#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ctl n ALA 2 N 0.00 0.00 -1.18 3.17 0.00 -1.26 -5.14 120.51 116.10 1ctl n ALA 2 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1ctl n ALA 2 Cb 0.00 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.68 1ctl n ALA 2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1ctl s GLN 3 N 0.75 -0.88 -0.09 0.00 0.74 -1.26 -4.76 119.66 114.15 1ctl s GLN 3 Ca 0.00 -0.05 -0.07 0.00 0.05 0.00 0.00 55.36 55.29 1ctl s GLN 3 Cb 0.00 -1.63 0.03 0.00 1.10 0.00 0.00 33.01 32.50 1ctl s GLN 3 CO 0.00 -3.49 0.13 1.17 -0.55 0.00 0.00 175.29 172.55 1ctl n LYS 4 N -4.60 -3.82 -4.65 1.67 4.81 -1.26 -5.05 118.16 105.25 1ctl n LYS 4 Ca 0.13 2.94 -0.23 0.00 -0.87 0.00 0.00 58.31 60.28 1ctl n LYS 4 Cb 0.59 -4.10 -0.15 0.00 0.02 0.00 0.00 35.03 31.39 1ctl n LYS 4 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1ctl s VAL 5 N -0.51 1.13 0.00 3.15 0.11 -1.26 -4.90 120.40 118.12 1ctl s VAL 5 Ca -0.15 -0.59 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 1ctl s VAL 5 Cb 0.01 -0.95 0.00 0.00 -1.53 0.00 0.00 36.38 33.91 1ctl s VAL 5 CO 0.41 0.32 0.00 0.61 -3.33 0.00 0.00 175.10 173.12 1ctl n GLY 6 N 2.87 0.54 0.07 6.54 0.00 -1.26 -4.96 105.19 108.97 1ctl n GLY 6 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 1ctl n GLY 6 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ctl h GLY 7 N 0.00 0.00 -1.55 -0.02 0.00 -1.99 -3.47 103.07 96.04 1ctl h GLY 7 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 1ctl h GLY 7 CO 0.00 0.00 0.32 -0.45 0.00 0.00 0.00 176.54 176.41 1ctl s SER 8 N -6.46 3.56 -0.24 0.19 0.15 -1.26 -4.91 113.70 104.73 1ctl s SER 8 Ca -0.01 2.31 -0.13 0.00 0.70 0.00 0.00 55.95 58.82 1ctl s SER 8 Cb 0.09 -2.58 0.08 0.00 -1.71 0.00 0.00 66.02 61.90 1ctl s SER 8 CO 0.82 -2.68 0.57 -1.81 1.20 0.00 0.00 173.24 171.34 1ctl s ASP 9 N -2.29 -0.77 0.44 5.45 1.01 -0.96 -5.04 116.67 114.51 1ctl s ASP 9 Ca 0.71 1.26 0.07 0.00 0.71 0.00 0.00 52.55 55.31 1ctl s ASP 9 Cb -0.27 1.22 -0.02 0.00 1.01 0.00 0.00 42.92 44.85 1ctl s ASP 9 CO 0.52 -0.22 0.32 -0.83 0.21 0.00 0.00 175.17 175.16 1ctl s GLY 10 N 1.68 2.25 -0.33 0.21 0.00 -1.26 -1.27 107.32 108.60 1ctl s GLY 10 Ca -0.09 -1.85 0.02 0.00 0.00 0.00 0.00 44.72 42.80 1ctl s GLY 10 CO -0.17 -1.82 0.06 0.00 0.00 0.00 0.00 173.10 171.17 1ctl n PRO 12 N 4.46 0.10 -0.04 0.00 -0.02 -1.26 -1.64 135.00 136.59 1ctl n PRO 12 Ca 0.01 0.59 -0.01 0.00 -2.02 0.00 0.00 63.50 62.07 1ctl n PRO 12 Cb 0.42 -1.81 -0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1ctl n PRO 12 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ctl h ARG 13 N 0.00 0.00 0.00 -0.52 3.08 -1.89 -3.39 114.38 111.67 1ctl h ARG 13 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 1ctl h ARG 13 Cb 0.01 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1ctl h ARG 13 CO 0.00 0.00 -1.01 0.00 -1.07 0.00 0.00 179.97 