#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 0.54 0.00 0.00 3.04 -1.79 -1.09 116.25 116.95 1imt h VAL 2 Ca 0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 65.55 1imt h VAL 2 Cb 0.00 0.11 0.00 0.00 -2.01 0.00 0.00 31.29 29.39 1imt h VAL 2 CO 0.00 0.07 0.20 0.16 -1.01 0.00 0.00 177.57 176.99 1imt h ILE 3 N 0.40 0.00 -0.95 3.17 -2.65 -1.97 -0.72 117.51 114.79 1imt h ILE 3 Ca 0.58 0.00 0.12 0.00 1.03 0.00 0.00 64.86 66.59 1imt h ILE 3 Cb 1.47 0.53 -0.08 0.00 -2.05 0.00 0.00 36.82 36.70 1imt h ILE 3 CO -0.28 0.00 0.60 0.71 0.03 0.00 0.00 178.15 179.21 1imt h THR 4 N 0.00 0.90 0.00 0.16 1.35 -1.56 -3.45 112.91 110.31 1imt h THR 4 Ca 0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1imt h THR 4 Cb 0.40 -0.05 0.00 0.00 -1.73 0.00 0.00 68.15 66.77 1imt h THR 4 CO 0.00 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 1imt n GLY 5 N -1.39 1.45 3.72 5.82 0.00 -0.28 -4.83 105.19 109.68 1imt n GLY 5 Ca 0.18 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1imt n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1imt s ALA 6 N 0.00 3.48 0.05 4.61 0.00 -1.26 -0.62 121.76 128.02 1imt s ALA 6 Ca 0.00 0.98 -0.02 0.00 0.00 0.00 0.00 51.96 52.92 1imt s ALA 6 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.61 1imt s ALA 6 CO 0.00 -0.50 0.01 0.00 0.00 0.00 0.00 175.76 175.27 1imt n GLU 8 N 0.38 0.60 -3.75 0.00 1.02 -1.26 -3.06 120.64 114.57 1imt n GLU 8 Ca -0.16 0.24 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 1imt n GLU 8 Cb 0.60 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.44 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 0.71 0.18 3.49 3.03 -1.26 -4.58 118.95 118.01 1imt s ARG 9 Ca -0.38 -0.25 -0.05 0.00 2.03 0.00 0.00 55.73 57.08 1imt s ARG 9 Cb 0.14 0.31 0.31 0.00 -1.03 0.00 0.00 34.95 34.67 1imt s ARG 9 CO 0.52 -0.20 1.00 -0.25 -1.13 0.00 0.00 175.30 175.24 1imt n ASP 10 N 1.11 -0.22 -0.42 -2.89 9.92 -1.23 -1.09 116.55 121.73 1imt n ASP 10 Ca -0.21 1.10 0.34 0.00 -0.53 0.00 0.00 54.79 55.50 1imt n ASP 10 Cb 0.57 -0.34 0.64 0.00 -0.64 0.00 0.00 41.12 41.35 1imt n ASP 10 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1imt h LEU 11 N 0.00 0.26 -0.08 0.64 3.38 -1.94 0.11 115.31 117.67 1imt h LEU 11 Ca 0.31 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1imt h LEU 11 Cb 0.49 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1imt h LEU 11 CO -0.66 -0.09 0.00 0.00 0.09 0.00 0.00 178.44 177.78 1imt n GLN 12 N -4.59 0.02 0.00 1.13 6.02 -0.25 -4.06 117.38 115.65 1imt n GLN 12 Ca 0.34 0.27 0.00 0.00 -0.01 0.00 0.00 57.00 57.60 1imt n GLN 12 Cb 1.32 