#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 1.91 0.24 3.49 1.70 -1.26 -4.77 118.95 120.27 1h64 s ARG 4 Ca 0.00 0.65 -0.14 0.00 -0.47 0.00 0.00 55.73 55.76 1h64 s ARG 4 Cb 0.00 -1.90 0.31 0.00 -0.57 0.00 0.00 34.95 32.79 1h64 s ARG 4 CO 0.00 -1.74 1.56 -1.35 -1.08 0.00 0.00 175.30 172.69 1h64 h PRO 5 N -1.18 -0.02 -0.14 3.89 0.11 -2.05 -1.13 132.00 131.49 1h64 h PRO 5 Ca -0.48 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 1h64 h PRO 5 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1h64 h PRO 5 CO 0.59 -0.01 -0.28 -0.07 -0.21 0.00 0.00 178.00 178.02 1h64 h LEU 6 N -0.02 0.25 -0.38 2.35 3.38 -1.99 -2.39 115.31 116.51 1h64 h LEU 6 Ca 0.38 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 1h64 h LEU 6 Cb 0.63 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1h64 h LEU 6 CO -0.96 0.53 0.16 0.44 0.09 0.00 0.00 178.44 178.71 1h64 h ASP 7 N 0.23 0.51 -0.58 -0.43 3.32 -1.56 0.53 116.42 118.43 1h64 h ASP 7 Ca 0.03 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1h64 h ASP 7 Cb 0.62 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 1h64 h ASP 7 CO 0.04 0.52 0.37 0.58 -1.72 0.00 0.00 179.24 179.03 1h64 h VAL 8 N 0.47 1.16 -0.36 -1.35 2.07 -1.28 -0.94 116.25 116.01 1h64 h VAL 8 Ca 0.13 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 1h64 h VAL 8 Cb 0.16 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1h64 h VAL 8 CO -0.01 0.16 0.09 0.40 0.02 0.00 0.00 177.57 178.22 1h64 h ILE 9 N 0.79 1.23 -0.37 4.57 1.08 -1.23 -2.61 117.51 120.96 1h64 h ILE 9 Ca 0.21 -0.77 0.04 0.00 -0.39 0.00 0.00 64.86 63.96 1h64 h ILE 9 Cb -0.06 1.03 -0.04 0.00 -3.07 0.00 0.00 36.82 34.68 1h64 h ILE 9 CO -0.04 0.26 0.13 -0.74 -0.69 0.00 0.00 178.15 177.06 1h64 h HIS 10 N 0.44 0.22 0.00 1.37 2.76 -0.52 -1.03 115.15 118.40 1h64 h HIS 10 Ca 0.11 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.30 1h64 h HIS 10 Cb 0.31 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.22 1h64 h HIS 10 CO 0.02 0.09 0.00 0.00 -1.30 0.00 0.00 177.93 176.74 1h64 h ARG 11 N 0.28 0.00 -0.06 5.26 3.08 -1.03 -1.79 114.38 120.12 1h64 h ARG 11 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1h64 h ARG 11 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1h64 h ARG 11 CO -0.18 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.15 1h64 n SER 12 N -2.90 1.39 -4.64 7.04 7.64 -0.40 -4.90 113.62 116.86 1h64 n SER 12 Ca -0.01 -1.52 -0.45 0.00 1.01 0.00 0.00 58.87 57.90 1h64 n SER 12 Cb 0.14 -0.03 -0.02 0.00 -1.01 0.00 0.00 64.21 63.29 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 0.10 2.54 -1.75 -3.43 4.77 -0.67 -0.63 117.00 117.93 1h64 n LEU 13 Ca 0.18 