#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ctl s ALA 2 N 0.00 3.38 0.46 3.17 0.00 -1.26 -5.01 121.76 122.50 1ctl s ALA 2 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1ctl s ALA 2 Cb 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.94 1ctl s ALA 2 CO 0.00 0.52 0.00 0.94 0.00 0.00 0.00 175.76 177.22 1ctl n GLN 3 N -0.15 -3.47 -4.28 0.00 7.27 -1.26 -4.83 117.38 110.66 1ctl n GLN 3 Ca -0.09 2.66 -0.22 0.00 0.07 0.00 0.00 57.00 59.42 1ctl n GLN 3 Cb 0.55 -3.21 -0.12 0.00 2.41 0.00 0.00 30.24 29.86 1ctl n GLN 3 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1ctl s LYS 4 N -4.82 1.03 -1.38 3.69 1.02 -1.26 -4.80 119.74 113.23 1ctl s LYS 4 Ca 0.00 -1.06 -0.08 0.00 0.02 0.00 0.00 55.97 54.85 1ctl s LYS 4 Cb 0.00 -1.19 0.01 0.00 -0.52 0.00 0.00 37.83 36.13 1ctl s LYS 4 CO 0.00 0.28 1.11 1.55 -0.92 0.00 0.00 175.35 177.37 1ctl n VAL 5 N 1.25 -2.86 0.00 3.17 3.14 -1.26 -4.74 118.33 117.02 1ctl n VAL 5 Ca -0.20 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.18 1ctl n VAL 5 Cb 0.54 -3.93 0.00 0.00 -1.06 0.00 0.00 33.84 29.39 1ctl n VAL 5 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ctl n GLY 6 N -1.95 3.45 0.00 7.55 0.00 -1.26 -5.15 105.19 107.82 1ctl n GLY 6 Ca -0.01 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1ctl n GLY 6 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ctl n GLY 7 N -0.22 0.44 1.78 -0.02 0.00 -1.26 -4.98 105.19 100.94 1ctl n GLY 7 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1ctl n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ctl n SER 8 N 0.00 -7.29 -3.56 1.61 2.88 -1.26 -4.75 113.62 101.25 1ctl n SER 8 Ca 0.00 1.15 -0.04 0.00 -1.33 0.00 0.00 58.87 58.64 1ctl n SER 8 Cb 0.00 -4.03 -0.06 0.00 -0.75 0.00 0.00 64.21 59.37 1ctl n SER 8 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1ctl s ASP 9 N -0.40 -0.68 0.43 -3.46 1.47 -0.95 -4.85 116.67 108.23 1ctl s ASP 9 Ca 0.00 1.12 0.07 0.00 1.18 0.00 0.00 52.55 54.92 1ctl s ASP 9 Cb 0.00 1.79 -0.02 0.00 -0.34 0.00 0.00 42.92 44.34 1ctl s ASP 9 CO 0.00 -0.24 0.35 -0.83 0.68 0.00 0.00 175.17 175.13 1ctl s GLY 10 N 2.74 2.19 -0.31 2.12 0.00 -1.26 -1.22 107.32 111.59 1ctl s GLY 10 Ca 0.01 -1.90 0.03 0.00 0.00 0.00 0.00 44.72 42.86 1ctl s GLY 10 CO -0.16 -1.76 0.01 0.00 0.00 0.00 0.00 173.10 171.19 1ctl h PRO 12 N 7.75 0.00 0.00 0.00 0.13 -1.79 -1.75 132.00 136.34 1ctl h PRO 12 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1ctl h PRO 12 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1ctl h PRO 12 CO 0.49 0.00 -0.05 -0.09 -0.23 0.00 0.00 178.00 178.12 1ctl h ARG 13 N 0.00 0.00 0.00 0.86 1.12 -1.89 -3.39 114.38 