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 31.04 1imt n GLN 12 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1imt n GLY 14 N 2.35 2.06 0.53 0.00 0.00 0.04 -4.51 105.19 105.67 1imt n GLY 14 Ca 0.00 -1.94 0.30 0.00 0.00 0.00 0.00 46.02 44.38 1imt n GLY 14 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1imt h LYS 15 N 0.00 0.00 0.00 1.61 2.10 -1.96 0.12 116.57 118.44 1imt h LYS 15 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1imt h LYS 15 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1imt h LYS 15 CO 0.00 0.00 0.00 0.78 -2.00 0.00 0.00 179.45 178.23 1imt h GLY 16 N 0.00 0.00 -2.03 0.07 0.00 -1.97 -3.44 103.07 95.70 1imt h GLY 16 Ca 0.50 0.00 -0.42 0.00 0.00 0.00 0.00 47.33 47.40 1imt h GLY 16 CO -0.01 0.00 -0.53 -0.51 0.00 0.00 0.00 176.54 175.49 1imt s THR 17 N -3.76 0.12 0.01 4.70 -4.23 0.41 -2.26 115.64 110.63 1imt s THR 17 Ca -0.02 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 1imt s THR 17 Cb 0.10 -2.49 -0.01 0.00 1.34 0.00 0.00 72.50 71.44 1imt s THR 17 CO 0.37 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.46 1imt s ALA 20 N 2.86 1.88 0.95 0.00 0.00 -0.10 -4.46 121.76 122.90 1imt s ALA 20 Ca 0.56 0.46 -0.11 0.00 0.00 0.00 0.00 51.96 52.88 1imt s ALA 20 Cb 0.15 -3.37 0.16 0.00 0.00 0.00 0.00 23.12 20.07 1imt s ALA 20 CO -0.07 -2.24 1.11 0.08 0.00 0.00 0.00 175.76 174.64 1imt s VAL 21 N -2.72 2.27 0.13 0.00 1.01 -0.04 0.03 120.40 121.08 1imt s VAL 21 Ca 0.65 0.09 -0.19 0.00 0.00 0.00 0.00 61.98 62.52 1imt s VAL 21 Cb -0.21 -2.22 -0.07 0.00 0.00 0.00 0.00 36.38 33.88 1imt s VAL 21 CO 0.56 -0.12 0.62 -0.55 0.00 0.00 0.00 175.10 175.61 1imt s SER 22 N -2.80 7.06 0.22 3.32 0.15 -0.92 -4.40 113.70 116.32 1imt s SER 22 Ca 0.66 1.30 0.24 0.00 0.70 0.00 0.00 55.95 58.86 1imt s SER 22 Cb -0.22 -2.37 0.91 0.00 -1.71 0.00 0.00 66.02 62.63 1imt s SER 22 CO 0.59 0.19 1.73 0.18 1.20 0.00 0.00 173.24 177.13 1imt n LEU 23 N 1.34 0.67 -0.12 3.45 7.99 -1.26 -4.03 117.00 125.04 1imt n LEU 23 Ca -0.07 0.62 -0.20 0.00 -0.01 0.00 0.00 56.01 56.35 1imt n LEU 23 Cb 0.51 -0.48 -0.10 0.00 -0.11 0.00 0.00 43.42 43.24 1imt n LEU 23 CO 0.42 -0.39 -1.30 0.79 -1.51 0.00 0.00 177.39 175.40 1imt n TRP 24 N -2.19 0.00 -3.57 -1.77 8.01 -1.26 -4.99 117.44 111.67 1imt n TRP 24 Ca 0.04 0.00 -0.03 0.00 -1.31 0.00 0.00 57.50 56.19 1imt n TRP 24 Cb 0.30 -0.89 -0.06 0.00 -2.01 0.00 0.00 31.31 28.65 1imt n TRP 24 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.69 175.18 1imt s ILE 25 N -2.46 -0.86 -1.14 -0.99 2.07 -1.26 -5.04 121.20 111.52 1imt s ILE 25 Ca -0.33 0.05 0.00 0.00 -1.41 0.00 0.00 60.65 