#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 2.48 0.23 3.44 1.70 -1.26 -4.76 118.95 120.79 1h64 s ARG 4 Ca 0.00 1.16 -0.17 0.00 -0.47 0.00 0.00 55.73 56.26 1h64 s ARG 4 Cb 0.00 -1.92 0.26 0.00 -0.57 0.00 0.00 34.95 32.72 1h64 s ARG 4 CO 0.00 -1.47 1.55 -1.35 -1.08 0.00 0.00 175.30 172.95 1h64 h PRO 5 N -0.84 -0.00 -0.13 3.89 0.11 -2.05 0.39 132.00 133.37 1h64 h PRO 5 Ca -0.44 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.61 1h64 h PRO 5 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1h64 h PRO 5 CO 0.53 -0.00 -0.19 -0.07 -0.21 0.00 0.00 178.00 178.06 1h64 h LEU 6 N -0.00 0.20 -0.37 2.35 -0.00 -2.00 -2.42 115.31 113.07 1h64 h LEU 6 Ca 0.36 -0.05 -0.03 0.00 -0.00 0.00 0.00 57.88 58.16 1h64 h LEU 6 Cb 0.61 -0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 41.20 1h64 h LEU 6 CO -0.99 0.41 0.13 0.44 -0.00 0.00 0.00 178.44 178.43 1h64 h ASP 7 N 0.20 0.53 -0.13 -0.43 3.32 -1.28 -0.59 116.42 118.04 1h64 h ASP 7 Ca 0.04 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1h64 h ASP 7 Cb 0.45 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1h64 h ASP 7 CO 0.03 0.58 0.08 0.58 -1.72 0.00 0.00 179.24 178.79 1h64 h VAL 8 N 0.46 1.02 -0.74 -1.35 2.07 -1.20 -0.65 116.25 115.86 1h64 h VAL 8 Ca 0.12 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1h64 h VAL 8 Cb 0.23 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 1h64 h VAL 8 CO -0.01 0.03 0.48 0.40 0.02 0.00 0.00 177.57 178.50 1h64 h ILE 9 N 0.16 1.17 -0.83 4.57 1.08 -1.32 -2.48 117.51 119.85 1h64 h ILE 9 Ca 0.05 -0.33 -0.03 0.00 -0.39 0.00 0.00 64.86 64.15 1h64 h ILE 9 Cb -0.01 0.11 -0.04 0.00 -3.07 0.00 0.00 36.82 33.81 1h64 h ILE 9 CO -0.02 0.18 0.40 -0.74 -0.69 0.00 0.00 178.15 177.28 1h64 h HIS 10 N 0.97 1.20 0.00 1.37 2.76 -0.67 -1.96 115.15 118.82 1h64 h HIS 10 Ca 0.28 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 1h64 h HIS 10 Cb -0.08 -0.37 0.00 0.00 1.55 0.00 0.00 27.41 28.51 1h64 h HIS 10 CO -0.03 0.87 0.00 0.00 -1.30 0.00 0.00 177.93 177.47 1h64 h ARG 11 N 1.19 0.00 -0.37 5.26 3.08 -0.70 -3.03 114.38 119.81 1h64 h ARG 11 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1h64 h ARG 11 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1h64 h ARG 11 CO -0.04 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.29 1h64 n SER 12 N -2.55 2.62 -4.75 7.04 7.64 -0.74 -4.93 113.62 117.94 1h64 n SER 12 Ca 0.01 -1.91 -0.40 0.00 1.01 0.00 0.00 58.87 57.58 1h64 n SER 12 Cb 0.24 -0.24 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 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 0.93 4.93 -0.75 -3.43 4.77 -1.15 -1.48 117.00 120.82 1h64 