#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x68 s SER 2 N 0.00 4.35 0.23 1.61 0.15 -1.26 -5.16 113.70 113.62 1x68 s SER 2 Ca 0.00 -0.92 -0.22 0.00 0.70 0.00 0.00 55.95 55.51 1x68 s SER 2 Cb 0.00 -0.60 0.04 0.00 -1.71 0.00 0.00 66.02 63.75 1x68 s SER 2 CO 0.00 -0.26 0.77 -0.55 1.20 0.00 0.00 173.24 174.40 1x68 s SER 3 N -3.76 -0.27 0.00 5.45 0.15 -1.26 -5.11 113.70 108.90 1x68 s SER 3 Ca 0.36 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1x68 s SER 3 Cb -0.01 0.65 0.00 0.00 -1.71 0.00 0.00 66.02 64.95 1x68 s SER 3 CO 0.20 -1.18 0.00 0.61 1.20 0.00 0.00 173.24 174.07 1x68 n GLY 4 N -0.45 -0.87 2.97 9.45 0.00 -1.26 -5.15 105.19 109.88 1x68 n GLY 4 Ca -0.06 0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1x68 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x68 s SER 5 N 0.00 3.03 -0.92 1.61 0.01 -1.26 -5.07 113.70 111.11 1x68 s SER 5 Ca 0.00 -0.71 -0.25 0.00 1.31 0.00 0.00 55.95 56.30 1x68 s SER 5 Cb 0.00 -1.13 -0.08 0.00 0.21 0.00 0.00 66.02 65.03 1x68 s SER 5 CO 0.00 -0.13 2.05 -0.44 0.41 0.00 0.00 173.24 175.13 1x68 s SER 6 N 1.49 4.80 0.00 2.44 0.01 -1.26 -4.68 113.70 116.50 1x68 s SER 6 Ca 0.01 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.62 1x68 s SER 6 Cb -0.15 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.52 1x68 s SER 6 CO -0.09 -3.10 0.00 0.61 0.41 0.00 0.00 173.24 171.07 1x68 n GLY 7 N 6.70 -0.97 3.69 3.44 0.00 -1.26 -4.59 105.19 112.20 1x68 n GLY 7 Ca 0.42 -0.88 -0.44 0.00 0.00 0.00 0.00 46.02 45.12 1x68 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x68 h VAL 9 N 4.59 0.00 -0.32 0.00 2.07 -1.49 0.26 116.25 121.36 1x68 h VAL 9 Ca -0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1x68 h VAL 9 Cb 1.23 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1x68 h VAL 9 CO 0.94 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.53 1x68 n ALA 10 N -1.83 2.19 -1.39 1.67 0.00 -1.26 -4.75 120.51 115.14 1x68 n ALA 10 Ca -0.02 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.31 1x68 n ALA 10 Cb 0.16 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.18 1x68 n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x68 n SER 12 N 0.00 -0.34 -4.86 0.00 2.88 0.75 -4.87 113.62 107.17 1x68 n SER 12 Ca 0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 1x68 n SER 12 Cb 0.11 -2.29 -0.02 0.00 -0.75 0.00 0.00 64.21 61.26 1x68 n SER 12 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1x68 s LYS 13 N -0.95 3.78 -0.09 -1.46 1.02 -1.26 -4.43 119.74 116.35 1x68 s LYS 13 Ca 0.00 