#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1imt h VAL 2 N 0.00 1.28 -2.57 0.00 -1.51 -1.97 -3.39 116.25 108.10 1imt h VAL 2 Ca 0.00 -1.37 -0.54 0.00 -1.23 0.00 0.00 66.70 63.56 1imt h VAL 2 Cb 0.00 1.30 -0.05 0.00 -2.13 0.00 0.00 31.29 30.41 1imt h VAL 2 CO 0.00 0.45 1.18 -0.63 -1.23 0.00 0.00 177.57 177.34 1imt s ILE 3 N -4.52 3.65 0.00 7.19 1.01 -1.26 -4.88 121.20 122.39 1imt s ILE 3 Ca -0.09 0.52 -0.02 0.00 0.00 0.00 0.00 60.65 61.06 1imt s ILE 3 Cb 0.13 -4.28 -0.10 0.00 0.01 0.00 0.00 42.46 38.22 1imt s ILE 3 CO 0.83 -1.09 2.24 0.35 0.00 0.00 0.00 174.94 177.27 1imt n THR 4 N 6.96 1.95 -1.73 2.92 -2.24 -1.26 -4.26 114.28 116.62 1imt n THR 4 Ca 0.15 -0.77 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 1imt n THR 4 Cb 0.50 -1.64 -0.00 0.00 -2.10 0.00 0.00 70.33 67.09 1imt n THR 4 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1imt n GLY 5 N 2.10 4.32 3.56 3.38 0.00 -1.26 -4.93 105.19 112.36 1imt n GLY 5 Ca 0.17 -1.58 -0.64 0.00 0.00 0.00 0.00 46.02 43.97 1imt n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1imt n ALA 6 N 6.20 -0.67 -2.33 4.61 0.00 -1.26 -0.63 120.51 126.43 1imt n ALA 6 Ca 0.52 0.37 -0.08 0.00 0.00 0.00 0.00 53.44 54.25 1imt n ALA 6 Cb 0.39 -2.01 -0.10 0.00 0.00 0.00 0.00 19.45 17.74 1imt n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1imt n GLU 8 N 0.34 0.63 -3.67 0.00 1.02 -1.26 -3.79 120.64 113.90 1imt n GLU 8 Ca -0.16 0.22 -0.15 0.00 -0.02 0.00 0.00 57.16 57.06 1imt n GLU 8 Cb 0.60 -1.53 -0.08 0.00 -0.02 0.00 0.00 31.44 30.42 1imt n GLU 8 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1imt s ARG 9 N -2.51 0.78 0.07 3.49 3.03 -1.26 -4.81 118.95 117.73 1imt s ARG 9 Ca -0.36 0.14 -0.08 0.00 2.03 0.00 0.00 55.73 57.47 1imt s ARG 9 Cb 0.11 0.36 0.03 0.00 -1.03 0.00 0.00 34.95 34.43 1imt s ARG 9 CO 0.56 -0.21 0.51 -0.25 -1.13 0.00 0.00 175.30 174.78 1imt n ASP 10 N 1.48 -0.28 -0.32 -2.89 8.00 -1.26 -1.31 116.55 119.98 1imt n ASP 10 Ca -0.19 0.58 0.30 0.00 0.71 0.00 0.00 54.79 56.19 1imt n ASP 10 Cb 0.56 -0.11 0.56 0.00 -0.02 0.00 0.00 41.12 42.12 1imt n ASP 10 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1imt n LEU 11 N -4.45 0.31 0.15 0.64 4.77 -1.26 -0.87 117.00 116.28 1imt n LEU 11 Ca 0.02 1.66 0.06 0.00 -0.03 0.00 0.00 56.01 57.72 1imt n LEU 11 Cb 0.11 -0.79 0.54 0.00 -2.33 0.00 0.00 43.42 40.94 1imt n LEU 11 CO -0.05 -1.84 1.09 1.56 -1.33 0.00 0.00 177.39 176.82 1imt h GLN 12 N 0.00 0.23 0.00 3.23 4.20 -1.64 -3.17 115.11 117.96 1imt h GLN 12 Ca 0.83 -0.02 -0.27 0.00 0.06 0.00 0.00 58.65 59.25 1imt h GLN 12 Cb 2.16 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 29.84 