111.08 1ctl h ARG 13 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1ctl h ARG 13 Cb 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.03 1ctl h ARG 13 CO 0.00 0.00 -0.55 0.00 -3.11 0.00 0.00 179.97 176.31 1ctl n GLY 15 N 1.34 0.55 3.91 0.00 0.00 -0.66 -5.08 105.19 105.25 1ctl n GLY 15 Ca 0.04 -0.70 -0.21 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.31 3.16 0.11 1.61 1.11 -1.19 -4.96 119.66 118.19 1ctl s GLN 16 Ca 0.00 -0.94 0.10 0.00 0.01 0.00 0.00 55.36 54.53 1ctl s GLN 16 Cb 0.00 -2.73 -0.04 0.00 -1.01 0.00 0.00 33.01 29.23 1ctl s GLN 16 CO 0.00 0.34 -0.26 0.00 0.01 0.00 0.00 175.29 175.38 1ctl s ALA 17 N -2.09 2.36 -0.00 6.09 0.00 -1.26 0.58 121.76 127.44 1ctl s ALA 17 Ca 0.36 -1.42 0.02 0.00 0.00 0.00 0.00 51.96 50.93 1ctl s ALA 17 Cb -0.08 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 1ctl s ALA 17 CO 0.28 0.54 -0.04 0.08 0.00 0.00 0.00 175.76 176.61 1ctl s VAL 18 N -1.00 3.83 -0.02 0.00 1.01 -0.36 -4.88 120.40 118.98 1ctl s VAL 18 Ca 0.14 -0.69 -0.00 0.00 0.00 0.00 0.00 61.98 61.42 1ctl s VAL 18 Cb -0.10 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.60 1ctl s VAL 18 CO 0.05 0.40 -0.02 -1.22 0.00 0.00 0.00 175.10 174.31 1ctl n TYR 19 N 1.54 0.00 0.10 5.22 4.02 -1.26 -2.24 117.16 124.54 1ctl n TYR 19 Ca -0.15 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.78 1ctl n TYR 19 Cb 0.53 -0.06 0.22 0.00 -0.02 0.00 0.00 39.34 40.01 1ctl n TYR 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1ctl n ALA 20 N -2.84 1.08 -2.59 -0.72 0.00 -1.26 -4.69 120.51 109.49 1ctl n ALA 20 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.46 1ctl n ALA 20 Cb 0.53 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 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 -1.60 -3.51 -1.26 0.00 0.00 -1.26 -4.94 120.51 107.93 1ctl n ALA 21 Ca -0.00 0.93 -0.10 0.00 0.00 0.00 0.00 53.44 54.27 1ctl n ALA 21 Cb 0.03 -1.82 0.22 0.00 0.00 0.00 0.00 19.45 17.88 1ctl n ALA 21 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ctl n GLU 22 N 0.89 2.43 -2.52 0.00 4.07 -1.26 -5.04 120.64 119.20 1ctl n GLU 22 Ca -0.10 -3.08 -0.42 0.00 -0.06 0.00 0.00 57.16 53.50 1ctl n GLU 22 Cb 0.16 -2.01 -0.03 0.00 -0.06 0.00 0.00 31.44 29.49 1ctl n GLU 22 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 1ctl s LYS 23 N -3.18 4.48 0.00 5.31 0.00 -1.25 -1.15 119.74 123.95 1ctl s LYS 23 Ca 0.50 1.65 0.00 0.00 0.00 0.00 0.00 55.97 58.12 1ctl s LYS 23 Cb 0.43 -3.38 0.00 0.00 0.00 0.00 0.00 37.83 34.88 1ctl s LYS 23 CO 0.07 -0.18 0.00 1.33 0.00 0.00 0.00 175.35 176.57 1ctl n VAL 24 N 3.87 0.00 -3.62 1.79 0.24 0.99 -4.91 118.33 116.68 1ctl n VAL 