#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 3.62 0.23 3.44 0.52 -1.26 -4.82 118.95 120.68 1h64 s ARG 4 Ca 0.00 1.74 -0.13 0.00 -0.52 0.00 0.00 55.73 56.82 1h64 s ARG 4 Cb 0.00 -2.28 0.28 0.00 0.52 0.00 0.00 34.95 33.47 1h64 s ARG 4 CO 0.00 -0.65 1.61 -1.35 0.02 0.00 0.00 175.30 174.92 1h64 h PRO 5 N 1.78 -0.01 -0.12 3.54 0.11 -2.05 0.13 132.00 135.38 1h64 h PRO 5 Ca -0.50 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 1h64 h PRO 5 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1h64 h PRO 5 CO 0.59 -0.01 -0.31 1.25 -0.21 0.00 0.00 178.00 179.31 1h64 h LEU 6 N -0.01 0.23 -0.06 2.35 5.85 -1.99 -2.48 115.31 119.19 1h64 h LEU 6 Ca 0.34 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1h64 h LEU 6 Cb 0.54 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1h64 h LEU 6 CO -0.75 0.54 0.04 0.44 -0.34 0.00 0.00 178.44 178.37 1h64 h ASP 7 N 0.20 0.07 -0.49 1.25 3.45 -1.14 -0.01 116.42 119.75 1h64 h ASP 7 Ca 0.03 -0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.49 1h64 h ASP 7 Cb 0.66 -0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 39.39 1h64 h ASP 7 CO 0.05 0.05 0.32 0.58 -1.57 0.00 0.00 179.24 178.67 1h64 h VAL 8 N 0.08 1.11 -0.53 -1.35 2.07 -1.12 -1.12 116.25 115.40 1h64 h VAL 8 Ca 0.02 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1h64 h VAL 8 Cb -0.01 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1h64 h VAL 8 CO -0.00 0.12 0.20 0.40 0.02 0.00 0.00 177.57 178.30 1h64 h ILE 9 N 0.65 1.22 -0.68 4.57 1.08 -1.28 -2.38 117.51 120.69 1h64 h ILE 9 Ca 0.18 -0.70 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 1h64 h ILE 9 Cb -0.06 0.70 -0.03 0.00 -3.07 0.00 0.00 36.82 34.35 1h64 h ILE 9 CO -0.05 0.27 0.44 -0.74 -0.69 0.00 0.00 178.15 177.38 1h64 h HIS 10 N 0.71 0.86 0.00 1.37 2.76 -0.65 -1.01 115.15 119.19 1h64 h HIS 10 Ca 0.17 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.36 1h64 h HIS 10 Cb 0.22 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 28.89 1h64 h HIS 10 CO 0.01 0.55 0.00 0.54 -1.30 0.00 0.00 177.93 177.73 1h64 n ARG 11 N -4.60 0.17 -0.02 5.26 1.74 -0.45 -1.94 116.66 116.81 1h64 n ARG 11 Ca 0.06 0.51 0.13 0.00 -0.77 0.00 0.00 57.85 57.78 1h64 n ARG 11 Cb 0.02 -1.90 0.46 0.00 -1.02 0.00 0.00 32.46 30.02 1h64 n ARG 11 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1h64 n SER 12 N -2.23 1.67 -4.71 0.55 7.64 -0.39 -4.92 113.62 111.24 1h64 n SER 12 Ca 0.01 -1.58 -0.43 0.00 1.01 0.00 0.00 58.87 57.87 1h64 n SER 12 Cb 0.15 -0.03 -0.02 0.00 -1.01 0.00 0.00 64.21 63.30 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 0.31 3.69 -2.12 -3.43 4.77 -0.82 -1.50 117.00 117.90 1h64 