177.89 1ctl n GLY 15 N 1.33 1.53 3.91 0.00 0.00 -0.65 -5.11 105.19 106.19 1ctl n GLY 15 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1ctl n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ctl s GLN 16 N 0.00 0.80 0.12 1.61 -1.52 -1.15 -4.81 119.66 114.71 1ctl s GLN 16 Ca 0.00 -0.28 0.05 0.00 -1.95 0.00 0.00 55.36 53.18 1ctl s GLN 16 Cb 0.00 -1.85 -0.04 0.00 -0.22 0.00 0.00 33.01 30.90 1ctl s GLN 16 CO 0.00 -2.33 -0.12 0.00 -0.25 0.00 0.00 175.29 172.59 1ctl s ALA 17 N -3.78 1.39 -0.03 6.09 0.00 -1.26 0.58 121.76 124.74 1ctl s ALA 17 Ca 0.71 -1.29 0.02 0.00 0.00 0.00 0.00 51.96 51.40 1ctl s ALA 17 Cb -0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.00 1ctl s ALA 17 CO 0.52 0.04 -0.06 0.08 0.00 0.00 0.00 175.76 176.34 1ctl s VAL 18 N -2.38 3.76 0.00 0.00 1.01 -0.40 -4.86 120.40 117.54 1ctl s VAL 18 Ca 0.09 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1ctl s VAL 18 Cb -0.03 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.75 1ctl s VAL 18 CO 0.02 0.50 0.00 -1.22 0.00 0.00 0.00 175.10 174.40 1ctl n TYR 19 N 1.87 0.00 -0.15 5.22 4.01 -1.26 -2.26 117.16 124.59 1ctl n TYR 19 Ca -0.17 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.63 1ctl n TYR 19 Cb 0.53 0.00 0.27 0.00 -0.31 0.00 0.00 39.34 39.82 1ctl n TYR 19 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ctl n ALA 20 N -1.79 3.24 -2.60 -0.72 0.00 -1.26 -4.84 120.51 112.55 1ctl n ALA 20 Ca 0.00 -1.22 -0.03 0.00 0.00 0.00 0.00 53.44 52.20 1ctl n ALA 20 Cb 0.41 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.78 1ctl n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ctl n ALA 21 N 0.54 -3.58 -1.56 0.00 0.00 -1.26 -4.96 120.51 109.69 1ctl n ALA 21 Ca 0.19 1.33 0.07 0.00 0.00 0.00 0.00 53.44 55.02 1ctl n ALA 21 Cb 0.80 -2.60 0.17 0.00 0.00 0.00 0.00 19.45 17.82 1ctl n ALA 21 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ctl n GLU 22 N 1.10 1.29 -3.22 0.00 1.02 -1.26 -5.04 120.64 114.53 1ctl n GLU 22 Ca -0.19 -2.90 -0.42 0.00 -0.02 0.00 0.00 57.16 53.63 1ctl n GLU 22 Cb 0.29 -1.39 -0.08 0.00 -0.02 0.00 0.00 31.44 30.24 1ctl n GLU 22 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1ctl s LYS 23 N -2.71 3.42 0.25 3.49 0.00 -1.25 -0.35 119.74 122.58 1ctl s LYS 23 Ca 0.34 -0.35 -0.04 0.00 0.00 0.00 0.00 55.97 55.93 1ctl s LYS 23 Cb 0.33 -3.88 0.06 0.00 0.00 0.00 0.00 37.83 34.34 1ctl s LYS 23 CO -0.05 -0.79 0.33 1.33 0.00 0.00 0.00 175.35 176.18 1ctl n VAL 24 N 5.54 0.00 -3.88 1.79 0.24 0.19 -4.83 118.33 117.38 1ctl n VAL 24 Ca -0.04 -0.26 -0.11 0.00 -2.04 0.00 0.00 64.34 61.88 1ctl n VAL 24 Cb 0.48 -1.83 -0.12 0.00 -1.47 0.00 0.00 33.84 30.91 1ctl n VAL 24 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 1ctl s ILE 25 N -1.66 0.04 -0.33 1.34 1.10 -1.26 -1.86 121.20 118.58 1ctl s ILE 25 Ca 0.19 -0.36 -0.01 0.00 -0.51 0.00 0.00 60.65 59.96 1ctl s ILE 25 Cb -0.01 -0.22 