1imt h GLN 12 CO -0.78 0.17 -2.03 0.00 -0.67 0.00 0.00 178.83 175.52 1imt n GLY 14 N 2.36 1.43 0.41 0.00 0.00 -0.08 -4.80 105.19 104.51 1imt n GLY 14 Ca -0.28 -2.00 0.37 0.00 0.00 0.00 0.00 46.02 44.11 1imt n GLY 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1imt n LYS 15 N 1.93 -0.04 0.15 1.61 4.76 -1.26 -0.23 118.16 125.07 1imt n LYS 15 Ca 0.00 1.27 0.11 0.00 -2.87 0.00 0.00 58.31 56.82 1imt n LYS 15 Cb 0.00 -2.43 0.55 0.00 -1.84 0.00 0.00 35.03 31.31 1imt n LYS 15 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1imt n GLY 16 N -1.42 -0.98 3.30 0.72 0.00 -1.26 -4.75 105.19 100.81 1imt n GLY 16 Ca 0.39 0.16 -0.19 0.00 0.00 0.00 0.00 46.02 46.38 1imt n GLY 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1imt s THR 17 N -3.47 0.10 0.16 2.61 -4.23 0.68 -2.30 115.64 109.19 1imt s THR 17 Ca -0.00 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.49 1imt s THR 17 Cb 0.07 -2.48 -0.04 0.00 1.34 0.00 0.00 72.50 71.39 1imt s THR 17 CO 0.25 0.00 0.10 0.00 -0.54 0.00 0.00 174.62 174.43 1imt s ALA 20 N -0.65 3.67 1.00 0.00 0.00 -0.88 -4.50 121.76 120.41 1imt s ALA 20 Ca 0.22 -1.11 -0.13 0.00 0.00 0.00 0.00 51.96 50.94 1imt s ALA 20 Cb -0.13 -2.24 0.11 0.00 0.00 0.00 0.00 23.12 20.86 1imt s ALA 20 CO -0.08 -0.72 0.58 0.28 0.00 0.00 0.00 175.76 175.82 1imt n VAL 21 N -2.38 0.00 -3.17 0.00 0.31 -1.26 0.12 118.33 111.95 1imt n VAL 21 Ca 0.06 -0.20 -0.39 0.00 -0.01 0.00 0.00 64.34 63.80 1imt n VAL 21 Cb 0.59 -0.75 -0.05 0.00 -0.91 0.00 0.00 33.84 32.71 1imt n VAL 21 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1imt s SER 22 N -2.18 6.94 0.38 4.52 0.15 0.18 -4.30 113.70 119.39 1imt s SER 22 Ca 0.61 1.13 0.28 0.00 0.70 0.00 0.00 55.95 58.66 1imt s SER 22 Cb -0.20 -2.37 1.22 0.00 -1.71 0.00 0.00 66.02 62.96 1imt s SER 22 CO 0.65 0.02 1.83 -0.07 1.20 0.00 0.00 173.24 176.87 1imt h LEU 23 N 6.12 0.00 0.01 3.45 -0.00 -1.90 -3.26 115.31 119.73 1imt h LEU 23 Ca -0.43 0.00 -0.40 0.00 -0.00 0.00 0.00 57.88 57.05 1imt h LEU 23 Cb 1.20 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.79 1imt h LEU 23 CO 0.72 0.00 -2.40 0.79 -0.00 0.00 0.00 178.44 177.55 1imt n TRP 24 N -2.53 0.18 -3.34 1.13 7.02 -1.26 -4.84 117.44 113.80 1imt n TRP 24 Ca 0.01 0.05 -0.10 0.00 -1.02 0.00 0.00 57.50 56.43 1imt n TRP 24 Cb 0.21 -1.02 -0.07 0.00 -2.42 0.00 0.00 31.31 28.00 1imt n TRP 24 CO 0.00 0.00 0.00 -1.50 -2.02 0.00 0.00 177.69 174.17 1imt s ILE 25 N -2.52 -0.59 -1.39 -0.99 2.07 -1.25 -5.04 121.20 111.50 1imt s ILE 25 Ca -0.34 -0.23 0.00 0.00 -1.41 0.00 0.00 60.65 58.67 1imt s ILE 25 Cb 0.10 -0.91 0.00 0.00 0.13 0.00 0.00 42.46 41.77 1imt s ILE 25 CO 