n LEU 13 Ca 0.18 1.14 -0.20 0.00 -0.03 0.00 0.00 56.01 57.11 1h64 n LEU 13 Cb 0.37 -1.51 -0.03 0.00 -2.33 0.00 0.00 43.42 39.93 1h64 n LEU 13 CO 0.16 -0.19 -0.24 0.47 -1.33 0.00 0.00 177.39 176.25 1h64 n ASP 14 N 2.14 -5.64 -4.22 -1.43 8.00 0.60 -4.97 116.55 111.03 1h64 n ASP 14 Ca 0.10 0.09 -0.16 0.00 0.71 0.00 0.00 54.79 55.53 1h64 n ASP 14 Cb 0.34 -4.72 -0.11 0.00 -0.02 0.00 0.00 41.12 36.61 1h64 n ASP 14 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1h64 s LYS 15 N -4.72 0.97 0.34 -1.24 -0.14 -0.56 -4.89 119.74 109.49 1h64 s LYS 15 Ca 0.00 -1.25 -0.28 0.00 -1.36 0.00 0.00 55.97 53.08 1h64 s LYS 15 Cb 0.00 -0.72 -0.09 0.00 -1.68 0.00 0.00 37.83 35.34 1h64 s LYS 15 CO 0.00 0.12 1.16 0.34 -0.76 0.00 0.00 175.35 176.21 1h64 s ASP 16 N -2.59 6.88 0.06 2.83 -1.08 -1.26 -1.72 116.67 119.80 1h64 s ASP 16 Ca 0.09 2.37 -0.05 0.00 -0.52 0.00 0.00 52.55 54.44 1h64 s ASP 16 Cb -0.03 -2.62 -0.02 0.00 -1.46 0.00 0.00 42.92 38.79 1h64 s ASP 16 CO 0.02 -0.42 0.07 0.68 0.52 0.00 0.00 175.17 176.03 1h64 s VAL 17 N -1.28 0.18 -0.16 1.11 -7.23 -0.14 -0.74 120.40 112.14 1h64 s VAL 17 Ca 0.50 -1.45 -0.01 0.00 -1.81 0.00 0.00 61.98 59.21 1h64 s VAL 17 Cb -0.32 -1.34 -0.01 0.00 0.56 0.00 0.00 36.38 35.27 1h64 s VAL 17 CO 0.42 -0.80 -0.12 -0.22 -0.31 0.00 0.00 175.10 174.07 1h64 s LEU 18 N -2.76 2.68 -0.32 1.32 2.96 0.06 -1.83 118.68 120.80 1h64 s LEU 18 Ca 0.04 -0.39 -0.05 0.00 -0.22 0.00 0.00 54.13 53.51 1h64 s LEU 18 Cb 0.05 -1.63 0.04 0.00 0.50 0.00 0.00 46.19 45.15 1h64 s LEU 18 CO -0.09 0.10 0.06 -0.69 -1.32 0.00 0.00 176.35 174.40 1h64 s VAL 19 N 0.77 3.55 -0.15 1.68 1.01 0.66 -0.84 120.40 127.08 1h64 s VAL 19 Ca -0.05 -1.12 -0.19 0.00 0.00 0.00 0.00 61.98 60.63 1h64 s VAL 19 Cb -0.15 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1h64 s VAL 19 CO 0.01 -0.10 0.50 -0.63 0.00 0.00 0.00 175.10 174.89 1h64 s ILE 20 N 1.38 5.15 0.00 2.22 1.01 0.29 -0.84 121.20 130.40 1h64 s ILE 20 Ca -0.02 0.98 0.00 0.00 0.00 0.00 0.00 60.65 61.61 1h64 s ILE 20 Cb -0.19 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.44 1h64 s ILE 20 CO 0.01 0.27 0.00 0.18 0.00 0.00 0.00 174.94 175.40 1h64 n LEU 21 N 4.10 0.00 -4.91 2.97 4.32 -0.73 -0.28 117.00 122.47 1h64 n LEU 21 Ca -0.06 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 55.68 1h64 n LEU 21 Cb 0.51 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.28 1h64 n LEU 21 CO 0.43 -0.05 -0.12 -1.59 -1.22 0.00 0.00 177.39 174.85 1h64 s LYS 22 N 1.05 3.30 0.00 3.23 -2.85 -1.26 -4.48 119.74 118.73 1h64 s LYS 22 Ca 0.00 -0.71 0.00 0.00 -1.00 0.00 0.00 55.97 54.26 1h64 s LYS 22 Cb 0.00 -2.86 0.00 0.00 -2.06 0.00 0.00 