58.97 1imt s ILE 25 Cb 0.10 -0.88 0.00 0.00 0.13 0.00 0.00 42.46 41.81 1imt s ILE 25 CO 0.50 0.02 0.89 0.29 -1.91 0.00 0.00 174.94 174.73 1imt n LYS 26 N 5.42 0.00 0.12 3.50 5.02 -1.26 -0.88 118.16 130.08 1imt n LYS 26 Ca -0.09 0.40 -0.01 0.00 -2.02 0.00 0.00 58.31 56.58 1imt n LYS 26 Cb 0.49 -1.51 0.23 0.00 -0.02 0.00 0.00 35.03 34.22 1imt n LYS 26 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1imt h SER 27 N 0.00 0.13 -2.90 4.39 4.64 -1.96 -3.44 113.55 114.41 1imt h SER 27 Ca 0.00 -0.06 -0.62 0.00 -0.47 0.00 0.00 61.79 60.64 1imt h SER 27 Cb 0.03 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 62.04 1imt h SER 27 CO 0.00 0.60 -0.49 -0.69 -0.87 0.00 0.00 176.83 175.38 1imt s VAL 28 N -3.96 5.39 0.10 0.95 1.01 -0.06 -5.06 120.40 118.76 1imt s VAL 28 Ca -0.03 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.68 1imt s VAL 28 Cb 0.13 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1imt s VAL 28 CO 0.76 0.18 -0.11 -0.13 0.00 0.00 0.00 175.10 175.81 1imt s ARG 29 N -2.38 0.85 -0.01 2.72 0.52 -1.17 -2.17 118.95 117.31 1imt s ARG 29 Ca 0.33 -1.15 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 1imt s ARG 29 Cb -0.13 -0.57 0.00 0.00 0.52 0.00 0.00 34.95 34.77 1imt s ARG 29 CO 0.26 0.09 -0.06 0.14 0.02 0.00 0.00 175.30 175.75 1imt s VAL 30 N -2.33 0.51 -0.72 3.52 -7.23 0.10 -0.60 120.40 113.65 1imt s VAL 30 Ca 0.05 -0.24 -0.26 0.00 -1.81 0.00 0.00 61.98 59.72 1imt s VAL 30 Cb -0.04 -0.45 -0.02 0.00 0.56 0.00 0.00 36.38 36.44 1imt s VAL 30 CO 0.00 0.16 1.77 0.00 -0.31 0.00 0.00 175.10 176.73 1imt s THR 32 N 8.60 5.47 0.57 0.00 2.01 0.29 -4.84 115.64 127.74 1imt s THR 32 Ca 0.62 0.25 -0.19 0.00 0.31 0.00 0.00 61.69 62.68 1imt s THR 32 Cb -0.10 -3.43 -0.07 0.00 0.01 0.00 0.00 72.50 68.91 1imt s THR 32 CO 0.13 0.60 0.78 -2.65 -0.69 0.00 0.00 174.62 172.78 1imt n PRO 33 N 2.14 0.76 -1.38 4.92 -0.02 -1.26 -0.25 135.00 139.91 1imt n PRO 33 Ca -0.19 0.29 -0.35 0.00 -2.02 0.00 0.00 63.50 61.23 1imt n PRO 33 Cb 0.55 -1.95 0.10 0.00 -0.02 0.00 0.00 33.50 32.18 1imt n PRO 33 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1imt n VAL 34 N -1.59 3.26 -1.76 -1.45 0.24 -0.96 -4.64 118.33 111.43 1imt n VAL 34 Ca 0.12 -0.34 -0.42 0.00 -2.04 0.00 0.00 64.34 61.66 1imt n VAL 34 Cb 0.46 -1.29 -0.03 0.00 -1.47 0.00 0.00 33.84 31.52 1imt n VAL 34 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1imt s GLY 35 N -1.76 1.14 0.46 7.63 0.00 0.25 -4.72 107.32 110.32 1imt s GLY 35 Ca 0.77 0.98 0.07 0.00 0.00 0.00 0.00 44.72 46.54 1imt s GLY 35 CO 0.47 3.45 0.63 -0.51 0.00 0.00 0.00 173.10 177.14 1imt s THR 36 