0.11 0.00 0.15 0.00 0.00 42.46 42.50 1ctl s ILE 25 CO 0.13 -0.20 0.15 -0.83 -2.11 0.00 0.00 174.94 172.09 1ctl s GLY 26 N -0.61 0.88 0.00 1.50 0.00 -0.02 -4.85 107.32 104.21 1ctl s GLY 26 Ca -0.07 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.03 1ctl s GLY 26 CO 0.00 1.89 0.00 0.00 0.00 0.00 0.00 173.10 174.99 1ctl n ALA 27 N 4.64 0.00 -2.44 3.20 0.00 -1.26 -0.50 120.51 124.15 1ctl n ALA 27 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.35 1ctl n ALA 27 Cb 0.40 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.89 1ctl n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ctl n GLY 28 N 0.00 3.90 3.49 0.00 0.00 -1.26 -5.07 105.19 106.26 1ctl n GLY 28 Ca 0.00 -1.78 -0.23 0.00 0.00 0.00 0.00 46.02 44.01 1ctl n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ctl s LYS 29 N -3.61 1.72 -0.09 1.61 3.01 0.35 -5.14 119.74 117.58 1ctl s LYS 29 Ca 0.38 -1.94 -0.05 0.00 -1.01 0.00 0.00 55.97 53.35 1ctl s LYS 29 Cb 0.36 -1.18 0.04 0.00 -1.01 0.00 0.00 37.83 36.04 1ctl s LYS 29 CO -0.01 -0.08 0.22 0.45 0.51 0.00 0.00 175.35 176.45 1ctl s SER 30 N -3.54 -0.23 0.17 2.83 0.15 -1.26 -0.84 113.70 110.98 1ctl s SER 30 Ca 0.34 0.47 0.06 0.00 0.70 0.00 0.00 55.95 57.53 1ctl s SER 30 Cb 0.08 0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 64.72 1ctl s SER 30 CO 0.15 -0.15 -0.13 0.26 1.20 0.00 0.00 173.24 174.58 1ctl s TRP 31 N 1.05 1.48 0.47 3.44 0.52 -0.78 -4.04 118.94 121.09 1ctl s TRP 31 Ca -0.08 -0.65 -0.22 0.00 0.02 0.00 0.00 56.10 55.17 1ctl s TRP 31 Cb -0.09 -0.72 -0.07 0.00 -1.15 0.00 0.00 33.47 31.43 1ctl s TRP 31 CO -0.07 0.22 1.12 -1.01 0.02 0.00 0.00 176.95 177.23 1ctl s HIS 32 N -3.04 2.92 -1.00 -1.98 3.76 -1.24 0.53 115.29 115.23 1ctl s HIS 32 Ca 0.19 1.56 -0.18 0.00 -0.15 0.00 0.00 55.06 56.48 1ctl s HIS 32 Cb 0.00 -3.26 -0.09 0.00 1.11 0.00 0.00 32.58 30.34 1ctl s HIS 32 CO 0.04 -1.25 2.05 0.36 -0.85 0.00 0.00 174.74 175.09 1ctl n LYS 33 N -0.66 1.98 0.00 1.40 -0.00 0.53 -2.16 118.16 119.25 1ctl n LYS 33 Ca 0.08 -2.04 0.00 0.00 -0.00 0.00 0.00 58.31 56.35 1ctl n LYS 33 Cb 0.50 -2.99 0.00 0.00 -0.00 0.00 0.00 35.03 32.54 1ctl n LYS 33 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1ctl n SER 34 N 6.75 0.00 -1.36 -5.58 2.88 -1.26 -4.92 113.62 110.13 1ctl n SER 34 Ca 0.51 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 58.11 1ctl n SER 34 Cb 0.38 0.00 0.28 0.00 -0.75 0.00 0.00 64.21 64.11 1ctl n SER 34 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ctl n PHE 36 N 0.64 3.02 -3.25 0.00 -0.00 -1.24 -4.86 117.46 111.76 1ctl n PHE 36 Ca 0.20 -2.95 -0.41 0.00 -0.00 0.00 0.00 57.45 54.29 1ctl n PHE 36 Cb 0.80 -1.34 -0.08 0.00 -0.00 0.00 0.00 39.48 38.86 1ctl n PHE 36 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1ctl s ARG 37 N -2.43 3.81 -0.24 -4.13 0.52 -1.26 -1.73 118.95 113.49 1ctl s ARG 37 Ca 0.31 0.03 -0.28 0.00 -0.52 0.00 0.00 55.73 55.27 1ctl s ARG 37 Cb 0.01 -3.74 -0.05 0.00 0.52 0.00 0.00 34.95 31.69 1ctl s ARG 37 CO 0.06 -0.52 2.23 0.00 0.02 0.00 0.00 175.30 177.09 1ctl h ALA 39 N 15.36 1.09 0.17 0.00 0.00 -1.86 -0.83 119.26 133.20 1ctl h ALA 39 Ca -0.40 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1ctl h ALA 39 Cb 1.