1.16 -0.21 0.00 -0.03 0.00 0.00 56.01 57.12 1h64 n LEU 13 Cb 0.32 -1.36 -0.08 0.00 -2.33 0.00 0.00 43.42 39.98 1h64 n LEU 13 CO 0.15 -0.88 -0.21 0.47 -1.33 0.00 0.00 177.39 175.60 1h64 n ASP 14 N 1.65 -5.59 -4.53 -1.43 10.43 0.35 -4.98 116.55 112.44 1h64 n ASP 14 Ca 0.11 0.42 -0.24 0.00 2.57 0.00 0.00 54.79 57.65 1h64 n ASP 14 Cb 0.31 -4.88 -0.09 0.00 1.84 0.00 0.00 41.12 38.30 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 -4.00 1.87 0.20 -1.24 1.02 0.19 -4.87 119.74 112.92 1h64 s LYS 15 Ca 0.00 -1.68 -0.30 0.00 0.02 0.00 0.00 55.97 54.01 1h64 s LYS 15 Cb 0.00 -1.88 -0.08 0.00 -0.52 0.00 0.00 37.83 35.35 1h64 s LYS 15 CO 0.00 0.32 1.06 -0.51 -0.92 0.00 0.00 175.35 175.31 1h64 s ASP 16 N -3.57 7.34 0.05 2.83 -0.00 -1.26 -0.94 116.67 121.12 1h64 s ASP 16 Ca 0.31 2.09 0.01 0.00 -0.00 0.00 0.00 52.55 54.95 1h64 s ASP 16 Cb -0.05 -2.61 -0.03 0.00 -0.00 0.00 0.00 42.92 40.23 1h64 s ASP 16 CO 0.17 -0.13 -0.05 -0.69 -0.00 0.00 0.00 175.17 174.46 1h64 s VAL 17 N -0.57 0.37 -0.20 -1.27 1.01 0.71 -0.32 120.40 120.13 1h64 s VAL 17 Ca 0.47 -1.44 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 1h64 s VAL 17 Cb -0.29 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.04 1h64 s VAL 17 CO 0.35 -0.70 -0.00 -0.22 0.00 0.00 0.00 175.10 174.53 1h64 s LEU 18 N -2.27 3.27 -0.26 3.92 2.96 -0.36 -2.01 118.68 123.93 1h64 s LEU 18 Ca -0.02 -0.19 -0.03 0.00 -0.22 0.00 0.00 54.13 53.68 1h64 s LEU 18 Cb -0.01 -1.83 0.03 0.00 0.50 0.00 0.00 46.19 44.88 1h64 s LEU 18 CO -0.04 0.08 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.35 1h64 s VAL 19 N 0.92 3.09 -0.15 1.68 1.01 0.74 -1.18 120.40 126.49 1h64 s VAL 19 Ca 0.01 -1.00 -0.18 0.00 0.00 0.00 0.00 61.98 60.81 1h64 s VAL 19 Cb -0.14 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1h64 s VAL 19 CO 0.02 0.14 0.49 -0.63 0.00 0.00 0.00 175.10 175.12 1h64 s ILE 20 N 1.35 5.16 0.52 2.22 1.01 0.40 -0.98 121.20 130.88 1h64 s ILE 20 Ca 0.00 0.94 0.07 0.00 0.00 0.00 0.00 60.65 61.67 1h64 s ILE 20 Cb -0.17 -3.82 0.04 0.00 0.01 0.00 0.00 42.46 38.52 1h64 s ILE 20 CO -0.03 0.26 0.54 -0.76 0.00 0.00 0.00 174.94 174.96 1h64 s LEU 21 N 1.06 3.03 0.00 2.97 1.43 -0.42 -0.43 118.68 126.31 1h64 s LEU 21 Ca 0.25 -0.97 0.28 0.00 -1.03 0.00 0.00 54.13 52.66 1h64 s LEU 21 Cb -0.15 -1.59 1.42 0.00 0.03 0.00 0.00 46.19 45.89 1h64 s LEU 21 CO 0.10 -1.08 1.96 0.29 0.23 0.00 0.00 176.35 177.85 1h64 n LYS 22 N -1.89 0.42 -1.08 1.70 5.02 -1.25 -4.19 118.16 116.88 1h64 n LYS 22 Ca 0.06 0.02 -0.02 0.00 -2.02 0.00 0.00 58.31 56.35 1h64 n LYS 22 Cb 0.63 -1.50 0.14 0.00 -0.02 0.00 0.00 35.03 34.28 1h64 n LYS 22 