37.83 32.91 1h64 s LYS 22 CO 0.00 0.49 0.00 1.63 0.10 0.00 0.00 175.35 177.57 1h64 n LYS 23 N -0.71 0.00 -0.97 1.78 5.02 -1.26 -3.68 118.16 118.34 1h64 n LYS 23 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1h64 n LYS 23 Cb 0.55 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 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 -2.51 0.49 3.88 0.72 0.00 -1.26 -4.94 105.19 101.57 1h64 n GLY 24 Ca 0.00 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 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 3.49 0.10 1.61 0.40 -1.24 -4.02 117.98 116.32 1h64 s PHE 25 Ca 0.00 0.75 -0.18 0.00 -0.60 0.00 0.00 56.93 56.90 1h64 s PHE 25 Cb 0.00 -2.15 0.04 0.00 0.51 0.00 0.00 43.02 41.42 1h64 s PHE 25 CO 0.00 0.39 0.44 -1.83 0.70 0.00 0.00 175.22 174.93 1h64 s GLU 26 N -2.50 1.05 0.06 0.44 -1.05 -0.54 -1.77 118.70 114.39 1h64 s GLU 26 Ca 0.41 -0.53 0.09 0.00 -0.15 0.00 0.00 54.97 54.79 1h64 s GLU 26 Cb -0.12 0.47 -0.03 0.00 -0.44 0.00 0.00 34.13 34.01 1h64 s GLU 26 CO 0.22 -0.40 -0.24 -0.06 0.95 0.00 0.00 175.26 175.72 1h64 s PHE 27 N -3.29 2.38 -0.02 4.83 0.40 -0.02 0.47 117.98 122.74 1h64 s PHE 27 Ca -0.00 -0.37 0.03 0.00 -0.60 0.00 0.00 56.93 55.99 1h64 s PHE 27 Cb 0.01 -1.39 -0.00 0.00 0.51 0.00 0.00 43.02 42.14 1h64 s PHE 27 CO -0.08 0.19 -0.11 0.50 0.70 0.00 0.00 175.22 176.42 1h64 s ARG 28 N -1.43 1.01 0.00 0.44 3.52 -0.64 -0.24 118.95 121.61 1h64 s ARG 28 Ca 0.13 -0.38 0.00 0.00 -0.13 0.00 0.00 55.73 55.35 1h64 s ARG 28 Cb -0.10 -0.95 0.00 0.00 -1.56 0.00 0.00 34.95 32.34 1h64 s ARG 28 CO 0.04 0.19 0.00 0.41 -0.81 0.00 0.00 175.30 175.13 1h64 n GLY 29 N 3.02 -1.56 3.64 8.12 0.00 -0.76 -0.92 105.19 116.73 1h64 n GLY 29 Ca -0.16 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.92 4.16 -0.10 1.61 3.52 -0.59 -0.96 118.95 124.67 1h64 s ARG 30 Ca 0.00 0.78 -0.30 0.00 -0.13 0.00 0.00 55.73 56.08 1h64 s ARG 30 Cb 0.00 -3.64 -0.03 0.00 -1.56 0.00 0.00 34.95 29.72 1h64 s ARG 30 CO 0.00 -0.45 1.25 -1.17 -0.81 0.00 0.00 175.30 174.12 1h64 s LEU 31 N 2.63 4.24 0.00 -0.88 2.96 -0.70 -0.06 118.68 126.87 1h64 s LEU 31 Ca 0.31 1.78 0.00 0.00 -0.22 0.00 0.00 54.13 56.01 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 0.08 -0.68 0.24 2.30 -1.32 0.00 0.00 176.35 176.97 1h64 n ILE 32 N 4.99 0.00 -3.57 6.68 -5.35 -0.68 0.22 119.36 121.64 1h64 n ILE 32 Ca 0.13 -0.36 -0.05 0.00 -0.27 0.00 0.00 62.75 62.19 1h64 n ILE 32 Cb 0.45 1.18 -0.02 0.00 -1.74 0.00 0.00 39.64 39.51 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 -0.25 -0.36 0.13 3.28 0.00 -1.18 -4.91 107.32 104.02 1h64 s GLY 33 Ca 0.00 1.20 -0.25 0.00 0.00 0.00 0.00 44.72 45.66 1h64 