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ctl h ALA 39 CO 0.97 0.13 -0.08 -0.22 0.00 0.00 0.00 179.25 180.05 1ctl h LYS 40 N 0.00 -0.22 0.00 0.00 3.64 -1.87 -3.39 116.57 114.73 1ctl h LYS 40 Ca -0.00 0.02 -0.27 0.00 -1.27 0.00 0.00 60.65 59.13 1ctl h LYS 40 Cb 0.47 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 1ctl h LYS 40 CO 0.01 -0.15 -1.63 0.00 -2.27 0.00 0.00 179.45 175.41 1ctl n GLY 42 N 1.52 1.23 3.71 0.00 0.00 -0.32 -5.09 105.19 106.25 1ctl n GLY 42 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1ctl n GLY 42 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ctl s LYS 43 N 0.00 4.26 -0.54 1.61 2.36 -1.22 -4.70 119.74 121.51 1ctl s LYS 43 Ca 0.00 2.21 -0.24 0.00 -2.55 0.00 0.00 55.97 55.40 1ctl s LYS 43 Cb 0.00 -3.25 0.04 0.00 -1.05 0.00 0.00 37.83 33.57 1ctl s LYS 43 CO 0.00 -0.54 0.91 -1.54 1.55 0.00 0.00 175.35 175.73 1ctl s SER 44 N 1.27 6.33 0.05 1.43 1.04 -1.26 -1.57 113.70 120.99 1ctl s SER 44 Ca 0.68 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.71 1ctl s SER 44 Cb -0.40 -2.42 -0.00 0.00 0.10 0.00 0.00 66.02 63.30 1ctl s SER 44 CO 0.31 -1.18 0.01 0.00 0.98 0.00 0.00 173.24 173.35 1ctl n LEU 45 N 7.31 0.00 0.00 2.42 -0.00 -0.70 -4.97 117.00 121.05 1ctl n LEU 45 Ca 0.01 -0.38 -0.09 0.00 -0.00 0.00 0.00 56.01 55.55 1ctl n LEU 45 Cb 0.47 0.09 -0.03 0.00 -0.00 0.00 0.00 43.42 43.96 1ctl n LEU 45 CO 0.63 -0.06 -0.06 -0.62 -0.00 0.00 0.00 177.39 177.28 1ctl n GLU 46 N -0.13 0.75 -0.75 1.47 4.71 -1.26 -3.86 120.64 121.57 1ctl n GLU 46 Ca -0.01 -1.25 -0.28 0.00 -0.01 0.00 0.00 57.16 55.60 1ctl n GLU 46 Cb 0.07 0.71 0.23 0.00 -1.01 0.00 0.00 31.44 31.45 1ctl n GLU 46 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 1ctl s SER 47 N -1.91 1.33 -0.73 1.62 0.01 -1.26 -3.11 113.70 109.66 1ctl s SER 47 Ca 0.08 1.33 0.00 0.00 1.31 0.00 0.00 55.95 58.68 1ctl s SER 47 Cb 0.00 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 64.16 1ctl s SER 47 CO 0.06 -3.95 0.00 0.35 0.41 0.00 0.00 173.24 170.10 1ctl n THR 48 N -4.74 0.00 -2.70 1.44 -2.24 -1.26 -4.57 114.28 100.22 1ctl n THR 48 Ca 0.04 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.78 1ctl n THR 48 Cb 0.56 -1.28 0.11 0.00 -2.10 0.00 0.00 70.33 67.61 1ctl n THR 48 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ctl n THR 49 N -2.05 0.28 -4.47 4.28 -2.24 -1.18 -5.01 114.28 103.89 1ctl n THR 49 Ca -0.07 -1.58 -0.23 0.00 -2.27 0.00 0.00 64.05 59.90 1ctl n THR 49 Cb 0.54 1.03 -0.09 0.00 -2.10 0.00 0.00 70.33 69.70 1ctl n THR 49 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1ctl