N 5.71 2.86 -0.60 0.90 -4.23 -1.26 -0.52 115.64 118.50 1imt s THR 36 Ca 0.88 -0.94 -0.37 0.00 -1.18 0.00 0.00 61.69 60.08 1imt s THR 36 Cb -0.36 -2.92 -0.17 0.00 1.34 0.00 0.00 72.50 70.39 1imt s THR 36 CO 0.36 0.00 2.33 -1.20 -0.54 0.00 0.00 174.62 175.57 1imt n SER 37 N -1.98 1.09 0.00 3.99 7.64 -1.25 -0.59 113.62 122.52 1imt n SER 37 Ca 0.09 0.39 0.00 0.00 1.01 0.00 0.00 58.87 60.35 1imt n SER 37 Cb 0.59 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 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 6.88 2.02 3.77 0.23 0.00 0.30 -5.02 105.19 113.37 1imt n GLY 38 Ca 0.53 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.98 3.87 0.55 1.61 0.41 0.25 -4.66 118.70 119.74 1imt s GLU 39 Ca 0.00 2.00 -0.19 0.00 -0.41 0.00 0.00 54.97 56.37 1imt s GLU 39 Cb 0.00 -2.62 -0.06 0.00 -1.78 0.00 0.00 34.13 29.67 1imt s GLU 39 CO 0.00 -0.52 1.12 -0.51 -0.49 0.00 0.00 175.26 174.86 1imt s ASP 40 N -0.99 5.73 0.05 -0.19 1.01 -1.26 -0.64 116.67 120.38 1imt s ASP 40 Ca 0.60 2.15 -0.04 0.00 0.71 0.00 0.00 52.55 55.96 1imt s ASP 40 Cb -0.34 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 40.99 1imt s ASP 40 CO 0.43 -1.21 0.07 0.00 0.21 0.00 0.00 175.17 174.67 1imt s HIS 42 N -3.05 3.38 0.60 0.00 2.46 -1.26 -3.58 115.29 113.84 1imt s HIS 42 Ca -0.01 0.35 0.30 0.00 0.47 0.00 0.00 55.06 56.17 1imt s HIS 42 Cb 0.01 -2.24 1.70 0.00 -0.13 0.00 0.00 32.58 31.92 1imt s HIS 42 CO -0.07 0.19 2.10 -1.00 -2.47 0.00 0.00 174.74 173.50 1imt h PRO 43 N 6.99 0.00 -0.61 2.88 0.13 -1.95 0.11 132.00 139.55 1imt h PRO 43 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1imt h PRO 43 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1imt h PRO 43 CO 0.72 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.49 1imt n ALA 44 N -2.29 3.77 -1.60 -0.56 0.00 -1.26 -4.93 120.51 113.65 1imt n ALA 44 Ca 0.01 -1.77 -0.41 0.00 0.00 0.00 0.00 53.44 51.27 1imt n ALA 44 Cb 0.32 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 1imt n ALA 44 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1imt s SER 45 N -0.73 5.20 0.45 0.00 0.01 0.38 -4.90 113.70 114.12 1imt s SER 45 Ca 0.51 1.69 -0.23 0.00 1.31 0.00 0.00 55.95 59.23 1imt s SER 45 Cb 0.38 -2.51 -0.10 0.00 0.21 0.00 0.00 66.02 64.01 1imt s SER 45 CO 0.15 -2.19 0.90 1.41 0.41 0.00 0.00 173.24 173.92 1imt n HIS 46 N 12.74 0.73 -0.17 2.43 8.25 -1.26 -4.64 115.22 133.30 1imt n HIS 46 Ca 0.31 0.54 -0.19 0.00 -0.26 0.00 0.00 57.72 58.13 1imt n HIS 46 Cb 0.47 -2.16 0.18 0.00 1.12 0.00 0.00 29.99 29.61 1imt n HIS 46 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 1imt n LYS 47 N 