0.69 -0.30 0.00 0.02 0.00 0.00 55.97 56.38 1x68 s LYS 13 Cb 0.00 -2.22 -0.03 0.00 -0.52 0.00 0.00 37.83 35.06 1x68 s LYS 13 CO 0.00 -0.26 1.28 -1.25 -0.92 0.00 0.00 175.35 174.20 1x68 s PRO 14 N -4.33 4.28 0.50 -1.68 0.04 -1.26 -0.61 135.00 131.94 1x68 s PRO 14 Ca 0.55 1.74 -0.19 0.00 0.04 0.00 0.00 61.00 63.13 1x68 s PRO 14 Cb -0.10 -3.67 -0.08 0.00 0.04 0.00 0.00 34.50 30.69 1x68 s PRO 14 CO 0.38 -0.59 1.02 0.42 0.04 0.00 0.00 177.00 178.27 1x68 s ILE 15 N 2.86 3.98 0.32 0.56 1.01 -1.26 -4.93 121.20 123.75 1x68 s ILE 15 Ca 0.57 1.15 -0.29 0.00 0.00 0.00 0.00 60.65 62.09 1x68 s ILE 15 Cb -0.25 -3.49 -0.10 0.00 0.01 0.00 0.00 42.46 38.62 1x68 s ILE 15 CO 0.20 -0.35 1.34 -0.55 0.00 0.00 0.00 174.94 175.58 1x68 s SER 16 N -2.27 6.72 1.18 3.58 0.15 -1.26 -5.01 113.70 116.79 1x68 s SER 16 Ca 0.65 2.72 -0.13 0.00 0.70 0.00 0.00 55.95 59.88 1x68 s SER 16 Cb -0.14 -2.65 0.20 0.00 -1.71 0.00 0.00 66.02 61.72 1x68 s SER 16 CO 0.23 -0.59 0.66 0.61 1.20 0.00 0.00 173.24 175.35 1x68 n GLY 17 N 0.95 -2.82 1.75 9.45 0.00 -1.26 -4.78 105.19 108.48 1x68 n GLY 17 Ca 0.01 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1x68 n GLY 17 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1x68 n LEU 18 N 0.00 0.51 -2.19 0.99 -0.00 -1.26 -3.91 117.00 111.14 1x68 n LEU 18 Ca 0.09 -0.23 -0.25 0.00 -0.00 0.00 0.00 56.01 55.62 1x68 n LEU 18 Cb 0.37 -0.10 0.15 0.00 -0.00 0.00 0.00 43.42 43.83 1x68 n LEU 18 CO 0.25 0.09 1.29 1.07 -0.00 0.00 0.00 177.39 180.09 1x68 n THR 19 N 1.74 3.19 -1.44 1.47 5.66 -1.26 -4.78 114.28 118.87 1x68 n THR 19 Ca 0.00 -2.03 0.00 0.00 -3.05 0.00 0.00 64.05 58.97 1x68 n THR 19 Cb 0.05 -0.64 0.00 0.00 -1.55 0.00 0.00 70.33 68.19 1x68 n THR 19 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1x68 n GLY 20 N -1.01 0.98 3.43 1.09 0.00 -1.26 -5.06 105.19 103.37 1x68 n GLY 20 Ca 0.58 -0.42 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1x68 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x68 s ALA 21 N -2.52 3.50 -0.26 4.61 0.00 -1.25 -5.05 121.76 120.79 1x68 s ALA 21 Ca 0.00 -1.85 -0.28 0.00 0.00 0.00 0.00 51.96 49.82 1x68 s ALA 21 Cb 0.00 -3.04 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1x68 s ALA 21 CO 0.00 -1.64 1.96 0.21 0.00 0.00 0.00 175.76 176.29 1x68 s LYS 22 N 1.83 3.32 0.15 0.00 2.47 -1.26 -4.91 119.74 121.33 1x68 s LYS 22 Ca 0.07 1.74 0.00 0.00 -1.56 0.00 0.00 55.97 56.22 1x68 s LYS 22 Cb -0.21 -4.25 -0.04 0.00 -1.46 0.00 0.00 37.83 31.86 1x68 s LYS 22 CO 0.09 -1.88 0.03 -0.59 0.16 0.00 0.00 175.35 