s LEU 50 N -3.78 2.01 -0.30 3.22 0.05 -1.25 0.26 118.68 118.88 1ctl s LEU 50 Ca 0.16 -1.54 -0.12 0.00 0.05 0.00 0.00 54.13 52.68 1ctl s LEU 50 Cb 0.42 -0.18 0.15 0.00 -2.05 0.00 0.00 46.19 44.53 1ctl s LEU 50 CO -0.09 -0.80 0.83 0.00 -0.55 0.00 0.00 176.35 175.75 1ctl s ALA 51 N -3.31 -2.43 0.43 1.48 0.00 0.49 -4.03 121.76 114.39 1ctl s ALA 51 Ca 0.30 2.16 0.06 0.00 0.00 0.00 0.00 51.96 54.48 1ctl s ALA 51 Cb 0.05 -1.95 0.01 0.00 0.00 0.00 0.00 23.12 21.23 1ctl s ALA 51 CO 0.15 -0.96 0.59 0.16 0.00 0.00 0.00 175.76 175.69 1ctl s ASP 52 N 2.66 5.65 0.00 0.00 -4.77 -1.26 -1.17 116.67 117.78 1ctl s ASP 52 Ca -0.03 -0.29 0.00 0.00 -3.30 0.00 0.00 52.55 48.92 1ctl s ASP 52 Cb -0.09 -0.81 0.00 0.00 -1.09 0.00 0.00 42.92 40.93 1ctl s ASP 52 CO -0.18 -0.77 0.00 1.17 0.70 0.00 0.00 175.17 176.09 1ctl n LYS 53 N -1.91 0.00 -1.57 2.11 0.00 -0.05 -4.90 118.16 111.84 1ctl n LYS 53 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 58.31 58.18 1ctl n LYS 53 Cb 0.59 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.54 1ctl n LYS 53 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ctl n ASP 54 N 0.00 -5.44 0.00 3.14 8.00 -1.26 -1.75 116.55 119.24 1ctl n ASP 54 Ca 0.00 0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.99 1ctl n ASP 54 Cb 0.00 -4.67 0.00 0.00 -0.02 0.00 0.00 41.12 36.43 1ctl n ASP 54 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ctl n GLY 55 N -0.45 3.41 3.90 0.44 0.00 -1.26 -5.02 105.19 106.19 1ctl n GLY 55 Ca -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 1ctl n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ctl s GLU 56 N -0.85 2.68 -0.02 1.61 2.56 -0.72 -5.05 118.70 118.92 1ctl s GLU 56 Ca 0.00 -1.38 -0.03 0.00 0.00 0.00 0.00 54.97 53.57 1ctl s GLU 56 Cb 0.00 -2.50 0.00 0.00 2.00 0.00 0.00 34.13 33.63 1ctl s GLU 56 CO 0.00 -0.10 0.06 0.96 -0.56 0.00 0.00 175.26 175.63 1ctl s ILE 57 N -2.38 0.02 0.21 -3.70 -4.36 -1.26 -0.87 121.20 108.87 1ctl s ILE 57 Ca 0.47 -0.19 0.03 0.00 -0.26 0.00 0.00 60.65 60.69 1ctl s ILE 57 Cb -0.06 -0.16 -0.01 0.00 1.25 0.00 0.00 42.46 43.49 1ctl s ILE 57 CO 0.28 -0.11 0.10 0.00 0.24 0.00 0.00 174.94 175.46 1ctl n TYR 58 N 2.69 -0.06 -4.17 1.37 4.11 -0.32 -3.78 117.16 116.99 1ctl n TYR 58 Ca -0.15 -1.47 -0.23 0.00 -0.00 0.00 0.00 57.90 56.06 1ctl n TYR 58 Cb 0.59 0.04 -0.06 0.00 -0.00 0.00 0.00 39.34 39.90 1ctl n TYR 58 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1ctl n LYS 60 N -1.05 0.14 0.00 0.00 4.81 0.14 -1.87 118.16 120.33 1ctl n LYS 60 Ca -0.05 0.19 0.03 0.00 -0.87 0.00 0.00 58.31 57.60 1ctl n LYS 60 Cb 0.60 -1.69 0.13 0.00 0.02 0.00 0.00 35.03 34.09 1ctl n LYS 60 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ctl n GLY 61 N 1.00 -0.70 0.88 3.14 0.00 -1.25 -1.02 105.19 107.24 1ctl n GLY 61 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 1ctl