s GLY 33 CO 0.00 0.38 1.03 -2.52 0.00 0.00 0.00 173.10 172.00 1h64 s TYR 34 N -2.74 -0.06 0.28 1.90 -0.85 -1.26 -1.00 117.35 113.62 1h64 s TYR 34 Ca 0.08 -0.23 0.03 0.00 -0.52 0.00 0.00 57.07 56.43 1h64 s TYR 34 Cb -0.00 0.64 -0.03 0.00 0.38 0.00 0.00 41.96 42.94 1h64 s TYR 34 CO -0.06 -0.76 0.24 0.16 -1.52 0.00 0.00 175.55 173.62 1h64 s ASP 35 N -3.07 1.04 0.59 -0.18 1.47 -0.77 -4.99 116.67 110.76 1h64 s ASP 35 Ca 0.15 -1.59 0.29 0.00 1.18 0.00 0.00 52.55 52.58 1h64 s ASP 35 Cb -0.01 0.50 1.69 0.00 -0.34 0.00 0.00 42.92 44.77 1h64 s ASP 35 CO 0.02 -1.00 2.14 0.40 0.68 0.00 0.00 175.17 177.41 1h64 h ILE 36 N 2.31 0.49 -0.05 2.11 1.08 -2.03 -0.72 117.51 120.70 1h64 h ILE 36 Ca -0.29 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.18 1h64 h ILE 36 Cb 1.24 0.88 0.00 0.00 -3.07 0.00 0.00 36.82 35.87 1h64 h ILE 36 CO 0.42 0.00 0.00 1.41 -0.69 0.00 0.00 178.15 179.29 1h64 n HIS 37 N -3.83 0.06 -1.80 1.37 8.25 -1.26 -4.88 115.22 113.13 1h64 n HIS 37 Ca 0.00 -0.03 -0.13 0.00 -0.26 0.00 0.00 57.72 57.31 1h64 n HIS 37 Cb 0.26 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.34 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 -0.47 -1.25 -4.75 2.41 4.77 -0.28 -4.34 117.00 113.09 1h64 n LEU 38 Ca 0.15 0.16 -0.40 0.00 -0.03 0.00 0.00 56.01 55.88 1h64 n LEU 38 Cb 0.15 -1.98 -0.05 0.00 -2.33 0.00 0.00 43.42 39.21 1h64 n LEU 38 CO 0.12 -0.41 0.69 0.20 -1.33 0.00 0.00 177.39 176.65 1h64 s ASN 39 N -2.65 7.54 0.21 -1.43 0.01 -1.26 -3.39 114.94 113.98 1h64 s ASN 39 Ca 0.00 1.98 0.06 0.00 -0.71 0.00 0.00 52.86 54.19 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 0.04 -0.08 0.68 -1.51 0.00 0.00 177.10 176.23 1h64 s VAL 40 N -0.89 1.42 -0.11 1.60 -7.23 -0.07 -1.84 120.40 113.27 1h64 s VAL 40 Ca 0.43 -2.12 0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1h64 s VAL 40 Cb -0.27 -2.15 0.01 0.00 0.56 0.00 0.00 36.38 34.53 1h64 s VAL 40 CO 0.33 -0.51 -0.17 -0.69 -0.31 0.00 0.00 175.10 173.76 1h64 s VAL 41 N -3.17 1.59 0.04 1.32 1.01 -0.17 0.01 120.40 121.03 1h64 s VAL 41 Ca 0.24 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.60 1h64 s VAL 41 Cb 0.03 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 1h64 s VAL 41 CO 0.07 0.46 -0.23 -0.76 0.00 0.00 0.00 175.10 174.64 1h64 s LEU 42 N 0.86 2.34 0.10 3.92 1.43 0.53 -1.69 118.68 126.18 1h64 s LEU 42 Ca -0.09 -0.52 0.05 0.00 -1.03 0.00 0.00 54.13 52.54 1h64 s LEU 42 Cb -0.15 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1h64 s LEU 42 CO 0.00 0.26 -0.01 0.00 0.23 0.00 0.00 176.35 176.83 1h64 s ALA 43 N -0.85 3.26 -1.30 4.21 0.00 0.91 -1.03 121.76 126.95 1h64 s ALA 43 Ca 0.13 -1.15 -0.14 