0.05 -3.73 -4.88 -0.41 2.85 -1.26 -4.59 118.16 106.20 1imt n LYS 47 Ca 0.10 -0.91 -0.30 0.00 -1.05 0.00 0.00 58.31 56.16 1imt n LYS 47 Cb 0.41 -1.16 -0.15 0.00 -0.65 0.00 0.00 35.03 33.48 1imt n LYS 47 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1imt s ILE 48 N -1.70 2.08 0.11 0.58 1.01 -1.26 -3.51 121.20 118.50 1imt s ILE 48 Ca 0.41 -1.37 -0.30 0.00 0.00 0.00 0.00 60.65 59.40 1imt s ILE 48 Cb -0.07 -1.78 -0.06 0.00 0.01 0.00 0.00 42.46 40.56 1imt s ILE 48 CO 0.35 0.35 0.96 -2.16 0.00 0.00 0.00 174.94 174.43 1imt s PRO 49 N -1.23 4.69 -0.84 2.79 0.04 -1.26 -5.12 135.00 134.08 1imt s PRO 49 Ca 0.11 1.44 -0.14 0.00 0.04 0.00 0.00 61.00 62.45 1imt s PRO 49 Cb -0.10 -3.38 0.22 0.00 0.04 0.00 0.00 34.50 31.28 1imt s PRO 49 CO 0.02 0.22 0.79 0.12 0.04 0.00 0.00 177.00 178.18 1imt s PHE 50 N -0.01 3.74 -1.00 0.56 5.36 -1.23 -4.95 117.98 120.45 1imt s PHE 50 Ca 0.47 -1.98 -0.07 0.00 -0.96 0.00 0.00 56.93 54.40 1imt s PHE 50 Cb -0.23 -3.84 -0.07 0.00 -0.34 0.00 0.00 43.02 38.53 1imt s PHE 50 CO 0.30 -1.01 2.38 0.43 -1.46 0.00 0.00 175.22 175.85 1imt n SER 51 N 4.07 5.76 -2.73 6.13 7.64 -1.26 -3.51 113.62 129.73 1imt n SER 51 Ca 0.14 -2.37 -0.02 0.00 1.01 0.00 0.00 58.87 57.64 1imt n SER 51 Cb 0.47 -1.20 0.02 0.00 -1.01 0.00 0.00 64.21 62.49 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 3.61 0.76 3.55 0.23 0.00 -1.26 -5.03 105.19 107.04 1imt n GLY 52 Ca 0.52 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.04 3.18 0.68 1.61 -1.52 -1.26 -4.65 119.66 115.67 1imt s GLN 53 Ca 0.17 -0.24 -0.17 0.00 -1.95 0.00 0.00 55.36 53.17 1imt s GLN 53 Cb -0.02 -4.23 0.00 0.00 -0.22 0.00 0.00 33.01 28.54 1imt s GLN 53 CO 0.04 -2.17 1.17 0.54 -0.25 0.00 0.00 175.29 174.61 1imt n ARG 54 N 9.36 0.83 -0.22 2.91 1.74 -1.26 -4.96 116.66 125.06 1imt n ARG 54 Ca 0.05 0.34 0.09 0.00 -0.77 0.00 0.00 57.85 57.56 1imt n ARG 54 Cb 0.49 -2.41 0.18 0.00 -1.02 0.00 0.00 32.46 29.71 1imt n ARG 54 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1imt n MET 55 N -1.98 2.00 -4.01 5.56 2.81 -1.26 -4.58 117.12 115.67 1imt n MET 55 Ca 0.15 -2.64 -0.10 0.00 -1.81 0.00 0.00 57.70 53.30 1imt n MET 55 Cb 0.49 -1.62 -0.11 0.00 -0.71 0.00 0.00 33.22 31.27 1imt n MET 55 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 1imt s HIS 56 N -2.77 0.37 -0.68 2.03 3.76 -1.26 -4.97 115.29 111.77 1imt s HIS 56 Ca 0.35 -0.57 0.26 0.00 -0.15 0.00 0.00 55.06 54.94 1imt s HIS 56 Cb 0.29 -0.25 0.70 0.00 1.11 0.00 0.00 32.58 34.44 1imt s HIS 56 CO 0.05 -0.18 1.71 0.45 -0.85 0.00 0.00 174.74 175.92 1imt h HIS 57 N 4.48 0.00 -2.70 1.40 -0.00 -1.92 -0.08 