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1h64 n LYS 23 N -1.27 2.00 -0.92 1.97 5.02 -1.26 -4.86 118.16 118.84 1h64 n LYS 23 Ca 0.14 -3.44 0.00 0.00 -2.02 0.00 0.00 58.31 52.98 1h64 n LYS 23 Cb 0.22 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 1h64 n LYS 23 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h64 n GLY 24 N -0.89 0.54 3.93 0.72 0.00 -1.26 -4.89 105.19 103.34 1h64 n GLY 24 Ca 0.24 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 1h64 n GLY 24 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h64 s PHE 25 N -2.00 3.43 0.17 1.61 0.40 -1.26 -1.44 117.98 118.88 1h64 s PHE 25 Ca 0.00 0.07 -0.22 0.00 -0.60 0.00 0.00 56.93 56.18 1h64 s PHE 25 Cb 0.00 -1.62 0.06 0.00 0.51 0.00 0.00 43.02 41.97 1h64 s PHE 25 CO 0.00 0.50 0.59 -1.83 0.70 0.00 0.00 175.22 175.19 1h64 s GLU 26 N -3.37 1.31 0.03 0.44 -1.05 -0.24 -1.30 118.70 114.52 1h64 s GLU 26 Ca 0.34 -0.54 0.07 0.00 -0.15 0.00 0.00 54.97 54.69 1h64 s GLU 26 Cb -0.10 0.58 -0.02 0.00 -0.44 0.00 0.00 34.13 34.14 1h64 s GLU 26 CO 0.28 -0.57 -0.22 -0.06 0.95 0.00 0.00 175.26 175.64 1h64 s PHE 27 N -3.77 1.90 -0.02 4.83 0.40 -0.15 0.38 117.98 121.55 1h64 s PHE 27 Ca 0.02 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 56.00 1h64 s PHE 27 Cb -0.01 -1.16 0.00 0.00 0.51 0.00 0.00 43.02 42.36 1h64 s PHE 27 CO -0.11 0.06 -0.09 1.03 0.70 0.00 0.00 175.22 176.82 1h64 s ARG 28 N -1.01 0.91 0.00 0.44 0.52 -0.62 -0.19 118.95 118.99 1h64 s ARG 28 Ca 0.08 -0.31 0.00 0.00 -0.52 0.00 0.00 55.73 54.98 1h64 s ARG 28 Cb -0.09 -0.86 0.00 0.00 0.52 0.00 0.00 34.95 34.53 1h64 s ARG 28 CO 0.01 0.14 0.00 0.41 0.02 0.00 0.00 175.30 175.88 1h64 n GLY 29 N 3.18 -1.37 3.65 -3.53 0.00 -0.85 -0.66 105.19 105.61 1h64 n GLY 29 Ca -0.17 -0.99 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 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 -1.31 4.13 -0.07 1.61 3.52 -0.77 -0.21 118.95 125.85 1h64 s ARG 30 Ca 0.00 0.22 -0.30 0.00 -0.13 0.00 0.00 55.73 55.53 1h64 s ARG 30 Cb 0.00 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 1h64 s ARG 30 CO 0.00 -0.16 1.37 -1.17 -0.81 0.00 0.00 175.30 174.54 1h64 s LEU 31 N 1.69 4.27 0.00 -0.88 2.96 -0.11 -0.79 118.68 125.81 1h64 s LEU 31 Ca 0.19 1.95 0.00 0.00 -0.22 0.00 0.00 54.13 56.05 1h64 s LEU 31 Cb -0.15 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 42.99 1h64 s LEU 31 CO 0.09 -0.75 0.35 2.30 -1.32 0.00 0.00 176.35 177.02 1h64 n ILE 32 N 5.05 0.00 -3.56 6.68 -5.35 -0.59 0.13 119.36 121.72 1h64 n ILE 32 Ca 0.14 -0.42 -0.06 0.00 -0.27 0.00 0.00 62.75 62.14 1h64 n ILE 32 Cb 0.44 1.14 -0.02 0.00 -1.74 0.00 0.00 39.64 39.46 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 -0.13 -0.35 0.12 3.28 0.00 -1.20 -4.91 107.32 104.14 1h64 s GLY 33 Ca 0.00 1.42 -0.26 0.00 0.00 0.00 0.00 44.72 45.88 1h64 s GLY 33 CO 0.00 0.48 1.00 -2.52 0.00 0.00 0.00 173.10 172.06 1h64 s TYR 34 N -2.61 -0.13 0.36 1.90 -0.85 -1.26 -0.41 117.35 114.34 1h64 s TYR 34 Ca 0.08 -0.14 0.07 0.00 -0.52 0.00 0.00 57.07 56.56 1h64 s TYR 34 Cb -0.01 0.62 -0.03 0.00 0.38 0.00 0.00 41.96 42.92 1h64 s TYR 34 CO -0.06 -0.73 0.26 0.16 -1.52 0.00 0.00 175.55 173.65 1h64 s ASP 35 N -2.91 2.01 0.60 -0.18 1.47 -0.82 -4.98 116.67 111.86 1h64 s ASP 35 Ca 0.12 -1.77 0.40 0.00 1.18 0.00 0.00 52.55 52.48 1h64 s ASP 35 Cb -0.01 0.58 2.07 0.00 -0.34 0.00 0.00 42.92 45.22 1h64 s ASP 35 CO 0.01 -1.06 2.21 -0.29 0.68 0.00 0.00 175.17 176.72 1h64 h ILE 36 N 2.03 0.00 -0.02 2.11 2.10 -2.03 -1.19 117.51 120.50 1h64 h ILE 36 Ca -0.26 -0.11 0.00 0.00 1.08 0.00 0.00 64.86 65.56 1h64 h ILE 36 Cb 1.24 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 38.03 1h64 h ILE 36 CO 0.39 0.00 0.00 1.41 -1.08 0.00 0.00 178.15 178.87 1h64 n HIS 37 N -2.98 0.02 -1.75 2.19 8.25 -1.26 -4.90 115.22 114.78 1h64 n HIS 37 Ca -0.02 -0.01 -0.07 0.00 -0.26 0.00 0.00 57.72 57.36 1h64 n HIS 37 Cb 0.12 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.22 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 -0.04 -1.00 -4.78 2.41 4.32 -0.45 -4.41 117.00 113.05 1h64 n LEU 38 Ca 0.20 0.07 -0.37 0.00 -0.02 0.00 0.00 56.01 55.89 1h64 n LEU 38 Cb 0.30 -1.36 -0.04 0.00 -1.62 0.00 0.00 43.42 40.71 1h64 n LEU 38 CO 0.16 -0.21 0.73 0.20 -1.22 0.00 0.00 177.39 177.05 1h64 s ASN 39 N -2.77 6.86 0.07 -1.43 0.02 -1.26 -3.38 114.94 113.05 1h64 s ASN 39 Ca 0.00 2.03 0.02 0.00 -1.02 0.00 0.00 52.86 53.89 1h64 s ASN 39 Cb 0.00 -2.59 -0.03 0.00 0.02 0.00 0.00 41.25 38.65 1h64 s ASN 39 CO 0.00 -0.42 -0.08 0.68 0.02 0.00 0.00 177.10 177.31 1h64 s VAL 40 N -1.62 0.63 -0.10 1.60 -7.23 -0.42 -1.94 120.40 111.33 1h64 s VAL 40 Ca 0.56 -1.46 0.03 0.00 -1.81 0.00 0.00 61.98 59.30 1h64 s VAL 40 Cb -0.22 -1.09 -0.01 0.00 0.56 0.00 0.00 36.38 35.62 1h64 s VAL 40 CO 0.28 -0.59 -0.18 -0.69 -0.31 0.00 0.00 175.10 173.61 1h64 s VAL 41 N -2.34 2.60 0.05 1.32 1.01 0.46 -0.28 120.40 123.22 1h64 s VAL 41 Ca -0.00 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.21 1h64 s VAL 41 Cb -0.03 -2.03 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 1h64 s VAL 41 CO -0.02 0.55 -0.21 -0.76 0.00 0.00 0.00 175.10 174.67 1h64 s LEU 42 N 0.09 2.19 0.10 3.92 1.43 -0.29 -1.53 118.68 124.58 1h64 s LEU 42 Ca -0.08 -0.55 0.06 0.00 -1.03 0.00 0.00 54.13 52.53 1h64 s LEU 42 Cb -0.15 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.06 1h64 