0.60 -0.24 0.77 0.29 -1.91 0.00 0.00 174.94 174.45 1imt n LYS 26 N 5.35 0.00 -0.00 3.50 4.01 -1.23 -2.19 118.16 127.60 1imt n LYS 26 Ca -0.02 0.28 0.00 0.00 -0.51 0.00 0.00 58.31 58.07 1imt n LYS 26 Cb 0.49 -1.51 0.31 0.00 -0.51 0.00 0.00 35.03 33.82 1imt n LYS 26 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1imt h SER 27 N 0.00 0.49 -2.20 4.39 4.64 -1.96 -3.44 113.55 115.48 1imt h SER 27 Ca 0.00 -0.08 -0.53 0.00 -0.47 0.00 0.00 61.79 60.71 1imt h SER 27 Cb 0.02 -0.13 -0.07 0.00 -0.31 0.00 0.00 62.40 61.91 1imt h SER 27 CO 0.00 0.53 -0.58 0.68 -0.87 0.00 0.00 176.83 176.59 1imt s VAL 28 N -5.06 4.03 0.15 0.95 -7.23 -0.93 -5.04 120.40 107.26 1imt s VAL 28 Ca -0.08 -1.62 0.09 0.00 -1.81 0.00 0.00 61.98 58.56 1imt s VAL 28 Cb 0.16 -3.17 -0.04 0.00 0.56 0.00 0.00 36.38 33.89 1imt s VAL 28 CO 0.76 -0.36 -0.13 -0.13 -0.31 0.00 0.00 175.10 174.93 1imt s ARG 29 N -3.77 1.95 0.04 4.82 0.52 -1.25 -0.65 118.95 120.61 1imt s ARG 29 Ca 0.32 -1.21 0.02 0.00 -0.52 0.00 0.00 55.73 54.35 1imt s ARG 29 Cb -0.07 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.22 1imt s ARG 29 CO 0.23 0.46 -0.08 0.14 0.02 0.00 0.00 175.30 176.07 1imt s VAL 30 N -1.43 0.57 -0.54 3.52 -7.23 0.12 -0.57 120.40 114.84 1imt s VAL 30 Ca 0.22 -1.07 -0.26 0.00 -1.81 0.00 0.00 61.98 59.05 1imt s VAL 30 Cb -0.10 -0.63 -0.05 0.00 0.56 0.00 0.00 36.38 36.16 1imt s VAL 30 CO 0.13 -0.36 2.21 0.00 -0.31 0.00 0.00 175.10 176.77 1imt s THR 32 N 11.07 5.44 0.69 0.00 2.01 1.00 -4.13 115.64 131.72 1imt s THR 32 Ca 0.86 0.27 -0.16 0.00 0.31 0.00 0.00 61.69 62.98 1imt s THR 32 Cb -0.15 -3.45 0.02 0.00 0.01 0.00 0.00 72.50 68.92 1imt s THR 32 CO 0.24 0.56 1.17 -2.16 -0.69 0.00 0.00 174.62 173.74 1imt s PRO 33 N -0.61 2.47 0.64 4.92 0.04 -1.26 -0.27 135.00 140.93 1imt s PRO 33 Ca 0.14 1.65 -0.18 0.00 0.04 0.00 0.00 61.00 62.66 1imt s PRO 33 Cb -0.12 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 1imt s PRO 33 CO 0.03 -1.56 0.98 1.33 0.04 0.00 0.00 177.00 177.83 1imt n VAL 34 N -2.46 3.66 -1.55 -0.36 0.24 -0.97 -4.69 118.33 112.21 1imt n VAL 34 Ca 0.12 -0.47 -0.32 0.00 -2.04 0.00 0.00 64.34 61.63 1imt n VAL 34 Cb 0.51 -1.16 -0.04 0.00 -1.47 0.00 0.00 33.84 31.68 1imt n VAL 34 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1imt n GLY 35 N 1.23 0.09 3.98 7.63 0.00 0.29 -4.61 105.19 113.81 1imt n GLY 35 Ca 0.14 0.61 -0.20 0.00 0.00 0.00 0.00 46.02 46.57 1imt n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1imt s THR 36 N 12.52 4.00 -0.56 2.61 2.01 -1.26 -0.38 115.64 134.58 1imt s THR 36 Ca 0.99 -0.89 -0.27 0.00 0.31 0.00 0.00 61.69 61.83 1imt s THR 36 Cb -0.21 -3.40 -0.15 