115.15 116.33 1imt h HIS 57 Ca -0.33 0.00 -0.66 0.00 -0.00 0.00 0.00 60.37 59.38 1imt h HIS 57 Cb 1.20 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 28.55 1imt h HIS 57 CO 0.65 0.00 -0.46 0.95 -0.00 0.00 0.00 177.93 179.07 1imt s THR 58 N -3.12 5.46 0.21 2.45 -4.23 -1.26 -4.65 115.64 110.50 1imt s THR 58 Ca 0.10 0.21 0.03 0.00 -1.18 0.00 0.00 61.69 60.85 1imt s THR 58 Cb 0.11 -3.44 -0.03 0.00 1.34 0.00 0.00 72.50 70.48 1imt s THR 58 CO 0.62 0.57 0.34 0.00 -0.54 0.00 0.00 174.62 175.61 1imt s PRO 60 N -3.63 2.13 0.32 0.00 0.04 -1.26 -3.90 135.00 128.70 1imt s PRO 60 Ca 0.35 1.33 -0.29 0.00 0.04 0.00 0.00 61.00 62.43 1imt s PRO 60 Cb -0.10 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.46 1imt s PRO 60 CO 0.29 -1.76 1.40 0.00 0.04 0.00 0.00 177.00 176.97 1imt n ALA 62 N 1.16 0.28 -1.52 0.00 0.00 0.32 -4.72 120.51 116.04 1imt n ALA 62 Ca 0.02 0.45 -0.18 0.00 0.00 0.00 0.00 53.44 53.72 1imt n ALA 62 Cb 0.40 -2.18 -0.17 0.00 0.00 0.00 0.00 19.45 17.51 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 2.18 0.21 0.00 0.00 -0.02 -1.26 -0.19 135.00 135.91 1imt n PRO 63 Ca 0.14 -0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1imt n PRO 63 Cb 0.27 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1imt n PRO 63 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1imt n ASN 64 N 10.54 0.00 -4.80 2.55 3.02 -1.26 -5.14 115.26 120.17 1imt n ASN 64 Ca 0.59 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.81 1imt n ASN 64 Cb 0.25 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.41 1imt n ASN 64 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1imt s LEU 65 N 0.00 3.69 0.06 3.41 1.43 0.73 -4.84 118.68 123.16 1imt s LEU 65 Ca 0.00 1.89 0.09 0.00 -1.03 0.00 0.00 54.13 55.08 1imt s LEU 65 Cb 0.00 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.64 1imt s LEU 65 CO 0.00 -0.97 -0.23 0.00 0.23 0.00 0.00 176.35 175.37 1imt s ALA 66 N -2.18 2.01 -1.01 4.21 0.00 0.48 -4.57 121.76 120.71 1imt s ALA 66 Ca 0.66 -1.21 -0.21 0.00 0.00 0.00 0.00 51.96 51.20 1imt s ALA 66 Cb -0.17 -0.38 0.09 0.00 0.00 0.00 0.00 23.12 22.66 1imt s ALA 66 CO 0.28 0.46 1.34 0.00 0.00 0.00 0.00 175.76 177.84 1imt s VAL 68 N 3.87 5.37 0.54 0.00 0.11 0.14 -4.82 120.40 125.61 1imt s VAL 68 Ca 0.41 -0.21 -0.21 0.00 -2.93 0.00 0.00 61.98 59.05 1imt s VAL 68 Cb -0.02 -3.60 -0.05 0.00 -1.53 0.00 0.00 36.38 31.19 1imt s VAL 68 CO -0.08 0.21 1.24 0.00 -3.33 0.00 0.00 175.10 173.14 1imt s GLN 69 N -2.27 3.22 0.00 1.54 1.03 -1.26 -0.27 119.66 121.64 1imt s GLN 69 Ca 0.33 1.94 0.00 0.00 0.04 0.00 0.00 55.36 57.66 1imt s GLN 69 