24 Ca 0.08 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.25 1ctl n VAL 24 Cb 0.48 -0.65 -0.06 0.00 -1.47 0.00 0.00 33.84 32.14 1ctl n VAL 24 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1ctl s ILE 25 N 0.50 0.05 -0.28 1.34 -5.25 -1.26 -1.96 121.20 114.33 1ctl s ILE 25 Ca 0.00 -0.38 -0.15 0.00 -0.99 0.00 0.00 60.65 59.12 1ctl s ILE 25 Cb 0.00 -0.99 0.10 0.00 2.95 0.00 0.00 42.46 44.52 1ctl s ILE 25 CO 0.00 -0.21 0.73 -0.83 -1.79 0.00 0.00 174.94 172.84 1ctl s GLY 26 N -2.11 -0.55 0.00 6.27 0.00 -0.83 -4.92 107.32 105.18 1ctl s GLY 26 Ca -0.04 2.54 0.00 0.00 0.00 0.00 0.00 44.72 47.22 1ctl s GLY 26 CO -0.04 2.53 0.00 0.00 0.00 0.00 0.00 173.10 175.59 1ctl n ALA 27 N 4.37 0.00 -2.02 3.20 0.00 -1.26 0.57 120.51 125.37 1ctl n ALA 27 Ca -0.19 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.25 1ctl n ALA 27 Cb 0.58 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.02 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 0.80 3.92 0.00 0.00 -1.26 -5.06 105.19 103.59 1ctl n GLY 28 Ca 0.00 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 2.38 -0.02 1.61 -0.14 0.19 -5.12 119.74 118.65 1ctl s LYS 29 Ca 0.01 -0.16 -0.03 0.00 -1.36 0.00 0.00 55.97 54.43 1ctl s LYS 29 Cb 0.02 -2.18 0.00 0.00 -1.68 0.00 0.00 37.83 33.99 1ctl s LYS 29 CO -0.01 -1.12 0.06 -1.12 -0.76 0.00 0.00 175.35 172.41 1ctl s SER 30 N -4.47 -0.02 0.34 2.83 0.01 -1.26 -1.96 113.70 109.16 1ctl s SER 30 Ca 0.59 0.02 0.04 0.00 1.31 0.00 0.00 55.95 57.91 1ctl s SER 30 Cb -0.11 0.15 -0.03 0.00 0.21 0.00 0.00 66.02 66.24 1ctl s SER 30 CO 0.45 -0.10 0.18 0.26 0.41 0.00 0.00 173.24 174.45 1ctl s TRP 31 N -0.31 1.68 0.62 2.43 0.52 -0.83 -4.16 118.94 118.89 1ctl s TRP 31 Ca -0.04 -1.42 -0.07 0.00 0.02 0.00 0.00 56.10 54.59 1ctl s TRP 31 Cb -0.02 -0.90 0.01 0.00 -1.15 0.00 0.00 33.47 31.41 1ctl s TRP 31 CO 0.00 -0.55 0.95 -1.01 0.02 0.00 0.00 176.95 176.36 1ctl s HIS 32 N -3.47 3.28 0.56 -1.98 3.76 -1.26 -0.01 115.29 116.17 1ctl s HIS 32 Ca 0.34 0.76 0.30 0.00 -0.15 0.00 0.00 55.06 56.31 1ctl s HIS 32 Cb 0.04 -2.81 1.79 0.00 1.11 0.00 0.00 32.58 32.70 1ctl s HIS 32 CO 0.19 -0.90 2.23 -0.22 -0.85 0.00 0.00 174.74 175.19 1ctl h LYS 33 N -0.29 0.00 -0.07 1.40 3.64 -1.50 -2.50 116.57 117.25 1ctl h LYS 33 Ca -0.45 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 58.80 1ctl h LYS 33 Cb 1.25 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.86 1ctl h LYS 33 CO 0.61 0.02 -0.78 0.45 -2.27 0.00 0.00 179.45 177.49 1ctl n SER 34 N -3.77 1.61 -0.00 4.20 2.88 -1.26 -4.60 113.62 112.69 1ctl n SER 34 Ca -0.03 -3.00 0.00 0.00 -1.33 0.00 0.00 58.87 54.51 1ctl n SER 34 Cb 0.11 -0.42 -0.00 0.00 -0.75 0.00 0.00 64.21 63.15 1ctl n SER 34 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ctl s PHE 36 N -1.08 1.25 -0.37 0.00 0.08 -1.24 -4.88 117.98 111.73 1ctl s PHE 36 Ca 0.00 0.81 0.00 0.00 0.12 0.00 0.00 56.93 57.87 1ctl s PHE 36 Cb 0.00 -3.88 0.10 0.00 -0.57 0.00 0.00 43.02 38.68 1ctl s PHE 36 CO 0.02 -3.47 0.12 0.50 -0.10 0.00 0.00 175.22 172.29 1ctl s ARG 37 N 6.75 1.78 -0.07 0.44 3.52 -1.26 -1.97 118.95 128.15 1ctl s ARG 37 Ca 0.95 -1.82 -0.29 0.00 -0.13 0.00 0.00 55.73 54.44 1ctl s ARG 37 Cb -0.27 -3.39 -0.07 0.00 -1.56 0.00 0.00 34.95 29.67 1ctl s ARG 37 CO 0.32 -0.99 1.91 0.00 -0.81 0.00 0.00 175.30 175.73 1ctl n ALA 39 N 8.40 6.15 0.00 0.00 0.00 -1.23 -0.75 120.51 133.08 1ctl n ALA 39 Ca 0.21 -3.21 0.00 0.00 0.00 0.00 0.00 53.44 50.44 1ctl n ALA 39 Cb 0.43 -1.75 0.00 0.00 0.00 0.00 0.00 19.45 18.13 1ctl n ALA 39 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ctl n LYS 40 N -0.56 0.00 0.00 0.00 0.00 -1.26 -4.65 118.16 111.70 1ctl n LYS 40 Ca 0.55 0.00 0.11 0.00 0.00 0.00 0.00 58.31 58.97 1ctl n LYS 40 Cb 0.58 -0.30 -0.03 0.00 0.00 0.00 0.00 35.03 35.28 1ctl n LYS 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ctl n GLY 42 N 1.45 0.62 3.69 0.00 0.00 0.07 -5.05 105.19 105.98 1ctl n GLY 42 Ca 0.03 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.06 2.71 0.25 1.61 2.20 -0.51 -4.93 119.74 120.01 1ctl s LYS 43 Ca 0.00 -0.70 -0.30 0.00 -0.36 0.00 0.00 55.97 54.62 1ctl s LYS 43 Cb 0.00 -2.63 -0.09 0.00 -1.51 0.00 0.00 37.83 33.60 1ctl s LYS 43 CO 0.00 0.59 1.30 -1.12 -0.36 0.00 0.00 175.35 175.76 1ctl s SER 44 N -1.89 6.87 0.00 1.43 0.01 -1.26 -1.94 113.70 116.91 1ctl s SER 44 Ca 0.23 2.50 0.00 0.00 1.31 0.00 0.00 55.95 59.99 1ctl s SER 44 Cb -0.12 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.49 1ctl s SER 44 CO 0.14 -0.51 0.00 0.18 0.41 0.00 0.00 173.24 173.46 1ctl n LEU 45 N 1.94 0.00 0.00 2.44 4.77 -0.83 -4.93 117.00 120.38 1ctl n LEU 45 Ca 0.04 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.76 1ctl n LEU 45 Cb 0.42 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 1ctl n LEU 45 CO 0.58 -0.17 -0.13 -0.62 -1.33 0.00 0.00 177.39 175.72 1ctl n GLU 46 N -0.35 0.91 0.18 3.23 1.02 -1.26 -4.93 120.64 119.44 1ctl n GLU 46 Ca 0.00 -3.08 -0.11 0.00 -0.02 0.00 0.00 57.16 53.95 1ctl n GLU 46 Cb 0.00 0.69 -0.06 0.00 -0.02 0.00 0.00 31.44 32.05 1ctl n GLU 46 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1ctl h SER 47 N 0.90 -0.43 -1.12 1.62 0.02 -2.00 -3.38 113.55 109.17 1ctl h SER 47 Ca -0.34 -0.12 -0.58 0.00 -0.84 0.00 0.00 61.79 59.91 1ctl h SER 47 Cb 1.08 0.11 -0.42 0.00 0.14 0.00 