n LEU 13 Ca 0.17 1.12 -0.10 0.00 -0.03 0.00 0.00 56.01 57.18 1h64 n LEU 13 Cb 0.45 -1.59 -0.04 0.00 -2.33 0.00 0.00 43.42 39.91 1h64 n LEU 13 CO 0.13 -0.23 -0.09 0.47 -1.33 0.00 0.00 177.39 176.34 1h64 n ASP 14 N -0.10 -5.12 -4.37 -1.43 8.00 0.25 -4.96 116.55 108.81 1h64 n ASP 14 Ca 0.05 0.24 -0.26 0.00 0.71 0.00 0.00 54.79 55.54 1h64 n ASP 14 Cb 0.41 -3.49 -0.12 0.00 -0.02 0.00 0.00 41.12 37.90 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 -2.66 1.38 0.25 -1.24 1.02 -0.55 -4.85 119.74 113.08 1h64 s LYS 15 Ca 0.00 -1.40 -0.30 0.00 0.02 0.00 0.00 55.97 54.29 1h64 s LYS 15 Cb 0.00 -1.68 -0.09 0.00 -0.52 0.00 0.00 37.83 35.53 1h64 s LYS 15 CO 0.00 0.37 1.33 0.34 -0.92 0.00 0.00 175.35 176.47 1h64 s ASP 16 N -2.39 6.83 0.13 2.83 2.15 -1.26 -0.94 116.67 124.01 1h64 s ASP 16 Ca 0.16 2.53 0.00 0.00 0.43 0.00 0.00 52.55 55.67 1h64 s ASP 16 Cb -0.08 -2.62 -0.04 0.00 -0.30 0.00 0.00 42.92 39.87 1h64 s ASP 16 CO 0.07 -0.55 0.01 0.68 -0.17 0.00 0.00 175.17 175.21 1h64 s VAL 17 N -0.28 0.40 -0.17 1.11 -7.23 0.13 -0.82 120.40 113.54 1h64 s VAL 17 Ca 0.55 -1.92 -0.01 0.00 -1.81 0.00 0.00 61.98 58.78 1h64 s VAL 17 Cb -0.38 -1.94 -0.01 0.00 0.56 0.00 0.00 36.38 34.61 1h64 s VAL 17 CO 0.43 -0.61 -0.10 -0.22 -0.31 0.00 0.00 175.10 174.29 1h64 s LEU 18 N -3.07 2.73 -0.32 1.32 2.96 0.21 -2.35 118.68 120.15 1h64 s LEU 18 Ca 0.20 -0.38 -0.04 0.00 -0.22 0.00 0.00 54.13 53.68 1h64 s LEU 18 Cb 0.07 -1.65 0.05 0.00 0.50 0.00 0.00 46.19 45.16 1h64 s LEU 18 CO -0.00 0.08 0.06 -0.69 -1.32 0.00 0.00 176.35 174.48 1h64 s VAL 19 N 0.87 3.42 -0.19 1.68 1.01 0.80 -0.90 120.40 127.09 1h64 s VAL 19 Ca -0.03 -1.27 -0.20 0.00 0.00 0.00 0.00 61.98 60.48 1h64 s VAL 19 Cb -0.15 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 1h64 s VAL 19 CO 0.00 -0.16 0.59 -0.63 0.00 0.00 0.00 175.10 174.90 1h64 s ILE 20 N 1.33 5.05 0.35 2.22 1.01 0.25 -0.84 121.20 130.57 1h64 s ILE 20 Ca -0.03 1.12 0.03 0.00 0.00 0.00 0.00 60.65 61.77 1h64 s ILE 20 Cb -0.20 -3.91 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1h64 s ILE 20 CO 0.01 0.14 0.52 -0.76 0.00 0.00 0.00 174.94 174.85 1h64 s LEU 21 N 1.76 3.97 0.00 2.97 1.43 0.03 -0.29 118.68 128.56 1h64 s LEU 21 Ca 0.27 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.54 1h64 s LEU 21 Cb -0.16 -3.04 0.00 0.00 0.03 0.00 0.00 46.19 43.02 1h64 s LEU 21 CO 0.10 -0.39 0.52 0.29 0.23 0.00 0.00 176.35 177.11 1h64 n LYS 22 N -1.75 0.34 0.00 1.70 5.02 -1.09 -3.14 118.16 119.24 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 0.57 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 34.25 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 