n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ctl h TYR 63 N -0.14 0.00 0.00 0.00 3.20 -1.50 0.24 116.97 118.77 1ctl h TYR 63 Ca -0.09 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.78 1ctl h TYR 63 Cb 1.04 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.31 1ctl h TYR 63 CO -0.01 0.00 -0.15 0.00 -1.64 0.00 0.00 178.16 176.36 1ctl h ALA 64 N 1.99 0.00 0.00 1.82 0.00 -1.26 -3.22 119.26 118.59 1ctl h ALA 64 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1ctl h ALA 64 Cb 0.01 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ctl h ALA 64 CO 0.00 0.15 0.00 1.17 0.00 0.00 0.00 179.25 180.57 1ctl n LYS 65 N -3.08 0.08 -2.71 0.00 4.81 -0.70 -1.92 118.16 114.64 1ctl n LYS 65 Ca -0.02 0.56 -0.07 0.00 -0.87 0.00 0.00 58.31 57.91 1ctl n LYS 65 Cb 0.08 -1.75 0.04 0.00 0.02 0.00 0.00 35.03 33.42 1ctl n LYS 65 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1ctl n ASN 66 N -1.92 1.21 -4.68 3.14 3.02 0.75 -5.03 115.26 111.75 1ctl n ASN 66 Ca -0.00 -2.51 -0.42 0.00 -0.03 0.00 0.00 54.58 51.61 1ctl n ASN 66 Cb 0.03 -0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 38.78 1ctl n ASN 66 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1ctl s PHE 67 N -3.02 3.48 -0.17 3.10 5.36 -0.81 -4.60 117.98 121.32 1ctl s PHE 67 Ca 0.26 1.49 -0.12 0.00 -0.96 0.00 0.00 56.93 57.61 1ctl s PHE 67 Cb 0.42 -3.14 0.04 0.00 -0.34 0.00 0.00 43.02 40.00 1ctl s PHE 67 CO 0.01 -0.24 0.23 0.41 -1.46 0.00 0.00 175.22 174.17 1ctl n GLY 68 N 3.20 -5.27 3.40 13.12 0.00 -1.26 -4.99 105.19 113.40 1ctl n GLY 68 Ca 0.08 1.65 -0.31 0.00 0.00 0.00 0.00 46.02 47.44 1ctl n GLY 68 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ctl n PRO 69 N 1.65 -1.68 -4.37 1.61 -0.02 -1.26 -5.07 135.00 125.85 1ctl n PRO 69 Ca -0.39 -0.46 -0.25 0.00 -2.02 0.00 0.00 63.50 60.38 1ctl n PRO 69 Cb 0.60 -1.96 -0.12 0.00 -0.02 0.00 0.00 33.50 32.01 1ctl n PRO 69 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1ctl s LYS 70 N -3.94 1.38 0.00 -0.52 -0.14 -1.26 -5.11 119.74 110.15 1ctl s LYS 70 Ca 0.62 -1.43 0.00 0.00 -1.36 0.00 0.00 55.97 53.80 1ctl s LYS 70 Cb -0.19 -1.60 0.00 0.00 -1.68 0.00 0.00 37.83 34.36 1ctl s LYS 70 CO 0.65 0.34 0.00 0.41 -0.76 0.00 0.00 175.35 176.00 1ctl n GLY 71 N 0.39 1.42 3.63 -3.33 0.00 -1.26 -4.98 105.19 101.07 1ctl n GLY 71 Ca -0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 1ctl n GLY 71 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ctl s PHE 72 N 0.00 2.70 0.00 1.61 -0.12 -1.26 -5.13 117.98 115.77 1ctl s PHE 72 Ca 0.00 -0.21 0.00 0.00 -0.05 0.00 0.00 56.93 56.67 1ctl s PHE 72 Cb 0.00 -1.22 0.00 0.00 -0.63 0.00 0.00 43.02 41.17 1ctl s PHE 72 CO 0.00 0.60 0.00 0.41 -0.05 0.00 0.00 175.22 176.18 1ctl n GLY 73 N -0.69 3.35 3.15 1.99 0.00 -1.26 -5.16 105.19 106.57 1ctl n GLY 73 Ca -0.07 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 1ctl n GLY 73 