0.00 62.40 63.32 1ctl h SER 47 CO 0.56 0.00 -0.68 1.07 -1.14 0.00 0.00 176.83 176.65 1ctl n THR 48 N -5.13 2.53 -3.15 -2.27 5.66 -1.26 -4.77 114.28 105.88 1ctl n THR 48 Ca -0.09 -4.48 -0.22 0.00 -3.05 0.00 0.00 64.05 56.21 1ctl n THR 48 Cb 0.27 -1.20 -0.05 0.00 -1.55 0.00 0.00 70.33 67.80 1ctl n THR 48 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1ctl n THR 49 N -0.62 -0.56 -4.05 1.09 5.66 -1.26 -5.02 114.28 109.53 1ctl n THR 49 Ca 0.43 -3.89 -0.10 0.00 -3.05 0.00 0.00 64.05 57.44 1ctl n THR 49 Cb 0.81 -1.42 -0.06 0.00 -1.55 0.00 0.00 70.33 68.11 1ctl n THR 49 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1ctl s LEU 50 N -1.35 0.53 -0.28 1.09 0.05 -1.26 -1.82 118.68 115.64 1ctl s LEU 50 Ca 0.35 -1.06 -0.05 0.00 0.05 0.00 0.00 54.13 53.42 1ctl s LEU 50 Cb 0.20 1.46 0.15 0.00 -2.05 0.00 0.00 46.19 45.95 1ctl s LEU 50 CO -0.11 -1.09 0.57 0.00 -0.55 0.00 0.00 176.35 175.17 1ctl s ALA 51 N -3.99 -1.92 0.43 1.48 0.00 -0.13 -4.10 121.76 113.53 1ctl s ALA 51 Ca 0.26 1.91 -0.01 0.00 0.00 0.00 0.00 51.96 54.12 1ctl s ALA 51 Cb 0.01 -1.86 -0.02 0.00 0.00 0.00 0.00 23.12 21.25 1ctl s ALA 51 CO 0.10 -1.09 0.67 0.16 0.00 0.00 0.00 175.76 175.60 1ctl s ASP 52 N 2.81 6.05 -0.29 0.00 1.47 -1.26 -1.95 116.67 123.51 1ctl s ASP 52 Ca 0.07 0.51 -0.21 0.00 1.18 0.00 0.00 52.55 54.09 1ctl s ASP 52 Cb -0.13 -1.86 0.14 0.00 -0.34 0.00 0.00 42.92 40.72 1ctl s ASP 52 CO -0.19 -0.57 1.03 -0.75 0.68 0.00 0.00 175.17 175.37 1ctl s LYS 53 N -4.55 0.42 3.10 2.11 2.47 0.34 -4.79 119.74 118.84 1ctl s LYS 53 Ca 0.46 0.60 0.00 0.00 -1.56 0.00 0.00 55.97 55.47 1ctl s LYS 53 Cb -0.10 0.16 0.00 0.00 -1.46 0.00 0.00 37.83 36.43 1ctl s LYS 53 CO 0.39 -0.07 0.00 -0.25 0.16 0.00 0.00 175.35 175.59 1ctl n ASP 54 N 2.86 0.00 -0.33 1.43 9.92 -1.26 -0.47 116.55 128.69 1ctl n ASP 54 Ca -0.15 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.11 1ctl n ASP 54 Cb 0.57 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.05 1ctl n ASP 54 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ctl n GLY 55 N 0.00 -0.17 2.87 0.44 0.00 -1.26 -4.36 105.19 102.72 1ctl n GLY 55 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1ctl n GLY 55 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ctl n GLU 56 N 0.00 0.73 -3.66 1.61 4.71 0.38 -5.02 120.64 119.39 1ctl n GLU 56 Ca 0.00 -2.95 -0.12 0.00 -0.01 0.00 0.00 57.16 54.08 1ctl n GLU 56 Cb 0.59 1.36 -0.08 0.00 -1.01 0.00 0.00 31.44 32.30 1ctl n GLU 56 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 1ctl s ILE 57 N -2.75 -0.00 0.44 -3.67 -4.36 -1.26 -0.50 121.20 109.10 1ctl s ILE 57 Ca 0.12 0.01 0.03 0.00 -0.26 0.00 0.00 60.65 