173.16 1x68 s PHE 23 N 7.23 1.02 -0.01 4.03 -0.12 -1.26 -3.57 117.98 125.30 1x68 s PHE 23 Ca 0.88 -1.12 0.07 0.00 -0.05 0.00 0.00 56.93 56.71 1x68 s PHE 23 Cb -0.28 -0.58 -0.02 0.00 -0.63 0.00 0.00 43.02 41.51 1x68 s PHE 23 CO 0.34 -0.36 -0.22 0.42 -0.05 0.00 0.00 175.22 175.36 1x68 s ILE 24 N -3.85 1.72 -0.04 -4.49 -1.09 0.07 -4.92 121.20 108.61 1x68 s ILE 24 Ca 0.23 -0.96 0.02 0.00 -2.23 0.00 0.00 60.65 57.71 1x68 s ILE 24 Cb 0.07 -1.44 0.01 0.00 -1.58 0.00 0.00 42.46 39.52 1x68 s ILE 24 CO 0.02 0.46 -0.09 0.00 -1.23 0.00 0.00 174.94 174.10 1x68 s PHE 26 N 0.46 -0.30 -0.92 0.00 5.36 -1.26 -4.94 117.98 116.39 1x68 s PHE 26 Ca -0.08 -0.17 -0.05 0.00 -0.96 0.00 0.00 56.93 55.67 1x68 s PHE 26 Cb -0.12 -0.50 -0.03 0.00 -0.34 0.00 0.00 43.02 42.03 1x68 s PHE 26 CO 0.01 -0.82 0.80 0.94 -1.46 0.00 0.00 175.22 174.69 1x68 n GLN 27 N 5.30 -1.69 -3.78 10.12 0.00 -1.26 -3.86 117.38 122.21 1x68 n GLN 27 Ca -0.04 1.07 -0.28 0.00 -0.00 0.00 0.00 57.00 57.75 1x68 n GLN 27 Cb 0.46 -5.37 0.01 0.00 0.00 0.00 0.00 30.24 25.34 1x68 n GLN 27 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1x68 n ASP 28 N -2.52 -4.98 -4.25 1.69 2.03 -1.26 -5.03 116.55 102.22 1x68 n ASP 28 Ca -0.06 -0.97 -0.14 0.00 0.52 0.00 0.00 54.79 54.14 1x68 n ASP 28 Cb 0.57 -2.08 -0.10 0.00 -0.72 0.00 0.00 41.12 38.79 1x68 n ASP 28 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1x68 s SER 29 N -3.13 1.16 -0.09 1.67 1.04 -1.25 -5.17 113.70 107.93 1x68 s SER 29 Ca 0.13 -1.22 -0.03 0.00 0.48 0.00 0.00 55.95 55.31 1x68 s SER 29 Cb -0.07 0.14 0.05 0.00 0.10 0.00 0.00 66.02 66.24 1x68 s SER 29 CO 0.90 -0.61 0.14 -1.10 0.98 0.00 0.00 173.24 173.55 1x68 s GLN 30 N -3.95 0.03 -0.05 4.02 -1.52 -1.26 -4.12 119.66 112.81 1x68 s GLN 30 Ca 0.27 0.43 0.02 0.00 -1.95 0.00 0.00 55.36 54.13 1x68 s GLN 30 Cb 0.06 -0.57 0.01 0.00 -0.22 0.00 0.00 33.01 32.30 1x68 s GLN 30 CO 0.06 -0.38 -0.09 -1.58 -0.25 0.00 0.00 175.29 173.05 1x68 s TRP 31 N 2.26 1.08 0.70 0.91 0.51 0.02 -1.26 118.94 123.16 1x68 s TRP 31 Ca 0.04 -0.34 -0.15 0.00 -2.12 0.00 0.00 56.10 53.53 1x68 s TRP 31 Cb -0.13 -0.82 0.02 0.00 -0.81 0.00 0.00 33.47 31.73 1x68 s TRP 31 CO -0.06 -0.20 1.15 -1.01 -0.51 0.00 0.00 176.95 176.32 1x68 s HIS 32 N 0.60 2.35 0.25 -1.98 3.76 -1.26 -0.75 115.29 118.26 1x68 s HIS 32 Ca -0.10 1.58 -0.04 0.00 -0.15 0.00 0.00 55.06 56.35 1x68 s HIS 32 Cb -0.13 -3.29 0.44 0.00 1.11 0.00 0.00 32.58 30.71 1x68 s HIS 32 CO 0.02 -2.10 1.76 0.66 -0.85 0.00 0.00 174.74 174.23 1x68 h SER 33 N -0.20 0.46 0.22 1.40 