1.38 0.00 -1.87 1.97 4.76 -1.26 -4.96 118.16 118.19 1h64 n LYS 23 Ca 0.00 -0.30 -0.10 0.00 -2.87 0.00 0.00 58.31 55.04 1h64 n LYS 23 Cb 0.17 -0.39 -0.02 0.00 -1.84 0.00 0.00 35.03 32.95 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 0.00 0.39 3.29 0.72 0.00 -1.19 -4.99 105.19 103.41 1h64 n GLY 24 Ca 0.00 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.45 2.24 0.16 1.61 5.36 -1.26 -4.21 117.98 119.43 1h64 s PHE 25 Ca 0.00 -0.43 -0.10 0.00 -0.96 0.00 0.00 56.93 55.44 1h64 s PHE 25 Cb 0.00 -1.44 -0.01 0.00 -0.34 0.00 0.00 43.02 41.23 1h64 s PHE 25 CO 0.00 -0.04 0.30 -1.83 -1.46 0.00 0.00 175.22 172.19 1h64 s GLU 26 N -0.57 1.17 0.08 10.12 -1.05 -0.46 -0.79 118.70 127.20 1h64 s GLU 26 Ca 0.09 -1.14 0.09 0.00 -0.15 0.00 0.00 54.97 53.85 1h64 s GLU 26 Cb -0.10 0.39 -0.03 0.00 -0.44 0.00 0.00 34.13 33.95 1h64 s GLU 26 CO -0.01 -0.43 -0.23 -0.06 0.95 0.00 0.00 175.26 175.48 1h64 s PHE 27 N -3.96 1.96 -0.01 4.83 0.40 -0.02 0.50 117.98 121.68 1h64 s PHE 27 Ca 0.16 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 56.11 1h64 s PHE 27 Cb 0.03 -1.11 0.00 0.00 0.51 0.00 0.00 43.02 42.45 1h64 s PHE 27 CO -0.01 0.18 -0.03 1.03 0.70 0.00 0.00 175.22 177.09 1h64 s ARG 28 N -1.61 0.38 -0.07 0.44 0.52 -0.80 -0.14 118.95 117.67 1h64 s ARG 28 Ca 0.09 -0.10 -0.21 0.00 -0.52 0.00 0.00 55.73 54.99 1h64 s ARG 28 Cb -0.10 -0.40 0.07 0.00 0.52 0.00 0.00 34.95 35.04 1h64 s ARG 28 CO 0.03 0.03 0.93 0.41 0.02 0.00 0.00 175.30 176.73 1h64 n GLY 29 N 3.29 0.18 3.66 -3.53 0.00 -0.99 -1.66 105.19 106.14 1h64 n GLY 29 Ca -0.17 -0.94 -0.39 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.00 4.20 -0.12 1.61 3.52 -0.55 -0.70 118.95 124.92 1h64 s ARG 30 Ca 0.22 0.49 -0.29 0.00 -0.13 0.00 0.00 55.73 56.02 1h64 s ARG 30 Cb -0.00 -3.56 -0.03 0.00 -1.56 0.00 0.00 34.95 29.79 1h64 s ARG 30 CO -0.02 -0.17 1.46 -1.17 -0.81 0.00 0.00 175.30 174.59 1h64 s LEU 31 N 1.70 4.23 0.00 -0.88 2.96 -0.12 -0.42 118.68 126.15 1h64 s LEU 31 Ca 0.26 1.94 0.03 0.00 -0.22 0.00 0.00 54.13 56.14 1h64 s LEU 31 Cb -0.16 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.98 1h64 s LEU 31 CO 0.10 -0.86 0.20 2.30 -1.32 0.00 0.00 176.35 176.77 1h64 n ILE 32 N 5.47 0.00 -3.63 6.68 -5.35 -0.18 0.86 119.36 123.20 1h64 n ILE 32 Ca 0.16 -0.45 -0.04 0.00 -0.27 0.00 0.00 62.75 62.15 1h64 n ILE 32 Cb 0.44 1.01 -0.02 0.00 -1.74 0.00 0.00 39.64 39.33 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 -1.08 -0.35 0.07 3.28 0.00 -1.19 -4.90 107.32 103.15 1h64 s GLY 33 Ca 0.01 0.70 -0.27 0.00 0.00 0.00 0.00 44.72 45.16 1h64 s GLY 33 CO 0.10 0.20 1.07 -2.52 0.00 0.00 0.00 173.10 171.95 