s LEU 42 CO 0.05 0.15 -0.07 0.00 0.23 0.00 0.00 176.35 176.71 1h64 s ALA 43 N -0.85 3.05 -1.24 4.21 0.00 0.03 -1.19 121.76 125.76 1h64 s ALA 43 Ca 0.07 -1.20 -0.16 0.00 0.00 0.00 0.00 51.96 50.67 1h64 s ALA 43 Cb -0.09 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 22.04 1h64 s ALA 43 CO 0.02 0.66 0.64 -0.25 0.00 0.00 0.00 175.76 176.83 1h64 n ASP 44 N 0.70 -3.39 -4.93 0.00 8.00 0.15 -1.85 116.55 115.23 1h64 n ASP 44 Ca -0.13 -1.07 -0.27 0.00 0.71 0.00 0.00 54.79 54.04 1h64 n ASP 44 Cb 0.52 -2.96 -0.03 0.00 -0.02 0.00 0.00 41.12 38.63 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 -3.66 3.80 -0.04 2.24 0.00 0.22 -4.45 121.76 119.87 1h64 s ALA 45 Ca 0.32 -0.82 0.04 0.00 0.00 0.00 0.00 51.96 51.49 1h64 s ALA 45 Cb -0.13 -2.03 0.00 0.00 0.00 0.00 0.00 23.12 20.96 1h64 s ALA 45 CO 0.89 0.36 -0.15 -1.21 0.00 0.00 0.00 175.76 175.66 1h64 s GLU 46 N -3.47 1.59 -0.19 0.00 2.02 0.17 -0.66 118.70 118.16 1h64 s GLU 46 Ca 0.39 -0.51 -0.14 0.00 0.02 0.00 0.00 54.97 54.73 1h64 s GLU 46 Cb -0.11 -1.38 -0.04 0.00 0.10 0.00 0.00 34.13 32.70 1h64 s GLU 46 CO 0.30 0.18 0.33 1.41 0.02 0.00 0.00 175.26 177.49 1h64 s MET 47 N 0.17 4.20 -0.13 1.61 -2.45 0.20 -1.60 119.30 121.31 1h64 s MET 47 Ca -0.05 0.10 0.01 0.00 -1.25 0.00 0.00 55.69 54.50 1h64 s MET 47 Cb -0.12 -3.49 -0.01 0.00 1.25 0.00 0.00 34.83 32.47 1h64 s MET 47 CO 0.02 0.09 -0.16 0.42 1.05 0.00 0.00 175.02 176.44 1h64 s ILE 48 N 0.91 2.69 -0.25 10.11 1.01 0.16 -1.24 121.20 134.58 1h64 s ILE 48 Ca 0.17 -0.78 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 1h64 s ILE 48 Cb -0.14 -2.11 0.02 0.00 0.01 0.00 0.00 42.46 40.25 1h64 s ILE 48 CO 0.06 0.53 -0.05 -1.58 0.00 0.00 0.00 174.94 173.90 1h64 s GLN 49 N 0.51 2.85 -1.37 2.79 0.74 0.60 -1.08 119.66 124.70 1h64 s GLN 49 Ca -0.11 -0.97 -0.01 0.00 0.05 0.00 0.00 55.36 54.32 1h64 s GLN 49 Cb -0.16 -3.03 -0.00 0.00 1.10 0.00 0.00 33.01 30.92 1h64 s GLN 49 CO 0.04 -0.41 0.51 -0.25 -0.55 0.00 0.00 175.29 174.63 1h64 n ASP 50 N 4.69 -0.67 0.00 6.67 8.00 -0.52 -1.32 116.55 133.39 1h64 n ASP 50 Ca -0.16 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.39 1h64 n ASP 50 Cb 0.47 -3.36 0.00 0.00 -0.02 0.00 0.00 41.12 38.21 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 -1.86 0.55 3.29 0.44 0.00 -1.26 -5.02 105.19 101.34 1h64 n GLY 51 Ca -0.30 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.34 3.08 -0.13 1.61 2.12 -0.43 -5.09 118.70 119.52 1h64 s GLU 52 Ca 0.00 -0.81 -0.29 0.00 0.36 0.00 0.00 54.97 54.23 1h64 s GLU 52 Cb 0.00 -2.40 -0.02 0.00 0.26 0.00 0.00 34.13 31.96 1h64 s GLU 52 CO 0.00 0.24 1.31 0.08 -0.54 0.00 0.00 175.26 176.35 1h64 s VAL 