4.64 -1.91 0.11 113.55 118.26 1x68 h SER 33 Ca -0.47 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1x68 h SER 33 Cb 1.27 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1x68 h SER 33 CO 0.52 0.22 0.00 -1.84 -0.87 0.00 0.00 176.83 174.86 1x68 n GLU 34 N -4.89 0.61 -0.08 4.77 0.28 -1.26 -3.45 120.64 116.61 1x68 n GLU 34 Ca 0.14 0.02 0.08 0.00 -0.16 0.00 0.00 57.16 57.25 1x68 n GLU 34 Cb 0.37 -1.50 0.11 0.00 1.43 0.00 0.00 31.44 31.85 1x68 n GLU 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1x68 s PHE 36 N -2.49 3.57 0.07 0.00 5.36 -1.13 -4.65 117.98 118.73 1x68 s PHE 36 Ca 0.26 -2.35 -0.04 0.00 -0.96 0.00 0.00 56.93 53.84 1x68 s PHE 36 Cb 0.23 -3.25 -0.03 0.00 -0.34 0.00 0.00 43.02 39.63 1x68 s PHE 36 CO 0.02 -0.97 0.06 -0.80 -1.46 0.00 0.00 175.22 172.07 1x68 s ASN 37 N 1.92 0.34 0.09 6.13 0.01 -1.26 -2.65 114.94 119.52 1x68 s ASN 37 Ca 0.08 -0.89 -0.32 0.00 -0.71 0.00 0.00 52.86 51.02 1x68 s ASN 37 Cb -0.23 0.26 -0.11 0.00 0.41 0.00 0.00 41.25 41.58 1x68 s ASN 37 CO -0.04 -0.66 1.85 0.00 -1.51 0.00 0.00 177.10 176.74 1x68 h GLY 39 N 8.75 0.00 2.00 0.00 0.00 -1.90 0.12 103.07 112.04 1x68 h GLY 39 Ca -0.47 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.69 1x68 h GLY 39 CO 0.94 0.00 -0.81 0.50 0.00 0.00 0.00 176.54 177.17 1x68 h LYS 40 N 0.00 0.00 0.00 4.80 1.57 -1.90 -3.41 116.57 117.63 1x68 h LYS 40 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1x68 h LYS 40 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1x68 h LYS 40 CO 0.02 0.81 0.00 0.00 -0.57 0.00 0.00 179.45 179.71 1x68 n SER 42 N 0.00 -4.23 -3.77 0.00 2.88 0.42 -5.01 113.62 103.91 1x68 n SER 42 Ca 0.00 0.46 -0.13 0.00 -1.33 0.00 0.00 58.87 57.87 1x68 n SER 42 Cb 0.00 -2.62 -0.10 0.00 -0.75 0.00 0.00 64.21 60.74 1x68 n SER 42 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x68 s VAL 43 N -0.83 0.02 0.41 2.46 0.11 -1.26 -4.88 120.40 116.43 1x68 s VAL 43 Ca 0.02 -0.17 -0.26 0.00 -2.93 0.00 0.00 61.98 58.65 1x68 s VAL 43 Cb -0.01 -0.50 -0.09 0.00 -1.53 0.00 0.00 36.38 34.26 1x68 s VAL 43 CO 0.29 -0.09 1.31 -0.55 -3.33 0.00 0.00 175.10 172.73 1x68 s SER 44 N -0.33 6.29 -0.04 3.54 0.15 -1.26 -0.95 113.70 121.10 1x68 s SER 44 Ca -0.05 2.66 0.06 0.00 0.70 0.00 0.00 55.95 59.32 1x68 s SER 44 Cb -0.03 -2.64 0.09 0.00 -1.71 0.00 0.00 66.02 61.73 1x68 s SER 44 CO 0.02 -0.87 1.04 0.18 1.20 0.00 0.00 173.24 174.81 1x68 n LEU 45 N 0.10 2.08 0.03 3.45 4.77 -1.09 -4.77 117.00 121.57 1x68 n LEU 45 Ca 0.04 -2.31 -0.02 0.00 -0.03 0.00 0.00 56.01 53.69 