1h64 s TYR 34 N -2.98 -0.12 0.33 1.90 -0.85 -1.26 -1.26 117.35 113.11 1h64 s TYR 34 Ca 0.10 -0.10 0.06 0.00 -0.52 0.00 0.00 57.07 56.61 1h64 s TYR 34 Cb -0.00 0.60 -0.03 0.00 0.38 0.00 0.00 41.96 42.90 1h64 s TYR 34 CO -0.03 -0.60 0.24 0.16 -1.52 0.00 0.00 175.55 173.79 1h64 s ASP 35 N -2.89 1.73 0.35 -0.18 1.47 -0.89 -4.99 116.67 111.27 1h64 s ASP 35 Ca 0.12 -1.71 0.25 0.00 1.18 0.00 0.00 52.55 52.39 1h64 s ASP 35 Cb 0.01 0.53 1.25 0.00 -0.34 0.00 0.00 42.92 44.37 1h64 s ASP 35 CO -0.01 -1.02 1.76 -0.29 0.68 0.00 0.00 175.17 176.29 1h64 h ILE 36 N 2.12 0.00 -0.12 2.11 6.09 -2.03 -0.95 117.51 124.73 1h64 h ILE 36 Ca -0.28 -0.08 0.00 0.00 -1.37 0.00 0.00 64.86 63.13 1h64 h ILE 36 Cb 1.24 0.70 0.00 0.00 0.47 0.00 0.00 36.82 39.23 1h64 h ILE 36 CO 0.41 0.00 0.00 1.41 -3.07 0.00 0.00 178.15 176.90 1h64 n HIS 37 N -2.37 0.14 -1.82 2.19 8.25 -1.26 -4.91 115.22 115.45 1h64 n HIS 37 Ca -0.01 -0.07 -0.10 0.00 -0.26 0.00 0.00 57.72 57.29 1h64 n HIS 37 Cb 0.10 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.19 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 0.45 -1.14 -4.76 2.41 4.77 -0.36 -4.44 117.00 113.93 1h64 n LEU 38 Ca 0.17 0.09 -0.40 0.00 -0.03 0.00 0.00 56.01 55.85 1h64 n LEU 38 Cb 0.38 -1.60 -0.05 0.00 -2.33 0.00 0.00 43.42 39.82 1h64 n LEU 38 CO 0.15 -0.26 0.72 0.20 -1.33 0.00 0.00 177.39 176.87 1h64 s ASN 39 N -2.70 7.40 0.16 -1.43 0.01 -1.26 -3.50 114.94 113.62 1h64 s ASN 39 Ca 0.00 2.09 0.05 0.00 -0.71 0.00 0.00 52.86 54.30 1h64 s ASN 39 Cb 0.00 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 39.00 1h64 s ASN 39 CO 0.00 -0.03 -0.12 0.68 -1.51 0.00 0.00 177.10 176.12 1h64 s VAL 40 N -1.23 1.34 -0.11 1.60 -7.23 -0.39 -2.09 120.40 112.28 1h64 s VAL 40 Ca 0.44 -2.06 0.03 0.00 -1.81 0.00 0.00 61.98 58.57 1h64 s VAL 40 Cb -0.28 -1.86 0.01 0.00 0.56 0.00 0.00 36.38 34.81 1h64 s VAL 40 CO 0.35 -0.67 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.59 1h64 s VAL 41 N -3.10 1.74 0.12 1.32 1.01 -0.39 -0.53 120.40 120.57 1h64 s VAL 41 Ca 0.17 -0.80 0.10 0.00 0.00 0.00 0.00 61.98 61.45 1h64 s VAL 41 Cb 0.01 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 1h64 s VAL 41 CO 0.02 0.49 -0.23 -0.76 0.00 0.00 0.00 175.10 174.62 1h64 s LEU 42 N 0.72 2.49 0.10 3.92 1.43 -0.25 -1.01 118.68 126.08 1h64 s LEU 42 Ca -0.11 -0.66 0.07 0.00 -1.03 0.00 0.00 54.13 52.40 1h64 s LEU 42 Cb -0.16 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1h64 s LEU 42 CO 0.02 0.18 -0.13 0.00 0.23 0.00 0.00 176.35 176.66 1h64 s ALA 43 N -1.09 2.86 -1.22 4.21 0.00 0.44 -0.76 121.76 126.20 1h64 s ALA 43 Ca 0.16 -1.26 -0.15 0.00 0.00 0.00 0.00 51.96 