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ctl s PHE 74 N 4.00 -0.43 0.00 1.61 0.40 -1.26 -5.11 117.98 117.19 1ctl s PHE 74 Ca 0.00 0.97 0.00 0.00 -0.60 0.00 0.00 56.93 57.30 1ctl s PHE 74 Cb 0.00 0.14 0.00 0.00 0.51 0.00 0.00 43.02 43.67 1ctl s PHE 74 CO 0.00 -0.26 0.00 0.41 0.70 0.00 0.00 175.22 176.07 1ctl n GLY 75 N 4.05 1.17 3.73 4.36 0.00 -1.26 -5.14 105.19 112.10 1ctl n GLY 75 Ca -0.23 0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1ctl n GLY 75 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ctl s GLN 76 N -0.09 4.22 0.00 1.61 0.74 -1.26 -4.87 119.66 120.01 1ctl s GLN 76 Ca 0.00 -0.08 0.00 0.00 0.05 0.00 0.00 55.36 55.33 1ctl s GLN 76 Cb 0.00 -3.42 0.00 0.00 1.10 0.00 0.00 33.01 30.69 1ctl s GLN 76 CO 0.00 0.27 0.00 0.41 -0.55 0.00 0.00 175.29 175.42 1ctl n GLY 77 N 3.47 -0.59 3.62 2.59 0.00 -1.26 -5.17 105.19 107.85 1ctl n GLY 77 Ca -0.14 0.12 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 1ctl n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ctl s ALA 78 N 0.00 -2.34 -0.25 4.61 0.00 -1.26 -5.18 121.76 117.35 1ctl s ALA 78 Ca 0.00 2.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.85 1ctl s ALA 78 Cb 0.00 -1.76 0.17 0.00 0.00 0.00 0.00 23.12 21.54 1ctl s ALA 78 CO 0.00 -0.41 1.25 0.20 0.00 0.00 0.00 175.76 176.80 1ctl s GLY 79 N 1.44 -0.03 0.00 0.00 0.00 -1.26 -5.18 107.32 102.29 1ctl s GLY 79 Ca -0.08 2.55 0.00 0.00 0.00 0.00 0.00 44.72 47.19 1ctl s GLY 79 CO -0.15 1.06 0.00 0.00 0.00 0.00 0.00 173.10 174.02 1ctl n ALA 80 N 0.56 0.00 -2.43 3.20 0.00 -1.26 -4.91 120.51 115.67 1ctl n ALA 80 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.39 1ctl n ALA 80 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.02 1ctl n ALA 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ctl n LEU 81 N 0.00 -6.55 -4.09 0.00 0.00 -1.26 -5.05 117.00 100.06 1ctl n LEU 81 Ca 0.00 2.73 -0.25 0.00 0.00 0.00 0.00 56.01 58.49 1ctl n LEU 81 Cb 0.00 -3.29 -0.16 0.00 0.00 0.00 0.00 43.42 39.97 1ctl n LEU 81 CO 0.00 -3.29 -0.48 0.27 0.00 0.00 0.00 177.39 173.89 1ctl s ILE 82 N -0.62 1.25 -0.23 1.96 -5.25 -1.26 -5.03 121.20 112.01 1ctl s ILE 82 Ca -0.09 -0.60 -0.06 0.00 -0.99 0.00 0.00 60.65 58.92 1ctl s ILE 82 Cb 0.01 -1.09 -0.18 0.00 2.95 0.00 0.00 42.46 44.14 1ctl s ILE 82 CO 0.23 0.37 -0.09 1.57 -1.79 0.00 0.00 174.94 175.23 1ctl n HIS 83 N 3.32 0.37 -4.33 1.37 -0.00 -1.26 -4.91 115.22 109.78 1ctl n HIS 83 Ca -0.19 0.10 -0.28 0.00 -0.00 0.00 0.00 57.72 57.35 1ctl n HIS 83 Cb 0.53 -1.05 -0.11 0.00 -0.00 0.00 0.00 29.99 29.36 1ctl n HIS 83 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 1ctl s SER 84 N -6.88 3.83 0.00 0.26 0.01 -1.26 -5.38 113.70 104.28 1ctl s SER 84 Ca -0.33 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.29 1ctl s SER 84 Cb 0.09 -0.50 0.00 0.00 0.21 0.00 0.00 66.02 65.83 1ctl s SER 84 CO 0.61 0.15 0.00 1.67 0.41 0.00 0.00 173.24 176.08