1x68 n LEU 45 Cb 0.44 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.38 1x68 n LEU 45 CO 0.56 0.56 0.08 0.58 -1.33 0.00 0.00 177.39 177.84 1x68 h VAL 46 N 0.07 0.00 0.00 4.08 2.07 -1.87 -3.35 116.25 117.25 1x68 h VAL 46 Ca 0.00 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 66.97 1x68 h VAL 46 Cb 0.67 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1x68 h VAL 46 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 1x68 n GLY 47 N 1.36 -0.38 3.22 2.17 0.00 -1.26 -4.79 105.19 105.50 1x68 n GLY 47 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1x68 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x68 s LYS 48 N -1.81 0.85 0.77 1.61 -2.85 -1.26 -5.16 119.74 111.90 1x68 s LYS 48 Ca 0.00 -0.86 -0.11 0.00 -1.00 0.00 0.00 55.97 54.00 1x68 s LYS 48 Cb 0.00 0.35 0.06 0.00 -2.06 0.00 0.00 37.83 36.18 1x68 s LYS 48 CO 0.00 -0.28 1.10 0.20 0.10 0.00 0.00 175.35 176.47 1x68 s GLY 49 N -2.72 1.76 0.24 0.59 0.00 -1.26 -4.76 107.32 101.18 1x68 s GLY 49 Ca 0.03 0.36 0.03 0.00 0.00 0.00 0.00 44.72 45.13 1x68 s GLY 49 CO -0.10 0.71 0.04 -0.11 0.00 0.00 0.00 173.10 173.64 1x68 s PHE 50 N -2.78 1.55 0.21 1.90 -0.71 -1.26 -4.30 117.98 112.58 1x68 s PHE 50 Ca 0.63 -1.03 0.09 0.00 -1.04 0.00 0.00 56.93 55.57 1x68 s PHE 50 Cb -0.18 -0.91 -0.05 0.00 -1.21 0.00 0.00 43.02 40.66 1x68 s PHE 50 CO 0.54 -0.16 -0.16 -0.51 -1.34 0.00 0.00 175.22 173.59 1x68 s LEU 51 N -3.31 2.54 -0.25 -1.99 1.02 -0.65 -4.91 118.68 111.13 1x68 s LEU 51 Ca 0.32 -0.99 0.01 0.00 0.02 0.00 0.00 54.13 53.48 1x68 s LEU 51 Cb 0.07 -0.77 0.07 0.00 0.02 0.00 0.00 46.19 45.58 1x68 s LEU 51 CO 0.10 -0.11 -0.02 0.42 0.02 0.00 0.00 176.35 176.77 1x68 s THR 52 N -2.71 1.43 0.04 5.49 -4.23 -1.26 -1.59 115.64 112.80 1x68 s THR 52 Ca 0.22 -1.29 -0.04 0.00 -1.18 0.00 0.00 61.69 59.41 1x68 s THR 52 Cb -0.02 -1.79 -0.02 0.00 1.34 0.00 0.00 72.50 72.00 1x68 s THR 52 CO 0.08 -0.23 0.05 -1.58 -0.54 0.00 0.00 174.62 172.40 1x68 s GLN 53 N 1.42 0.55 -1.65 3.99 0.74 -1.18 -4.91 119.66 118.63 1x68 s GLN 53 Ca -0.02 -0.83 -0.15 0.00 0.05 0.00 0.00 55.36 54.41 1x68 s GLN 53 Cb -0.19 0.21 0.13 0.00 1.10 0.00 0.00 33.01 34.26 1x68 s GLN 53 CO -0.09 -0.13 0.76 0.09 -0.55 0.00 0.00 175.29 175.37 1x68 n ASN 54 N 0.75 -3.07 -1.29 6.67 4.13 -1.26 -1.53 115.26 119.66 1x68 n ASN 54 Ca -0.19 -0.99 -0.11 0.00 1.68 0.00 0.00 54.58 54.98 1x68 n ASN 54 Cb 0.58 -2.92 -0.05 0.00 -1.54 0.00 0.00 39.78 35.86 1x68 n ASN 54 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1x68 n LYS 55 N -4.43 -1.27 -4.64 3.52 2.85 -1.26 -4.93 118.16 108.01 1x68 n LYS 55 Ca 0.02 0.66 -0.29 0.00 -1.05 0.00 0.00 58.31 57.64 1x68 n LYS 55 Cb 0.52 -4.85 -0.09 0.00 -0.65 0.00 0.00 35.03 29.97 1x68 n LYS 55 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1x68 s GLU 56 N -2.91 2.03 -0.12 -1.58 2.02 -0.58 -5.16 118.70 112.39 1x68 s GLU 56 Ca 0.00 -2.25 -0.00 0.00 0.02 0.00 0.00 54.97 52.74 1x68 s GLU 56 Cb 0.00 -1.20 -0.02 0.00 0.10 0.00 0.00 34.13 33.01 1x68 s GLU 56 CO 0.00 -0.34 -0.11 0.96 0.02 0.00 0.00 175.26 175.79 1x68 s ILE 57 N -3.00 3.25 0.18 -1.63 -4.36 -1.26 -3.08 121.20 111.29 1x68 s ILE 57 Ca 0.18 -0.60 0.01 0.00 -0.26 0.00 0.00 60.65 59.98 1x68 s ILE 57 Cb 0.04 -2.37 -0.05 0.00 1.25 0.00 0.00 42.46 41.34 1x68 s ILE 57 CO 0.10 0.53 0.03 -0.36 0.24 0.00 0.00 174.94 175.48 1x68 s PHE 58 N 0.16 1.18 0.45 1.37 0.08 -0.62 -3.02 117.98 117.58 1x68 s PHE 58 Ca -0.06 -1.10 -0.09 0.00 0.12 0.00 0.00 56.93 55.80 1x68 s PHE 58 Cb -0.15 -0.67 -0.05 0.00 -0.57 0.00 0.00 43.02 41.58 1x68 s PHE 58 CO 0.04 -0.30 0.80 0.00 -0.10 0.00 0.00 175.22 175.66 1x68 h GLN 60 N 0.82 -0.23 -0.30 0.00 4.20 -1.91 0.67 115.11 118.36 1x68 h GLN 60 Ca -0.47 0.02 0.09 0.00 0.06 0.00 0.00 58.65 58.35 1x68 h GLN 60 Cb 1.19 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 29.01 1x68 h GLN 60 CO 0.63 -0.16 0.31 -0.22 -0.67 0.00 0.00 178.83 178.73 1x68 h LYS 61 N -0.24 0.00 0.00 1.46 3.64 -1.95 0.49 116.57 119.97 1x68 h LYS 61 Ca 0.08 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 1x68 h LYS 61 Cb 0.35 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1x68 h LYS 61 CO -0.22 0.00 -1.86 0.00 -2.27 0.00 0.00 179.45 175.10 1x68 n GLY 63 N 1.37 0.12 3.59 0.00 0.00 0.13 -4.93 105.19 105.47 1x68 n GLY 63 Ca -0.10 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 44.86 1x68 n GLY 63 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x68 s SER 64 N -2.41 5.31 0.00 1.61 0.15 0.01 -4.71 113.70 113.66 1x68 s SER 64 Ca 0.19 1.56 0.00 0.00 0.70 0.00 0.00 55.95 58.40 1x68 s SER 64 Cb 0.18 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 1x68 s SER 64 CO 0.54 -2.13 0.00 0.61 1.20 0.00 0.00 173.24 173.46 1x68 n GLY 65 N 5.76 0.05 0.00 9.45 0.00 -1.26 -5.04 105.19 114.14 1x68 n GLY 65 Ca 0.30 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1x68 n GLY 65 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1x68 n MET 66 N -0.61 0.00 -1.17 1.61 0.00 -1.26 -5.05 117.12 110.64 1x68 n MET 66 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 57.70 57.64 1x68 