60.55 1ctl s ILE 57 Cb 0.01 -0.87 -0.02 0.00 1.25 0.00 0.00 42.46 42.83 1ctl s ILE 57 CO 0.09 0.00 0.09 -0.72 0.24 0.00 0.00 174.94 174.64 1ctl s TYR 58 N 0.72 1.83 0.07 1.37 1.13 -0.82 -3.48 117.35 118.16 1ctl s TYR 58 Ca -0.03 -1.17 0.05 0.00 -1.41 0.00 0.00 57.07 54.51 1ctl s TYR 58 Cb -0.05 -1.32 -0.04 0.00 -1.10 0.00 0.00 41.96 39.46 1ctl s TYR 58 CO -0.05 -0.11 -0.05 0.00 -2.51 0.00 0.00 175.55 172.82 1ctl n LYS 60 N 0.93 0.24 0.00 0.00 4.81 -0.75 -1.87 118.16 121.51 1ctl n LYS 60 Ca -0.13 0.10 0.06 0.00 -0.87 0.00 0.00 58.31 57.47 1ctl n LYS 60 Cb 0.52 -1.50 0.33 0.00 0.02 0.00 0.00 35.03 34.40 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 0.47 -0.54 0.99 3.14 0.00 -1.10 -0.63 105.19 107.53 1ctl n GLY 61 Ca 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ctl n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ctl n TYR 63 N -2.86 0.44 -0.00 0.00 9.36 -0.94 0.57 117.16 123.73 1ctl n TYR 63 Ca 0.00 0.23 -0.00 0.00 3.32 0.00 0.00 57.90 61.45 1ctl n TYR 63 Cb 0.43 -0.86 -0.00 0.00 -0.63 0.00 0.00 39.34 38.28 1ctl n TYR 63 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1ctl h ALA 64 N 1.99 0.00 -0.24 2.98 0.00 -1.03 -3.23 119.26 119.73 1ctl h ALA 64 Ca 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1ctl h ALA 64 Cb 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ctl h ALA 64 CO 0.00 0.03 0.12 0.87 0.00 0.00 0.00 179.25 180.27 1ctl h LYS 65 N -0.07 0.33 -2.28 0.00 1.79 -0.59 -1.16 116.57 114.58 1ctl h LYS 65 Ca 0.00 -0.03 -0.62 0.00 -2.18 0.00 0.00 60.65 57.83 1ctl h LYS 65 Cb 0.03 -0.07 -0.40 0.00 -1.58 0.00 0.00 32.23 30.21 1ctl h LYS 65 CO 0.00 0.26 -0.46 -1.71 -1.08 0.00 0.00 179.45 176.46 1ctl n ASN 66 N -4.46 4.64 0.31 0.86 2.85 0.19 -4.86 115.26 114.80 1ctl n ASN 66 Ca 0.01 -3.63 0.18 0.00 -0.11 0.00 0.00 54.58 51.03 1ctl n ASN 66 Cb 0.11 -0.65 1.00 0.00 1.24 0.00 0.00 39.78 41.48 1ctl n ASN 66 CO 0.00 0.00 0.00 2.19 -2.11 0.00 0.00 177.26 177.34 1ctl h PHE 67 N 3.38 0.00 -1.56 1.20 -5.15 -1.22 -3.33 116.94 110.27 1ctl h PHE 67 Ca 0.18 0.00 -0.26 0.00 -0.20 0.00 0.00 57.97 57.69 1ctl h PHE 67 Cb 0.52 0.00 -0.26 0.00 0.22 0.00 0.00 35.95 36.43 1ctl h PHE 67 CO 0.86 0.02 -0.61 0.20 -2.00 0.00 0.00 178.31 176.78 1ctl s GLY 68 N -4.15 -0.47 0.52 6.09 0.00 -1.26 -5.00 107.32 103.04 1ctl s GLY 68 Ca -0.04 -0.67 -0.21 0.00 0.00 0.00 0.00 44.72 43.80 1ctl s GLY 68 CO 0.49 3.10 1.01 -1.05 0.00 0.00 0.00 173.10 176.65 1ctl n PRO 69 N 3.99 1.19 0.00 2.90 -0.02 -1.25 -4.81 135.00 136.99 1ctl n PRO 69 Ca 0.14 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1ctl n PRO 69 Cb 0.50 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1ctl