Cb -0.13 -2.15 0.00 0.00 0.03 0.00 0.00 33.01 30.76 1imt s GLN 69 CO 0.23 -1.04 0.00 0.25 -2.54 0.00 0.00 175.29 172.20 1imt n THR 70 N -1.14 0.00 -3.93 3.63 -2.24 0.55 -4.75 114.28 106.39 1imt n THR 70 Ca 0.11 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.79 1imt n THR 70 Cb 0.48 -0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.56 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 -2.76 0.11 -0.26 3.42 0.01 -0.25 -5.01 113.70 108.97 1imt s SER 71 Ca 0.00 -1.04 -0.39 0.00 1.31 0.00 0.00 55.95 55.82 1imt s SER 71 Cb 0.00 0.71 -0.15 0.00 0.21 0.00 0.00 66.02 66.79 1imt s SER 71 CO 0.00 -1.38 1.76 -2.65 0.41 0.00 0.00 173.24 171.38 1imt n PRO 72 N -0.48 1.27 -2.94 12.44 -0.02 -1.26 -0.56 135.00 143.45 1imt n PRO 72 Ca -0.04 0.47 -0.15 0.00 -2.02 0.00 0.00 63.50 61.76 1imt n PRO 72 Cb 0.61 -2.17 -0.01 0.00 -0.02 0.00 0.00 33.50 31.91 1imt n PRO 72 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1imt n LYS 73 N 5.51 -2.74 -3.82 -0.52 2.85 -1.26 -4.94 118.16 113.24 1imt n LYS 73 Ca 0.26 0.37 -0.27 0.00 -1.05 0.00 0.00 58.31 57.61 1imt n LYS 73 Cb 0.15 -4.98 -0.17 0.00 -0.65 0.00 0.00 35.03 29.39 1imt n LYS 73 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 1imt s LYS 74 N -5.53 1.04 0.12 -1.58 2.20 0.27 -5.04 119.74 111.22 1imt s LYS 74 Ca 0.20 -0.39 0.10 0.00 -0.36 0.00 0.00 55.97 55.53 1imt s LYS 74 Cb -0.11 -1.86 -0.04 0.00 -1.51 0.00 0.00 37.83 34.31 1imt s LYS 74 CO 0.25 -0.48 -0.25 -0.06 -0.36 0.00 0.00 175.35 174.45 1imt s PHE 75 N 1.76 2.13 0.14 4.03 0.40 -1.24 -0.33 117.98 124.87 1imt s PHE 75 Ca 0.01 -0.39 0.09 0.00 -0.60 0.00 0.00 56.93 56.04 1imt s PHE 75 Cb -0.15 -1.15 -0.04 0.00 0.51 0.00 0.00 43.02 42.18 1imt s PHE 75 CO -0.07 0.30 -0.21 0.15 0.70 0.00 0.00 175.22 176.08 1imt s LYS 76 N -2.02 1.27 -0.55 0.44 1.02 0.62 -0.44 119.74 120.08 1imt s LYS 76 Ca 0.11 -1.32 -0.26 0.00 0.02 0.00 0.00 55.97 54.53 1imt s LYS 76 Cb -0.10 -1.51 0.04 0.00 -0.52 0.00 0.00 37.83 35.74 1imt s LYS 76 CO 0.05 0.33 1.02 0.00 -0.92 0.00 0.00 175.35 175.84 1imt s LEU 78 N 4.25 1.86 -0.08 0.00 1.43 -0.27 -0.53 118.68 125.34 1imt s LEU 78 Ca 0.35 -1.34 -0.01 0.00 -1.03 0.00 0.00 54.13 52.10 1imt s LEU 78 Cb -0.11 -0.10 0.00 0.00 0.03 0.00 0.00 46.19 46.02 1imt s LEU 78 CO 0.22 -0.66 2.26 -1.20 0.23 0.00 0.00 176.35 177.20 1imt n SER 79 N -0.47 5.59 0.00 2.29 7.64 -1.26 -0.38 113.62 127.02 1imt n SER 79 Ca -0.02 -2.57 0.00 0.00 1.01 0.00 0.00 58.87 57.29 1imt n SER 79 Cb 0.66 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 1imt n SER 79 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32