n MET 66 Cb 0.00 -0.49 -0.03 0.00 0.00 0.00 0.00 33.22 32.70 1x68 n MET 66 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1x68 n ASP 67 N -0.60 -5.33 -3.82 3.17 9.92 -1.26 -4.97 116.55 113.67 1x68 n ASP 67 Ca 0.00 0.15 -0.12 0.00 -0.53 0.00 0.00 54.79 54.28 1x68 n ASP 67 Cb 0.00 -3.35 -0.10 0.00 -0.64 0.00 0.00 41.12 37.03 1x68 n ASP 67 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1x68 s THR 68 N -1.68 0.04 -1.27 -3.53 -1.32 -1.26 -5.06 115.64 101.57 1x68 s THR 68 Ca 0.00 -0.36 0.19 0.00 -1.21 0.00 0.00 61.69 60.31 1x68 s THR 68 Cb 0.00 -0.42 0.27 0.00 -1.51 0.00 0.00 72.50 70.83 1x68 s THR 68 CO 0.00 -0.20 1.60 -0.90 -2.21 0.00 0.00 174.62 172.91 1x68 n ASP 69 N 2.03 0.00 -4.74 8.08 5.68 -1.26 -4.88 116.55 121.46 1x68 n ASP 69 Ca -0.18 0.19 -0.34 0.00 -0.50 0.00 0.00 54.79 53.96 1x68 n ASP 69 Cb 0.57 -0.36 0.07 0.00 -1.14 0.00 0.00 41.12 40.25 1x68 n ASP 69 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 1x68 s ILE 70 N -2.73 2.62 -0.47 2.12 -4.36 -1.26 -4.98 121.20 112.14 1x68 s ILE 70 Ca 0.15 0.32 0.08 0.00 -0.26 0.00 0.00 60.65 60.93 1x68 s ILE 70 Cb 0.13 -2.91 0.38 0.00 1.25 0.00 0.00 42.46 41.30 1x68 s ILE 70 CO 0.31 -0.15 0.97 -1.54 0.24 0.00 0.00 174.94 174.76 1x68 n SER 71 N -2.39 3.61 -4.71 4.36 3.41 -1.26 -5.10 113.62 111.54 1x68 n SER 71 Ca 0.13 -3.47 -0.33 0.00 -0.26 0.00 0.00 58.87 54.93 1x68 n SER 71 Cb 0.51 -0.53 0.11 0.00 -0.26 0.00 0.00 64.21 64.03 1x68 n SER 71 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x68 s GLY 72 N -3.29 2.11 -0.03 5.00 0.00 -1.26 -4.93 107.32 104.92 1x68 s GLY 72 Ca 0.45 0.75 -0.30 0.00 0.00 0.00 0.00 44.72 45.62 1x68 s GLY 72 CO -0.12 1.16 1.32 2.56 0.00 0.00 0.00 173.10 178.01 1x68 s PRO 73 N -4.20 4.30 -0.08 2.90 0.04 -1.26 -4.96 135.00 131.74 1x68 s PRO 73 Ca 0.71 1.84 -0.30 0.00 0.04 0.00 0.00 61.00 63.29 1x68 s PRO 73 Cb -0.26 -3.59 0.11 0.00 0.04 0.00 0.00 34.50 30.80 1x68 s PRO 73 CO 0.50 -0.54 0.92 -1.54 0.04 0.00 0.00 177.00 176.37 1x68 s SER 74 N 1.77 -0.40 -0.29 6.66 1.04 -1.26 -5.17 113.70 116.05 1x68 s SER 74 Ca 0.60 0.26 0.06 0.00 0.48 0.00 0.00 55.95 57.35 1x68 s SER 74 Cb -0.28 0.36 0.20 0.00 0.10 0.00 0.00 66.02 66.40 1x68 s SER 74 CO 0.24 -0.49 0.59 -0.94 0.98 0.00 0.00 173.24 173.62 1x68 s SER 75 N -1.71 -1.60 0.00 7.02 1.04 -1.26 -5.24 113.70 111.95 1x68 s SER 75 Ca 0.00 0.18 0.22 0.00 0.48 0.00 0.00 55.95 56.84 1x68 s SER 75 Cb -0.01 2.02 0.17 0.00 0.10 0.00 0.00 66.02 68.31 1x68 s SER 75 CO -0.02 -0.30 1.20 0.61 0.98 0.00 0.00 173.24 175.70