0.00 0.00 0.00 0.00 51.96 50.79 1h64 s ALA 43 Cb -0.10 -1.15 0.01 0.00 0.00 0.00 0.00 23.12 21.88 1h64 s ALA 43 CO 0.03 0.67 0.53 -0.25 0.00 0.00 0.00 175.76 176.75 1h64 n ASP 44 N 0.50 -2.49 -4.94 0.00 10.43 0.11 -1.54 116.55 118.63 1h64 n ASP 44 Ca -0.11 -1.12 -0.24 0.00 2.57 0.00 0.00 54.79 55.89 1h64 n ASP 44 Cb 0.52 -2.63 -0.01 0.00 1.84 0.00 0.00 41.12 40.84 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 -3.78 3.68 0.00 2.24 0.00 0.58 -4.43 121.76 120.06 1h64 s ALA 45 Ca 0.26 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.34 1h64 s ALA 45 Cb -0.11 -2.17 -0.01 0.00 0.00 0.00 0.00 23.12 20.83 1h64 s ALA 45 CO 0.92 -0.12 -0.06 -1.83 0.00 0.00 0.00 175.76 174.67 1h64 s GLU 46 N -4.40 0.44 -0.12 0.00 -1.05 -0.10 -0.63 118.70 112.84 1h64 s GLU 46 Ca 0.42 -0.28 -0.17 0.00 -0.15 0.00 0.00 54.97 54.79 1h64 s GLU 46 Cb -0.10 -0.39 -0.04 0.00 -0.44 0.00 0.00 34.13 33.16 1h64 s GLU 46 CO 0.37 0.10 0.43 1.41 0.95 0.00 0.00 175.26 178.52 1h64 s MET 47 N -0.36 4.29 -0.06 -4.83 -2.45 0.74 -1.62 119.30 115.01 1h64 s MET 47 Ca 0.00 0.37 0.04 0.00 -1.25 0.00 0.00 55.69 54.85 1h64 s MET 47 Cb -0.03 -3.42 -0.02 0.00 1.25 0.00 0.00 34.83 32.61 1h64 s MET 47 CO -0.00 0.21 -0.18 0.42 1.05 0.00 0.00 175.02 176.52 1h64 s ILE 48 N 0.47 2.69 -0.06 10.11 1.01 0.18 -0.13 121.20 135.48 1h64 s ILE 48 Ca 0.24 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 60.02 1h64 s ILE 48 Cb -0.15 -2.04 0.04 0.00 0.01 0.00 0.00 42.46 40.32 1h64 s ILE 48 CO 0.09 0.57 0.12 -1.58 0.00 0.00 0.00 174.94 174.14 1h64 s GLN 49 N -0.35 0.06 -1.06 2.79 0.74 -0.13 -1.47 119.66 120.24 1h64 s GLN 49 Ca 0.03 0.34 0.00 0.00 0.05 0.00 0.00 55.36 55.78 1h64 s GLN 49 Cb -0.12 -0.21 0.00 0.00 1.10 0.00 0.00 33.01 33.78 1h64 s GLN 49 CO 0.02 -0.18 0.00 -3.47 -0.55 0.00 0.00 175.29 171.12 1h64 n ASP 50 N 4.28 -5.06 0.00 6.67 -0.08 -1.26 -0.86 116.55 120.24 1h64 n ASP 50 Ca -0.25 0.25 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 1h64 n ASP 50 Cb 0.51 -3.44 0.00 0.00 2.34 0.00 0.00 41.12 40.53 1h64 n ASP 50 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1h64 n GLY 51 N -0.61 0.76 3.32 0.27 0.00 -1.26 -5.04 105.19 102.64 1h64 n GLY 51 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.30 2.74 0.20 1.61 2.12 -0.04 -5.09 118.70 119.94 1h64 s GLU 52 Ca 0.00 -0.82 -0.32 0.00 0.36 0.00 0.00 54.97 54.19 1h64 s GLU 52 Cb 0.00 -2.30 -0.11 0.00 0.26 0.00 0.00 34.13 31.97 1h64 s GLU 52 CO 0.00 0.38 1.67 0.08 -0.54 0.00 0.00 175.26 176.85 1h64 s VAL 53 N -0.14 2.20 -0.09 3.70 1.01 -1.26 -0.96 120.40 124.86 1h64 s VAL 53 Ca -0.03 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.13 