64 n GLY 51 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h64 s GLU 52 N -0.15 2.59 -0.24 1.61 2.02 -0.85 -5.07 118.70 118.60 1h64 s GLU 52 Ca 0.00 -0.66 -0.29 0.00 0.02 0.00 0.00 54.97 54.04 1h64 s GLU 52 Cb 0.00 -2.48 -0.01 0.00 0.10 0.00 0.00 34.13 31.74 1h64 s GLU 52 CO 0.00 0.63 1.34 0.08 0.02 0.00 0.00 175.26 177.32 1h64 s VAL 53 N -0.84 4.12 -0.42 2.63 1.01 -1.26 -0.89 120.40 124.74 1h64 s VAL 53 Ca 0.14 1.30 0.14 0.00 0.00 0.00 0.00 61.98 63.55 1h64 s VAL 53 Cb -0.11 -4.03 -0.17 0.00 0.00 0.00 0.00 36.38 32.07 1h64 s VAL 53 CO 0.03 -0.32 0.48 1.33 0.00 0.00 0.00 175.10 176.61 1h64 n VAL 54 N 5.92 0.00 -3.60 2.92 0.24 0.32 -4.98 118.33 119.15 1h64 n VAL 54 Ca 0.15 -0.23 -0.15 0.00 -2.04 0.00 0.00 64.34 62.07 1h64 n VAL 54 Cb 0.46 0.71 -0.06 0.00 -1.47 0.00 0.00 33.84 33.47 1h64 n VAL 54 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1h64 s LYS 55 N -2.52 0.96 0.02 7.34 1.02 -1.18 -4.99 119.74 120.39 1h64 s LYS 55 Ca 0.01 -0.11 0.03 0.00 0.02 0.00 0.00 55.97 55.93 1h64 s LYS 55 Cb 0.10 0.44 -0.01 0.00 -0.52 0.00 0.00 37.83 37.83 1h64 s LYS 55 CO 0.56 -0.32 -0.11 1.03 -0.92 0.00 0.00 175.35 175.60 1h64 s ARG 56 N -1.92 0.77 -0.01 1.68 0.52 -1.26 -0.19 118.95 118.54 1h64 s ARG 56 Ca -0.08 -0.53 0.03 0.00 -0.52 0.00 0.00 55.73 54.63 1h64 s ARG 56 Cb -0.01 -0.73 -0.01 0.00 0.52 0.00 0.00 34.95 34.73 1h64 s ARG 56 CO 0.02 0.19 -0.09 0.71 0.02 0.00 0.00 175.30 176.15 1h64 s TYR 57 N -0.59 0.83 0.05 -0.53 1.51 0.15 -4.99 117.35 113.79 1h64 s TYR 57 Ca 0.01 -0.16 -0.20 0.00 -1.01 0.00 0.00 57.07 55.71 1h64 s TYR 57 Cb -0.06 -0.54 -0.13 0.00 -0.11 0.00 0.00 41.96 41.12 1h64 s TYR 57 CO 0.00 -0.02 1.39 0.78 -1.11 0.00 0.00 175.55 176.59 1h64 h GLY 58 N 5.96 0.40 -5.44 0.71 0.00 -1.93 0.30 103.07 103.08 1h64 h GLY 58 Ca -0.31 -0.38 -0.17 0.00 0.00 0.00 0.00 47.33 46.47 1h64 h GLY 58 CO 0.49 0.34 -0.44 1.25 0.00 0.00 0.00 176.54 178.19 1h64 s LYS 59 N -4.48 0.28 -0.12 4.80 2.20 -1.26 -0.24 119.74 120.91 1h64 s LYS 59 Ca -0.14 0.36 -0.09 0.00 -0.36 0.00 0.00 55.97 55.74 1h64 s LYS 59 Cb 0.06 0.11 0.04 0.00 -1.51 0.00 0.00 37.83 36.53 1h64 s LYS 59 CO 0.75 -0.05 0.31 -1.50 -0.36 0.00 0.00 175.35 174.50 1h64 s ILE 60 N 0.26 -0.02 -0.26 5.43 2.07 -0.13 -4.99 121.20 123.56 1h64 s ILE 60 Ca -0.01 0.06 -0.09 0.00 -1.41 0.00 0.00 60.65 59.20 1h64 s ILE 60 Cb -0.03 -0.45 -0.04 0.00 0.13 0.00 0.00 42.46 42.07 1h64 s ILE 60 CO -0.01 0.02 0.12 -0.69 -1.91 0.00 0.00 174.94 172.48 1h64 s VAL 61 N 0.72 4.72 -0.19 4.00 1.01 -1.26 -0.75 120.40 128.64 1h64 s VAL 61 Ca -0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.84 1h64 s VAL 61 Cb -0.06 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 1h64 s VAL 61 CO -0.05 0.30 0.00 -0.63 0.00 0.00 0.00 175.10 174.72 1h64 s ILE 62 N 1.67 4.07 0.04 2.22 1.01 0.73 -4.97 121.20 125.98 1h64 s ILE 62 Ca 0.07 -0.28 -0.30 