0.00 0.01 0.00 0.00 72.50 68.75 1imt s THR 36 CO 0.24 -0.18 1.77 -1.20 -0.69 0.00 0.00 174.62 174.56 1imt n SER 37 N -1.75 0.36 0.00 3.53 7.64 -1.25 -0.47 113.62 121.69 1imt n SER 37 Ca 0.01 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.18 1imt n SER 37 Cb 0.58 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1imt n SER 37 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1imt n GLY 38 N 5.04 2.32 3.77 0.23 0.00 0.08 -5.02 105.19 111.61 1imt n GLY 38 Ca 0.44 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.07 1imt n GLY 38 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1imt s GLU 39 N -0.27 3.95 0.51 1.61 0.41 0.38 -4.71 118.70 120.59 1imt s GLU 39 Ca 0.00 2.20 -0.19 0.00 -0.41 0.00 0.00 54.97 56.57 1imt s GLU 39 Cb 0.00 -2.76 -0.07 0.00 -1.78 0.00 0.00 34.13 29.52 1imt s GLU 39 CO 0.00 -0.53 1.06 0.34 -0.49 0.00 0.00 175.26 175.64 1imt s ASP 40 N -0.69 6.14 0.05 -0.19 -1.08 -1.26 -0.64 116.67 119.00 1imt s ASP 40 Ca 0.57 1.95 -0.01 0.00 -0.52 0.00 0.00 52.55 54.53 1imt s ASP 40 Cb -0.39 -2.56 -0.04 0.00 -1.46 0.00 0.00 42.92 38.48 1imt s ASP 40 CO 0.50 -0.92 -0.02 0.00 0.52 0.00 0.00 175.17 175.25 1imt s HIS 42 N -3.79 3.12 0.58 0.00 2.46 -1.26 -4.47 115.29 111.93 1imt s HIS 42 Ca 0.06 -0.14 0.27 0.00 0.47 0.00 0.00 55.06 55.72 1imt s HIS 42 Cb 0.07 -2.01 1.60 0.00 -0.13 0.00 0.00 32.58 32.11 1imt s HIS 42 CO -0.10 0.04 2.10 -1.00 -2.47 0.00 0.00 174.74 173.32 1imt h PRO 43 N 6.71 0.00 -0.61 2.88 0.13 -1.97 -0.11 132.00 139.04 1imt h PRO 43 Ca -0.34 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.75 1imt h PRO 43 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1imt h PRO 43 CO 0.66 0.00 0.05 0.00 -0.23 0.00 0.00 178.00 178.48 1imt n ALA 44 N -2.39 4.03 -1.61 -0.56 0.00 -1.26 -4.99 120.51 113.74 1imt n ALA 44 Ca 0.02 -2.00 -0.52 0.00 0.00 0.00 0.00 53.44 50.94 1imt n ALA 44 Cb 0.33 -1.15 -0.06 0.00 0.00 0.00 0.00 19.45 18.56 1imt n ALA 44 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1imt n SER 45 N 0.50 2.70 -4.71 0.00 7.64 -0.06 -4.85 113.62 114.84 1imt n SER 45 Ca 0.30 0.79 -0.43 0.00 1.01 0.00 0.00 58.87 60.55 1imt n SER 45 Cb 1.24 -1.27 -0.01 0.00 -1.01 0.00 0.00 64.21 63.16 1imt n SER 45 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1imt n HIS 46 N 7.53 2.44 -0.55 1.43 8.25 -1.26 -4.60 115.22 128.46 1imt n HIS 46 Ca 0.30 0.47 -0.29 0.00 -0.26 0.00 0.00 57.72 57.95 1imt n HIS 46 Cb 0.23 -2.47 0.25 0.00 1.12 0.00 0.00 29.99 29.12 1imt n HIS 46 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1imt s LYS 47 N -1.40 -0.77 -0.11 -0.41 -0.14 -1.26 -4.49 119.74 111.15 1imt s LYS 47 Ca 0.59 