1h64 s VAL 53 Cb -0.14 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1h64 s VAL 53 CO 0.04 0.01 0.11 1.33 0.00 0.00 0.00 175.10 176.59 1h64 n VAL 54 N 3.86 0.00 -3.52 2.92 0.24 0.82 -4.91 118.33 117.74 1h64 n VAL 54 Ca 0.15 -0.28 -0.10 0.00 -2.04 0.00 0.00 64.34 62.06 1h64 n VAL 54 Cb 0.36 0.76 -0.03 0.00 -1.47 0.00 0.00 33.84 33.46 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 -1.69 0.82 0.07 7.34 2.20 -1.21 -4.98 119.74 122.29 1h64 s LYS 55 Ca 0.00 -0.13 0.07 0.00 -0.36 0.00 0.00 55.97 55.55 1h64 s LYS 55 Cb 0.02 0.38 -0.03 0.00 -1.51 0.00 0.00 37.83 36.70 1h64 s LYS 55 CO 0.14 -0.32 -0.19 1.03 -0.36 0.00 0.00 175.35 175.64 1h64 s ARG 56 N -2.41 1.12 -0.01 4.03 0.52 -1.26 -0.18 118.95 120.76 1h64 s ARG 56 Ca 0.01 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.20 1h64 s ARG 56 Cb -0.01 -1.27 0.01 0.00 0.52 0.00 0.00 34.95 34.20 1h64 s ARG 56 CO -0.04 0.30 -0.01 0.71 0.02 0.00 0.00 175.30 176.28 1h64 s TYR 57 N -1.04 0.13 0.12 -0.53 1.51 0.20 -4.98 117.35 112.75 1h64 s TYR 57 Ca 0.05 -0.00 -0.13 0.00 -1.01 0.00 0.00 57.07 55.98 1h64 s TYR 57 Cb -0.09 -0.14 -0.06 0.00 -0.11 0.00 0.00 41.96 41.56 1h64 s TYR 57 CO 0.03 -0.03 1.45 0.78 -1.11 0.00 0.00 175.55 176.67 1h64 h GLY 58 N 6.40 0.88 -5.49 0.71 0.00 -1.93 0.17 103.07 103.80 1h64 h GLY 58 Ca -0.30 -0.89 -0.16 0.00 0.00 0.00 0.00 47.33 45.99 1h64 h GLY 58 CO 0.50 0.80 -0.39 1.25 0.00 0.00 0.00 176.54 178.70 1h64 s LYS 59 N -4.40 0.32 -0.12 4.80 2.20 -1.26 0.09 119.74 121.37 1h64 s LYS 59 Ca -0.12 0.46 -0.10 0.00 -0.36 0.00 0.00 55.97 55.86 1h64 s LYS 59 Cb 0.10 0.09 0.03 0.00 -1.51 0.00 0.00 37.83 36.54 1h64 s LYS 59 CO 0.85 -0.08 0.30 -1.50 -0.36 0.00 0.00 175.35 174.57 1h64 s ILE 60 N 0.49 -0.01 -0.27 5.43 2.07 -0.20 -4.99 121.20 123.72 1h64 s ILE 60 Ca -0.03 0.03 -0.08 0.00 -1.41 0.00 0.00 60.65 59.16 1h64 s ILE 60 Cb -0.04 -0.43 -0.02 0.00 0.13 0.00 0.00 42.46 42.09 1h64 s ILE 60 CO -0.03 0.01 0.10 -0.69 -1.91 0.00 0.00 174.94 172.43 1h64 s VAL 61 N 0.39 4.48 -0.17 4.00 1.01 -1.26 -0.35 120.40 128.50 1h64 s VAL 61 Ca -0.02 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 61.70 1h64 s VAL 61 Cb -0.04 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1h64 s VAL 61 CO -0.02 0.25 0.00 -0.63 0.00 0.00 0.00 175.10 174.71 1h64 s ILE 62 N 1.63 4.22 0.03 2.22 1.01 0.10 -4.96 121.20 125.45 1h64 s ILE 62 Ca 0.06 -0.24 -0.30 0.00 0.00 0.00 0.00 60.65 60.17 1h64 s ILE 62 Cb -0.16 -2.87 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 1h64 s ILE 62 CO 0.05 0.48 1.11 -0.13 0.00 0.00 0.00 174.94 176.45 1h64 s ARG 63 N 0.40 4.48 0.58 2.79 0.52 -1.26 -0.90 118.95 125.56 