0.00 0.00 0.00 0.00 60.65 60.13 1h64 s ILE 62 Cb -0.16 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.43 1h64 s ILE 62 CO 0.07 0.44 1.17 -0.13 0.00 0.00 0.00 174.94 176.49 1h64 s ARG 63 N 0.80 4.44 0.55 2.79 0.52 -1.26 -1.25 118.95 125.53 1h64 s ARG 63 Ca 0.01 1.71 0.22 0.00 -0.52 0.00 0.00 55.73 57.14 1h64 s ARG 63 Cb -0.14 -3.39 1.49 0.00 0.52 0.00 0.00 34.95 33.43 1h64 s ARG 63 CO 0.02 -0.26 2.19 0.78 0.02 0.00 0.00 175.30 178.05 1h64 h GLY 64 N 7.00 0.00 1.71 -3.53 0.00 -1.78 -2.70 103.07 103.77 1h64 h GLY 64 Ca -0.40 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.94 1h64 h GLY 64 CO 0.81 0.00 0.13 -1.80 0.00 0.00 0.00 176.54 175.68 1h64 h ASP 65 N 0.00 0.00 -0.39 0.19 3.58 -1.88 -0.68 116.42 117.24 1h64 h ASP 65 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1h64 h ASP 65 Cb 0.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.07 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 -3.42 3.36 -4.75 2.28 3.02 -1.02 -4.95 115.26 109.79 1h64 n ASN 66 Ca -0.01 -1.98 -0.38 0.00 -0.03 0.00 0.00 54.58 52.18 1h64 n ASN 66 Cb 0.21 -0.25 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 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 -1.49 5.09 -0.14 2.41 1.01 -0.26 -2.41 120.40 124.60 1h64 s VAL 67 Ca 0.39 1.02 -0.14 0.00 0.00 0.00 0.00 61.98 63.25 1h64 s VAL 67 Cb 0.23 -3.84 -0.25 0.00 0.00 0.00 0.00 36.38 32.52 1h64 s VAL 67 CO 0.31 0.38 0.39 0.25 0.00 0.00 0.00 175.10 176.44 1h64 h LEU 68 N 6.16 0.30 -7.30 3.92 5.85 -0.62 -3.45 115.31 120.17 1h64 h LEU 68 Ca -0.44 -0.81 0.06 0.00 0.84 0.00 0.00 57.88 57.54 1h64 h LEU 68 Cb 1.19 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 42.02 1h64 h LEU 68 CO 0.72 1.69 0.32 0.00 -0.34 0.00 0.00 178.44 180.83 1h64 s ALA 69 N -2.48 -1.58 -0.07 1.25 0.00 -1.05 -5.02 121.76 112.81 1h64 s ALA 69 Ca -0.23 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.13 1h64 s ALA 69 Cb 0.06 0.74 0.02 0.00 0.00 0.00 0.00 23.12 23.93 1h64 s ALA 69 CO 0.72 -0.84 -0.08 0.42 0.00 0.00 0.00 175.76 175.98 1h64 s ILE 70 N -3.57 0.86 -0.13 0.00 1.01 -1.26 -0.73 121.20 117.38 1h64 s ILE 70 Ca 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.44 1h64 s ILE 70 Cb -0.02 -0.85 0.02 0.00 0.01 0.00 0.00 42.46 41.62 1h64 s ILE 70 CO -0.06 0.31 -0.12 -0.55 0.00 0.00 0.00 174.94 174.52 1h64 s SER 71 N 1.12 2.43 -0.15 3.58 0.15 0.29 -4.96 113.70 116.17 1h64 s SER 71 Ca -0.07 -0.40 -0.29 0.00 0.70 0.00 0.00 55.95 55.89 1h64 s SER 71 Cb -0.14 -1.03 -0.03 0.00 -1.71 0.00 0.00 66.02 63.11 1h64 s SER 71 CO -0.01 -0.07 1.46 -2.16 1.20 0.00 0.00 173.24 173.66 1h64 s PRO 72 N 1.46 4.12 0.00 5.44 0.04 -1.26 -0.48 135.00 144.32 1h64 s PRO 72 Ca 0.03 1.82 0.11 0.00 0.04 0.00 0.00 61.00 62.99 1h64 s PRO 72 Cb -0.13 -3.89 0.67 0.00 0.04 0.00 0.00 34.50 31.19 1h64 s PRO 72 CO -0.08 -0.88 1.11 0.25 0.04 0.00 0.00 177.00 177.44