0.91 -0.03 0.00 -1.36 0.00 0.00 55.97 56.08 1imt s LYS 47 Cb -0.56 -1.56 -0.03 0.00 -1.68 0.00 0.00 37.83 33.99 1imt s LYS 47 CO 0.58 -3.65 0.02 0.42 -0.76 0.00 0.00 175.35 171.96 1imt s ILE 48 N -2.48 4.50 -0.02 2.17 1.01 -1.26 -3.25 121.20 121.87 1imt s ILE 48 Ca 0.68 -0.17 -0.21 0.00 0.00 0.00 0.00 60.65 60.95 1imt s ILE 48 Cb -0.25 -2.93 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 1imt s ILE 48 CO 0.64 0.58 0.62 -2.16 0.00 0.00 0.00 174.94 174.61 1imt s PRO 49 N -0.60 4.36 -0.88 2.79 0.04 -1.26 -5.12 135.00 134.32 1imt s PRO 49 Ca 0.10 0.76 -0.14 0.00 0.04 0.00 0.00 61.00 61.77 1imt s PRO 49 Cb -0.12 -3.37 0.22 0.00 0.04 0.00 0.00 34.50 31.27 1imt s PRO 49 CO 0.02 0.28 0.85 0.12 0.04 0.00 0.00 177.00 178.31 1imt s PHE 50 N 0.11 3.77 -0.98 0.56 5.36 -1.20 -4.94 117.98 120.65 1imt s PHE 50 Ca 0.32 -2.03 -0.12 0.00 -0.96 0.00 0.00 56.93 54.14 1imt s PHE 50 Cb -0.18 -3.87 -0.08 0.00 -0.34 0.00 0.00 43.02 38.55 1imt s PHE 50 CO 0.17 -1.04 2.13 0.43 -1.46 0.00 0.00 175.22 175.46 1imt n SER 51 N 4.07 4.37 0.00 6.13 7.64 -1.26 -4.49 113.62 130.08 1imt n SER 51 Ca 0.16 -2.51 0.00 0.00 1.01 0.00 0.00 58.87 57.54 1imt n SER 51 Cb 0.46 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 1imt n SER 51 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1imt n GLY 52 N 4.03 3.63 2.98 0.23 0.00 -1.26 -5.14 105.19 109.65 1imt n GLY 52 Ca 0.50 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1imt n GLY 52 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1imt s GLN 53 N 3.31 1.85 -0.71 1.61 -1.52 -1.26 -4.72 119.66 118.22 1imt s GLN 53 Ca 0.00 -0.97 -0.26 0.00 -1.95 0.00 0.00 55.36 52.18 1imt s GLN 53 Cb 0.00 -2.55 -0.06 0.00 -0.22 0.00 0.00 33.01 30.18 1imt s GLN 53 CO 0.00 -0.53 2.11 1.03 -0.25 0.00 0.00 175.29 177.65 1imt s ARG 54 N 1.36 2.28 0.36 2.91 0.52 -1.26 -4.82 118.95 120.30 1imt s ARG 54 Ca -0.04 0.50 0.03 0.00 -0.52 0.00 0.00 55.73 55.69 1imt s ARG 54 Cb -0.18 -4.70 0.67 0.00 0.52 0.00 0.00 34.95 31.25 1imt s ARG 54 CO -0.07 -3.38 2.02 0.00 0.02 0.00 0.00 175.30 173.88 1imt h MET 55 N 14.45 0.79 -6.93 3.54 -0.00 -1.96 -3.37 114.93 121.44 1imt h MET 55 Ca -0.10 -0.05 -0.50 0.00 -0.00 0.00 0.00 59.70 59.05 1imt h MET 55 Cb 1.11 -0.18 0.03 0.00 -0.00 0.00 0.00 31.60 32.56 1imt h MET 55 CO 1.16 0.53 0.46 -1.01 -0.00 0.00 0.00 176.91 178.04 1imt s HIS 56 N -5.69 3.23 -0.53 -0.10 3.76 -1.26 -4.93 115.29 109.78 1imt s HIS 56 Ca -0.10 1.62 0.05 0.00 -0.15 0.00 0.00 55.06 56.48 1imt s HIS 56 Cb 0.18 -3.26 0.38 0.00 1.11 0.00 0.00 32.58 30.99 1imt s HIS 56 CO 0.76 -0.90 1.19 1.58 -0.85 0.00 0.00 174.74 176.53 1imt n HIS 57 N 0.16 1.13 -4.21 1.40 -0.00 -1.26 -4.17 115.22 108.28 1imt n HIS 57 Ca 0.04 -0.56 -0.15 0.00 0.46 0.00 0.00 57.72 57.51 1imt n HIS 57 Cb 0.48 -0.38 -0.08 0.00 -0.12 0.00 0.00 29.99 29.89 1imt n HIS 57 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1imt s THR 58 N -1.79 0.00 0.19 3.57 -4.23 -1.26 -4.86 115.64 107.26 1imt s THR 58 Ca 0.27 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 58.87 1imt s THR 58 Cb 0.21 -2.50 -0.05 0.00 1.34 0.00 0.00 72.50 71.50 1imt s THR 58 CO 0.07 0.00 0.03 0.00 -0.54 0.00 0.00 174.62 174.18 1imt s PRO 60 N -3.96 3.03 0.30 0.00 0.04 -1.26 -4.24 135.00 128.91 1imt s PRO 60 Ca 0.27 1.76 -0.29 0.00 0.04 0.00 0.00 61.00 62.78 1imt s PRO 60 Cb 0.07 -1.95 -0.10 0.00 0.04 0.00 0.00 34.50 32.56 1imt s PRO 60 CO 0.06 -1.14 1.31 0.00 0.04 0.00 0.00 177.00 177.27 1imt n ALA 62 N 1.21 0.67 -1.13 0.00 0.00 0.49 -4.70 120.51 117.04 1imt n ALA 62 Ca 0.01 0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.46 1imt n ALA 62 Cb 0.42 -2.19 -0.04 0.00 0.00 0.00 0.00 19.45 17.63 1imt n ALA 62 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1imt n PRO 63 N -0.86 0.03 0.00 0.00 -0.02 -1.26 -0.44 135.00 132.45 1imt n PRO 63 Ca 0.12 -0.57 0.00 0.00 -2.02 0.00 0.00 63.50 61.03 1imt n PRO 63 Cb 0.45 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1imt n PRO 63 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1imt n ASN 64 N 9.25 0.00 -4.78 2.55 2.85 -1.26 -5.14 115.26 118.73 1imt n ASN 64 Ca 0.15 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.21 1imt n ASN 64 Cb 0.45 0.00 -0.00 0.00 1.24 0.00 0.00 39.78 41.47 1imt n ASN 64 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1imt s LEU 65 N 0.00 4.32 -0.06 1.20 2.01 0.42 -4.35 118.68 122.22 1imt s LEU 65 Ca 0.00 3.05 0.01 0.00 0.01 0.00 0.00 54.13 57.20 1imt s LEU 65 Cb 0.00 -3.67 -0.03 0.00 0.01 0.00 0.00 46.19 42.50 1imt s LEU 65 CO 0.00 -0.87 -0.08 0.00 1.01 0.00 0.00 176.35 176.41 1imt s ALA 66 N -1.10 2.93 -1.09 4.21 0.00 0.60 -4.56 121.76 122.75 1imt s ALA 66 Ca 0.53 -0.91 -0.22 0.00 0.00 0.00 0.00 51.96 51.36 1imt s ALA 66 Cb -0.46 -1.19 0.05 0.00 0.00 0.00 0.00 23.12 21.52 1imt s ALA 66 CO 0.63 0.57 1.54 0.00 0.00 0.00 0.00 175.76 178.50 1imt s VAL 68 N 4.94 5.38 -0.31 0.00 0.11 0.39 -4.80 120.40 126.11 1imt s VAL 68 Ca 0.49 -0.34 -0.25 0.00 -2.93 0.00 0.00 61.98 58.95 1imt s VAL 68 Cb 0.01 -3.62 0.01 0.00 -1.53 0.00 0.00 36.38 31.24 1imt s VAL 68 CO -0.05 0.15 0.87 -1.10 -3.33 0.00 0.00 175.10 171.64 1imt s GLN 69 N -2.45 3.98 -0.20 1.54 1.11 -1.26 -0.48 119.66 121.89 1imt s GLN 69 Ca 0.35 0.70 0.11 0.00 0.01 0.00 0.00 55.36 56.53 1imt s GLN 69 Cb -0.13 -3.73 -0.22 0.00 -1.01 0.00 0.00 33.01 27.91 1imt s GLN 69 CO 0.27 -0.75 0.03 0.25 0.01 0.00 0.00 175.29 175.11 1imt n THR 70 N 5.64 1.46 -3.84 -0.19 -2.24 0.11 -4.99 114.28 110.22 1imt n THR 70 Ca 0.06 -0.75 -0.06 0.00 -2.27 0.00 0.00 64.05 61.02 1imt n THR 70 Cb 0.48 -0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 67.81 1imt n THR 70 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1imt s SER 71 N -5.95 -0.23 0.24 3.42 0.01 -1.15 -5.03 113.70 105.01 1imt s SER 71 Ca -0.18 -0.60 -0.31 0.00 1.31 0.00 0.00 55.95 56.17 1imt s SER 71 Cb 0.07 0.69 -0.14 0.00 0.21 0.00 0.00 66.02 66.85 1imt s SER 71 CO 0.75 -1.29 1.28 -2.65 0.41 0.00 0.00 173.24 171.74 1imt n PRO 72 N -0.47 1.72 0.00 12.44 -0.02 -1.26 -1.70 135.00 145.71 1imt n PRO 72 Ca -0.05 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1imt n PRO 72 Cb 0.59 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1imt n PRO 72 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1imt n LYS 73 N 1.64 0.00 -1.82 -0.52 4.76 -1.26 -4.84 118.16 116.12 1imt n LYS 73 Ca 0.12 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.23 1imt n LYS 73 Cb 0.30 -0.16 -0.06 0.00 -1.84 0.00 0.00 35.03 33.27 1imt n LYS 73 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1imt n LYS 74 N 0.00 1.60 -3.51 1.97 5.02 -0.69 -4.88 118.16 117.66 1imt n LYS 74 Ca 0.00 -2.31 -0.39 0.00 -2.02 0.00 0.00 58.31 53.58 1imt n LYS 74 Cb 0.00 -3.50 -0.10 0.00 -0.02 0.00 0.00 35.03 31.40 1imt n LYS 74 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1imt s PHE 75 N 9.30 3.22 0.06 2.13 0.40 -1.26 -0.72 117.98 131.12 1imt s PHE 75 Ca 0.65 -0.01 0.07 0.00 -0.60 0.00 0.00 56.93 57.04 1imt s PHE 75 Cb 0.04 -2.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.05 1imt s PHE 75 CO 0.13 -0.29 -0.18 0.21 0.70 0.00 0.00 175.22 175.79 1imt s LYS 76 N 1.82 1.13 -0.42 0.44 2.20 0.37 -0.58 119.74 124.70 1imt s LYS 76 Ca 0.08 -0.97 -0.26 0.00 -0.36 0.00 0.00 55.97 54.46 1imt s LYS 76 Cb -0.17 -1.25 0.02 0.00 -1.51 0.00 0.00 37.83 34.92 1imt s LYS 76 CO 0.11 0.30 0.95 0.00 -0.36 0.00 0.00 175.35 176.35 1imt s LEU 78 N 3.70 2.30 0.88 0.00 1.43 -0.80 -0.74 118.68 125.45 1imt s LEU 78 Ca 0.39 -1.20 -0.12 0.00 -1.03 0.00 0.00 54.13 52.17 1imt s LEU 78 Cb -0.11 -0.39 0.12 0.00 0.03 0.00 0.00 46.19 45.84 1imt s LEU 78 CO 0.23 -0.45 1.12 -0.44 0.23 0.00 0.00 176.35 177.04 1imt s SER 79 N -3.34 3.75 0.00 2.29 0.01 -1.26 -0.29 113.70 114.85 1imt s SER 79 Ca 0.28 1.13 0.00 0.00 1.31 0.00 0.00 55.95 58.67 1imt s SER 79 Cb 0.05 -1.77 0.00 0.00 0.21 0.00 0.00 66.02 64.50 1imt s SER 79 CO 0.09 -2.42 0.00 2.29 0.41 0.00 0.00 173.24 173.62