50.70 1h64 s ALA 43 Cb -0.10 -0.83 -0.00 0.00 0.00 0.00 0.00 23.12 22.19 1h64 s ALA 43 CO 0.08 0.62 0.68 -0.25 0.00 0.00 0.00 175.76 176.89 1h64 n ASP 44 N 0.81 -3.69 -4.94 0.00 8.00 0.12 -1.48 116.55 115.38 1h64 n ASP 44 Ca -0.14 -1.03 -0.24 0.00 0.71 0.00 0.00 54.79 54.09 1h64 n ASP 44 Cb 0.52 -3.18 -0.01 0.00 -0.02 0.00 0.00 41.12 38.43 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 -3.62 3.70 -0.01 2.24 0.00 0.12 -4.53 121.76 119.67 1h64 s ALA 45 Ca 0.33 -0.90 -0.00 0.00 0.00 0.00 0.00 51.96 51.38 1h64 s ALA 45 Cb -0.12 -2.10 0.01 0.00 0.00 0.00 0.00 23.12 20.90 1h64 s ALA 45 CO 0.88 0.01 0.02 -1.83 0.00 0.00 0.00 175.76 174.83 1h64 s GLU 46 N -4.25 0.00 -0.16 0.00 -1.05 -0.66 0.23 118.70 112.81 1h64 s GLU 46 Ca 0.40 0.06 -0.19 0.00 -0.15 0.00 0.00 54.97 55.09 1h64 s GLU 46 Cb -0.10 -0.05 -0.04 0.00 -0.44 0.00 0.00 34.13 33.50 1h64 s GLU 46 CO 0.35 -0.04 0.52 1.41 0.95 0.00 0.00 175.26 178.45 1h64 s MET 47 N 0.26 4.27 -0.15 -4.83 -2.45 -0.15 -1.91 119.30 114.35 1h64 s MET 47 Ca -0.02 0.47 -0.03 0.00 -1.25 0.00 0.00 55.69 54.86 1h64 s MET 47 Cb -0.03 -3.50 -0.03 0.00 1.25 0.00 0.00 34.83 32.52 1h64 s MET 47 CO -0.01 -0.02 -0.05 0.42 1.05 0.00 0.00 175.02 176.42 1h64 s ILE 48 N 1.19 3.82 -0.14 10.11 -1.09 0.18 -1.04 121.20 134.24 1h64 s ILE 48 Ca 0.26 -0.39 -0.01 0.00 -2.23 0.00 0.00 60.65 58.29 1h64 s ILE 48 Cb -0.15 -2.67 0.03 0.00 -1.58 0.00 0.00 42.46 38.09 1h64 s ILE 48 CO 0.10 0.50 -0.06 -1.58 -1.23 0.00 0.00 174.94 172.67 1h64 s GLN 49 N 0.35 1.42 -1.52 2.79 0.74 -0.11 -1.35 119.66 121.98 1h64 s GLN 49 Ca -0.05 -0.37 -0.13 0.00 0.05 0.00 0.00 55.36 54.86 1h64 s GLN 49 Cb -0.14 -1.78 0.08 0.00 1.10 0.00 0.00 33.01 32.27 1h64 s GLN 49 CO 0.03 -0.36 0.95 -0.25 -0.55 0.00 0.00 175.29 175.11 1h64 n ASP 50 N 4.92 -4.89 0.00 6.67 9.92 -1.26 -1.89 116.55 130.01 1h64 n ASP 50 Ca -0.12 -0.73 0.00 0.00 -0.53 0.00 0.00 54.79 53.42 1h64 n ASP 50 Cb 0.49 -3.91 0.00 0.00 -0.64 0.00 0.00 41.12 37.06 1h64 n ASP 50 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1h64 n GLY 51 N -1.67 1.45 3.39 0.44 0.00 -1.26 -5.06 105.19 102.49 1h64 n GLY 51 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1h64 n GLY 51 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1h64 s GLU 52 N -0.52 1.43 -0.12 1.61 -1.05 -0.79 -5.08 118.70 114.18 1h64 s GLU 52 Ca 0.00 -1.43 -0.29 0.00 -0.15 0.00 0.00 54.97 53.09 1h64 s GLU 52 Cb 0.00 -1.77 -0.03 0.00 -0.44 0.00 0.00 34.13 31.89 1h64 s GLU 52 CO 0.00 0.39 1.31 0.08 0.95 0.00 0.00 175.26 178.00 1h64 s VAL 53 N -1.49 4.15 -0.19 1.83 1.01 -1.26 -0.93 120.40 123.51 1h64 s VAL 53 Ca 0.17 1.42 0.03 0.00 0.00 