53 N 0.23 4.16 -0.01 3.70 1.01 -1.26 -0.29 120.40 127.93 1h64 s VAL 53 Ca -0.13 1.43 0.06 0.00 0.00 0.00 0.00 61.98 63.35 1h64 s VAL 53 Cb -0.16 -3.92 -0.10 0.00 0.00 0.00 0.00 36.38 32.19 1h64 s VAL 53 CO 0.07 -0.10 0.13 1.33 0.00 0.00 0.00 175.10 176.53 1h64 n VAL 54 N 5.23 0.04 -3.70 2.92 0.24 -0.37 -4.96 118.33 117.73 1h64 n VAL 54 Ca 0.14 -0.16 -0.11 0.00 -2.04 0.00 0.00 64.34 62.17 1h64 n VAL 54 Cb 0.45 0.23 -0.06 0.00 -1.47 0.00 0.00 33.84 32.99 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 -2.42 0.94 0.01 7.34 1.02 -1.18 -4.99 119.74 120.45 1h64 s LYS 55 Ca -0.02 -0.60 0.03 0.00 0.02 0.00 0.00 55.97 55.39 1h64 s LYS 55 Cb 0.04 0.41 -0.01 0.00 -0.52 0.00 0.00 37.83 37.75 1h64 s LYS 55 CO 0.27 -0.33 -0.09 1.03 -0.92 0.00 0.00 175.35 175.31 1h64 s ARG 56 N -3.17 0.67 -0.01 1.68 0.52 -1.26 -0.63 118.95 116.75 1h64 s ARG 56 Ca -0.01 -0.44 0.01 0.00 -0.52 0.00 0.00 55.73 54.78 1h64 s ARG 56 Cb 0.01 -0.62 0.00 0.00 0.52 0.00 0.00 34.95 34.86 1h64 s ARG 56 CO -0.07 0.16 -0.04 0.71 0.02 0.00 0.00 175.30 176.07 1h64 s TYR 57 N -0.49 0.49 0.12 -0.53 1.51 0.17 -5.00 117.35 113.61 1h64 s TYR 57 Ca 0.01 -0.09 -0.17 0.00 -1.01 0.00 0.00 57.07 55.81 1h64 s TYR 57 Cb -0.05 -0.36 -0.03 0.00 -0.11 0.00 0.00 41.96 41.41 1h64 s TYR 57 CO 0.00 -0.05 1.62 0.78 -1.11 0.00 0.00 175.55 176.79 1h64 h GLY 58 N 6.33 0.60 -5.02 0.71 0.00 -1.92 0.67 103.07 104.44 1h64 h GLY 58 Ca -0.31 -0.37 -0.13 0.00 0.00 0.00 0.00 47.33 46.51 1h64 h GLY 58 CO 0.50 0.35 -0.31 1.25 0.00 0.00 0.00 176.54 178.32 1h64 s LYS 59 N -5.33 0.49 -0.16 4.80 2.20 -1.26 0.31 119.74 120.78 1h64 s LYS 59 Ca -0.13 0.23 -0.14 0.00 -0.36 0.00 0.00 55.97 55.57 1h64 s LYS 59 Cb 0.09 0.23 0.04 0.00 -1.51 0.00 0.00 37.83 36.69 1h64 s LYS 59 CO 0.75 -0.09 0.43 -1.50 -0.36 0.00 0.00 175.35 174.58 1h64 s ILE 60 N -0.35 -0.00 -0.23 5.43 2.07 -0.34 -4.99 121.20 122.79 1h64 s ILE 60 Ca -0.05 0.01 -0.09 0.00 -1.41 0.00 0.00 60.65 59.11 1h64 s ILE 60 Cb -0.03 -0.61 -0.04 0.00 0.13 0.00 0.00 42.46 41.90 1h64 s ILE 60 CO 0.02 0.00 0.11 -0.69 -1.91 0.00 0.00 174.94 172.47 1h64 s VAL 61 N 0.37 4.94 -0.18 4.00 1.01 -1.26 -1.14 120.40 128.14 1h64 s VAL 61 Ca -0.01 0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.97 1h64 s VAL 61 Cb -0.04 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 1h64 s VAL 61 CO -0.01 0.38 -0.07 -0.63 0.00 0.00 0.00 175.10 174.77 1h64 s ILE 62 N 1.00 3.42 0.08 2.22 1.01 0.61 -4.97 121.20 124.56 1h64 s ILE 62 Ca 0.06 -0.51 -0.31 0.00 0.00 0.00 0.00 60.65 59.89 1h64 s ILE 62 Cb -0.14 -2.51 -0.06 0.00 0.01 0.00 0.00 42.46 39.76 1h64 s ILE 62 CO 0.03 0.47 1.26 -0.13 0.00 0.00 0.00 174.94 