1h64 s ARG 63 Ca -0.01 1.63 0.27 0.00 -0.52 0.00 0.00 55.73 57.10 1h64 s ARG 63 Cb -0.14 -3.40 1.64 0.00 0.52 0.00 0.00 34.95 33.58 1h64 s ARG 63 CO 0.02 -0.18 2.14 0.78 0.02 0.00 0.00 175.30 178.08 1h64 h GLY 64 N 6.84 0.00 1.95 -3.53 0.00 -1.75 -2.63 103.07 103.94 1h64 h GLY 64 Ca -0.41 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.92 1h64 h GLY 64 CO 0.79 0.00 0.02 -1.80 0.00 0.00 0.00 176.54 175.55 1h64 h ASP 65 N 0.00 0.00 -0.12 0.19 1.82 -1.87 -0.31 116.42 116.13 1h64 h ASP 65 Ca 0.06 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.70 1h64 h ASP 65 Cb 0.33 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.34 1h64 h ASP 65 CO -0.00 0.00 0.00 0.59 -1.61 0.00 0.00 179.24 178.22 1h64 n ASN 66 N -4.03 2.79 -4.72 2.28 3.02 -0.99 -4.94 115.26 108.67 1h64 n ASN 66 Ca -0.02 -1.90 -0.40 0.00 -0.03 0.00 0.00 54.58 52.23 1h64 n ASN 66 Cb 0.11 -0.06 -0.05 0.00 -0.61 0.00 0.00 39.78 39.17 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 -1.87 5.03 -0.16 2.41 1.01 -0.13 -4.25 120.40 122.44 1h64 s VAL 67 Ca 0.32 1.43 -0.20 0.00 0.00 0.00 0.00 61.98 63.53 1h64 s VAL 67 Cb 0.21 -4.03 -0.23 0.00 0.00 0.00 0.00 36.38 32.32 1h64 s VAL 67 CO 0.31 0.27 0.44 0.25 0.00 0.00 0.00 175.10 176.36 1h64 h LEU 68 N 6.67 0.14 -7.66 3.92 5.85 -0.92 -3.49 115.31 119.82 1h64 h LEU 68 Ca -0.41 -0.73 0.05 0.00 0.84 0.00 0.00 57.88 57.62 1h64 h LEU 68 Cb 1.20 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 1h64 h LEU 68 CO 0.75 1.45 0.25 0.00 -0.34 0.00 0.00 178.44 180.55 1h64 s ALA 69 N -2.38 -1.37 -0.02 1.25 0.00 -1.05 -5.01 121.76 113.18 1h64 s ALA 69 Ca -0.24 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.71 1h64 s ALA 69 Cb 0.04 0.84 0.02 0.00 0.00 0.00 0.00 23.12 24.02 1h64 s ALA 69 CO 0.67 -0.95 0.00 0.42 0.00 0.00 0.00 175.76 175.91 1h64 s ILE 70 N -3.81 0.13 -0.07 0.00 1.01 -1.26 -0.55 121.20 116.64 1h64 s ILE 70 Ca 0.08 0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.83 1h64 s ILE 70 Cb -0.04 -0.21 0.02 0.00 0.01 0.00 0.00 42.46 42.23 1h64 s ILE 70 CO 0.00 0.12 -0.11 -0.55 0.00 0.00 0.00 174.94 174.40 1h64 s SER 71 N 0.85 1.82 0.12 3.58 0.15 -0.02 -4.98 113.70 115.21 1h64 s SER 71 Ca -0.08 -0.30 -0.30 0.00 0.70 0.00 0.00 55.95 55.97 1h64 s SER 71 Cb -0.11 -0.82 -0.07 0.00 -1.71 0.00 0.00 66.02 63.31 1h64 s SER 71 CO -0.02 0.01 1.19 -2.84 1.20 0.00 0.00 173.24 172.78 1h64 s PRO 72 N 0.83 4.47 0.00 5.44 0.02 -1.26 -0.76 135.00 143.74 1h64 s PRO 72 Ca -0.11 1.80 0.14 0.00 0.02 0.00 0.00 61.00 62.85 1h64 s PRO 72 Cb -0.15 -3.30 0.86 0.00 0.02 0.00 0.00 34.50 31.93 1h64 s PRO 72 CO 0.02 -0.16 1.28 2.41 -0.33 0.00 0.00 177.00 180.22