0.00 0.00 61.98 63.59 1h64 s VAL 53 Cb -0.08 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1h64 s VAL 53 CO 0.08 -0.10 0.23 1.33 0.00 0.00 0.00 175.10 176.64 1h64 n VAL 54 N 5.21 0.00 -3.47 2.92 0.24 -0.20 -4.98 118.33 118.05 1h64 n VAL 54 Ca 0.14 -0.45 -0.15 0.00 -2.04 0.00 0.00 64.34 61.84 1h64 n VAL 54 Cb 0.45 1.01 -0.04 0.00 -1.47 0.00 0.00 33.84 33.79 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 -1.04 1.15 0.03 7.34 -0.14 -1.24 -4.97 119.74 120.87 1h64 s LYS 55 Ca 0.02 -0.11 0.02 0.00 -1.36 0.00 0.00 55.97 54.53 1h64 s LYS 55 Cb 0.02 0.54 -0.02 0.00 -1.68 0.00 0.00 37.83 36.69 1h64 s LYS 55 CO 0.10 -0.44 -0.06 1.03 -0.76 0.00 0.00 175.35 175.22 1h64 s ARG 56 N -2.48 0.45 -0.00 1.68 0.52 -1.26 -0.97 118.95 116.88 1h64 s ARG 56 Ca -0.05 -0.58 0.00 0.00 -0.52 0.00 0.00 55.73 54.58 1h64 s ARG 56 Cb -0.01 -0.25 0.00 0.00 0.52 0.00 0.00 34.95 35.22 1h64 s ARG 56 CO -0.02 0.05 0.00 0.71 0.02 0.00 0.00 175.30 176.06 1h64 s TYR 57 N -1.06 0.03 0.21 -0.53 1.51 0.14 -4.96 117.35 112.69 1h64 s TYR 57 Ca -0.08 0.01 -0.06 0.00 -1.01 0.00 0.00 57.07 55.93 1h64 s TYR 57 Cb -0.08 -0.06 0.16 0.00 -0.11 0.00 0.00 41.96 41.88 1h64 s TYR 57 CO 0.00 -0.02 1.68 0.78 -1.11 0.00 0.00 175.55 176.89 1h64 h GLY 58 N 6.33 1.05 -5.23 0.71 0.00 -1.94 0.34 103.07 104.33 1h64 h GLY 58 Ca -0.28 -0.75 -0.08 0.00 0.00 0.00 0.00 47.33 46.22 1h64 h GLY 58 CO 0.50 0.69 -0.12 1.25 0.00 0.00 0.00 176.54 178.87 1h64 s LYS 59 N -5.00 0.59 -0.04 4.80 2.20 -1.26 0.16 119.74 121.19 1h64 s LYS 59 Ca -0.11 0.84 -0.02 0.00 -0.36 0.00 0.00 55.97 56.32 1h64 s LYS 59 Cb 0.14 0.20 0.02 0.00 -1.51 0.00 0.00 37.83 36.68 1h64 s LYS 59 CO 0.84 -0.11 0.09 -1.50 -0.36 0.00 0.00 175.35 174.31 1h64 s ILE 60 N 0.77 -0.02 -0.29 5.43 2.07 0.06 -4.99 121.20 124.23 1h64 s ILE 60 Ca -0.04 0.08 -0.11 0.00 -1.41 0.00 0.00 60.65 59.17 1h64 s ILE 60 Cb -0.05 -0.14 -0.04 0.00 0.13 0.00 0.00 42.46 42.35 1h64 s ILE 60 CO -0.06 0.03 0.19 -0.69 -1.91 0.00 0.00 174.94 172.50 1h64 s VAL 61 N 0.47 5.22 -0.17 4.00 1.01 -1.26 -1.09 120.40 128.58 1h64 s VAL 61 Ca -0.04 0.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.98 1h64 s VAL 61 Cb -0.05 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 1h64 s VAL 61 CO -0.02 0.22 0.01 -0.63 0.00 0.00 0.00 175.10 174.68 1h64 s ILE 62 N 1.74 4.22 0.06 2.22 1.01 0.31 -4.98 121.20 125.78 1h64 s ILE 62 Ca 0.07 -0.23 -0.30 0.00 0.00 0.00 0.00 60.65 60.18 1h64 s ILE 62 Cb -0.16 -2.88 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 1h64 s ILE 62 CO 0.10 0.47 1.00 -0.13 0.00 0.00 0.00 174.94 176.38 1h64 s ARG 63 N 0.50 4.61 0.57 2.79 0.52 -1.26 -1.26 