176.57 1h64 s ARG 63 N 0.85 4.40 0.55 2.79 0.52 -1.26 -1.30 118.95 125.50 1h64 s ARG 63 Ca -0.02 1.86 0.22 0.00 -0.52 0.00 0.00 55.73 57.28 1h64 s ARG 63 Cb -0.15 -3.32 1.52 0.00 0.52 0.00 0.00 34.95 33.52 1h64 s ARG 63 CO 0.01 -0.32 2.20 0.78 0.02 0.00 0.00 175.30 177.99 1h64 h GLY 64 N 6.82 0.00 1.73 -3.53 0.00 -1.76 -2.78 103.07 103.55 1h64 h GLY 64 Ca -0.42 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.93 1h64 h GLY 64 CO 0.83 0.00 0.12 -1.80 0.00 0.00 0.00 176.54 175.69 1h64 h ASP 65 N 0.00 0.00 0.03 0.19 3.58 -1.87 0.29 116.42 118.63 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 0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 1h64 h ASP 65 CO -0.00 0.00 -0.24 0.59 -2.88 0.00 0.00 179.24 176.71 1h64 n ASN 66 N -3.35 2.03 -4.73 2.28 3.02 -1.05 -4.95 115.26 108.51 1h64 n ASN 66 Ca -0.02 -1.52 -0.40 0.00 -0.03 0.00 0.00 54.58 52.61 1h64 n ASN 66 Cb 0.20 0.22 -0.05 0.00 -0.61 0.00 0.00 39.78 39.54 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 -2.29 4.84 -0.13 2.41 1.01 0.09 -3.89 120.40 122.44 1h64 s VAL 67 Ca 0.25 1.63 -0.07 0.00 0.00 0.00 0.00 61.98 63.79 1h64 s VAL 67 Cb 0.19 -4.12 -0.25 0.00 0.00 0.00 0.00 36.38 32.20 1h64 s VAL 67 CO 0.46 0.30 0.32 0.18 0.00 0.00 0.00 175.10 176.36 1h64 n LEU 68 N 3.24 2.64 -3.47 3.92 4.77 0.42 -5.01 117.00 123.52 1h64 n LEU 68 Ca -0.01 0.19 -0.10 0.00 -0.03 0.00 0.00 56.01 56.06 1h64 n LEU 68 Cb 0.51 -1.11 -0.02 0.00 -2.33 0.00 0.00 43.42 40.47 1h64 n LEU 68 CO 0.48 0.85 0.55 0.00 -1.33 0.00 0.00 177.39 177.94 1h64 s ALA 69 N -2.55 -1.73 -0.04 -1.18 0.00 -1.12 -5.01 121.76 110.13 1h64 s ALA 69 Ca -0.23 0.82 0.01 0.00 0.00 0.00 0.00 51.96 52.56 1h64 s ALA 69 Cb 0.07 0.57 0.02 0.00 0.00 0.00 0.00 23.12 23.77 1h64 s ALA 69 CO 0.75 -0.70 -0.07 0.42 0.00 0.00 0.00 175.76 176.17 1h64 s ILE 70 N -3.25 0.67 -0.08 0.00 1.01 -1.26 -0.46 121.20 117.84 1h64 s ILE 70 Ca 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 60.65 60.44 1h64 s ILE 70 Cb -0.01 -0.66 0.03 0.00 0.01 0.00 0.00 42.46 41.83 1h64 s ILE 70 CO -0.10 0.25 -0.02 -0.55 0.00 0.00 0.00 174.94 174.52 1h64 s SER 71 N 0.74 1.72 0.37 3.58 0.15 -0.32 -4.99 113.70 114.95 1h64 s SER 71 Ca -0.11 -0.14 -0.28 0.00 0.70 0.00 0.00 55.95 56.12 1h64 s SER 71 Cb -0.14 -0.55 -0.10 0.00 -1.71 0.00 0.00 66.02 63.53 1h64 s SER 71 CO 0.01 -0.17 1.34 -2.16 1.20 0.00 0.00 173.24 173.47 1h64 s PRO 72 N 1.86 4.15 0.00 5.44 0.04 -1.26 -1.22 135.00 144.01 1h64 s PRO 72 Ca 0.04 2.27 0.27 0.00 0.04 0.00 0.00 61.00 63.63 1h64 s PRO 72 Cb -0.12 -2.93 0.91 0.00 0.04 0.00 0.00 34.50 32.39 1h64 s PRO 72 CO -0.06 -0.38 1.66 0.25 0.04 0.00 0.00 177.00 178.52