118.95 125.41 1h64 s ARG 63 Ca -0.01 1.48 0.25 0.00 -0.52 0.00 0.00 55.73 56.93 1h64 s ARG 63 Cb -0.14 -3.41 1.60 0.00 0.52 0.00 0.00 34.95 33.53 1h64 s ARG 63 CO 0.02 0.05 2.19 0.78 0.02 0.00 0.00 175.30 178.35 1h64 h GLY 64 N 6.20 0.00 2.00 -3.53 0.00 -1.77 -2.82 103.07 103.14 1h64 h GLY 64 Ca -0.42 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1h64 h GLY 64 CO 0.74 0.00 -0.00 -1.80 0.00 0.00 0.00 176.54 175.48 1h64 h ASP 65 N 0.00 0.00 0.21 0.19 1.82 -1.88 -0.53 116.42 116.23 1h64 h ASP 65 Ca 0.03 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 1h64 h ASP 65 Cb 0.13 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.14 1h64 h ASP 65 CO -0.00 0.00 -0.55 0.59 -1.61 0.00 0.00 179.24 177.68 1h64 n ASN 66 N -3.28 1.05 -4.73 2.28 3.02 -1.06 -4.95 115.26 107.59 1h64 n ASN 66 Ca -0.03 -0.84 -0.40 0.00 -0.03 0.00 0.00 54.58 53.28 1h64 n ASN 66 Cb 0.09 0.44 -0.04 0.00 -0.61 0.00 0.00 39.78 39.65 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 -2.77 4.84 -0.19 2.41 1.01 -0.21 -2.66 120.40 122.83 1h64 s VAL 67 Ca 0.15 1.73 -0.19 0.00 0.00 0.00 0.00 61.98 63.67 1h64 s VAL 67 Cb 0.18 -4.17 -0.21 0.00 0.00 0.00 0.00 36.38 32.18 1h64 s VAL 67 CO 0.67 0.28 0.26 0.25 0.00 0.00 0.00 175.10 176.56 1h64 h LEU 68 N 6.26 0.10 -7.23 3.92 5.85 -0.92 -3.46 115.31 119.82 1h64 h LEU 68 Ca -0.42 -0.61 -0.00 0.00 0.84 0.00 0.00 57.88 57.68 1h64 h LEU 68 Cb 1.21 -0.03 -0.11 0.00 0.37 0.00 0.00 40.66 42.10 1h64 h LEU 68 CO 0.73 1.57 0.19 0.00 -0.34 0.00 0.00 178.44 180.59 1h64 s ALA 69 N -2.40 -1.47 -0.03 1.25 0.00 -1.03 -5.02 121.76 113.05 1h64 s ALA 69 Ca -0.27 0.28 0.02 0.00 0.00 0.00 0.00 51.96 51.99 1h64 s ALA 69 Cb 0.06 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.06 1h64 s ALA 69 CO 0.63 -0.82 -0.06 0.42 0.00 0.00 0.00 175.76 175.94 1h64 s ILE 70 N -3.79 0.60 -0.09 0.00 1.01 -1.26 -0.58 121.20 117.10 1h64 s ILE 70 Ca 0.03 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1h64 s ILE 70 Cb -0.02 -0.57 0.02 0.00 0.01 0.00 0.00 42.46 41.90 1h64 s ILE 70 CO -0.09 0.21 -0.08 -0.55 0.00 0.00 0.00 174.94 174.44 1h64 s SER 71 N 0.47 1.82 0.29 3.58 0.15 -0.08 -4.98 113.70 114.96 1h64 s SER 71 Ca -0.07 -0.25 -0.29 0.00 0.70 0.00 0.00 55.95 56.04 1h64 s SER 71 Cb -0.10 -0.74 -0.10 0.00 -1.71 0.00 0.00 66.02 63.37 1h64 s SER 71 CO 0.00 -0.08 1.27 -2.16 1.20 0.00 0.00 173.24 173.47 1h64 s PRO 72 N 1.33 4.42 0.00 5.44 0.04 -1.26 -0.62 135.00 144.35 1h64 s PRO 72 Ca -0.03 2.09 0.24 0.00 0.04 0.00 0.00 61.00 63.34 1h64 s PRO 72 Cb -0.14 -3.12 0.19 0.00 0.04 0.00 0.00 34.50 31.47 1h64 s PRO 72 CO -0.03 -0.12 1.25 2.41 0.04 0.00 0.00 177.00 180.55