n PRO 69 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1ctl n LYS 70 N -0.46 0.00 0.00 -0.52 3.00 -1.26 -5.15 118.16 113.77 1ctl n LYS 70 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.42 1ctl n LYS 70 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.47 1ctl n LYS 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ctl n GLY 71 N 0.00 0.96 3.53 3.14 0.00 -1.26 -5.16 105.19 106.40 1ctl n GLY 71 Ca 0.00 -0.42 -0.01 0.00 0.00 0.00 0.00 46.02 45.59 1ctl n GLY 71 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ctl s PHE 72 N -2.00 -0.72 0.00 1.61 5.36 -1.26 -5.05 117.98 115.92 1ctl s PHE 72 Ca 0.00 1.33 0.00 0.00 -0.96 0.00 0.00 56.93 57.30 1ctl s PHE 72 Cb 0.00 0.43 0.00 0.00 -0.34 0.00 0.00 43.02 43.11 1ctl s PHE 72 CO 0.00 -0.36 0.00 0.41 -1.46 0.00 0.00 175.22 173.81 1ctl n GLY 73 N 4.49 0.00 5.42 13.12 0.00 -1.26 -5.05 105.19 121.91 1ctl n GLY 73 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1ctl n GLY 73 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ctl n PHE 74 N 0.00 0.00 -1.78 1.61 3.01 -1.26 -4.77 117.46 114.27 1ctl n PHE 74 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.14 1ctl n PHE 74 Cb 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.50 1ctl n PHE 74 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1ctl s GLY 75 N 0.00 1.81 -0.08 1.37 0.00 -1.26 -5.04 107.32 104.13 1ctl s GLY 75 Ca 0.00 0.16 -0.03 0.00 0.00 0.00 0.00 44.72 44.85 1ctl s GLY 75 CO 0.00 0.46 -0.06 -1.61 0.00 0.00 0.00 173.10 171.89 1ctl h GLN 76 N -0.27 0.00 0.00 2.90 4.15 -2.03 -3.49 115.11 116.37 1ctl h GLN 76 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.97 1ctl h GLN 76 Cb 1.21 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.90 1ctl h GLN 76 CO 0.58 0.00 0.00 0.41 -1.93 0.00 0.00 178.83 177.89 1ctl n GLY 77 N 1.75 3.79 3.25 2.39 0.00 -1.26 -5.03 105.19 110.09 1ctl n GLY 77 Ca -0.03 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.03 3.73 0.00 4.61 0.00 -1.26 -4.90 121.76 123.91 1ctl s ALA 78 Ca 0.00 -2.95 0.00 0.00 0.00 0.00 0.00 51.96 49.01 1ctl s ALA 78 Cb 0.00 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.98 1ctl s ALA 78 CO 0.00 -2.10 0.00 0.41 0.00 0.00 0.00 175.76 174.07 1ctl n GLY 79 N 4.39 0.03 1.71 0.00 0.00 -1.26 -5.04 105.19 105.03 1ctl n GLY 79 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 1ctl n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ctl n ALA 80 N -1.19 1.72 0.03 4.61 0.00 -1.26 -4.93 120.51 119.49 1ctl n ALA 80 Ca 0.00 -0.61 -0.19 0.00 0.00 0.00 0.00 53.44 52.64 1ctl n ALA 80 Cb 0.00 -0.55 -0.12 0.00 0.00 0.00 0.00 19.45 18.78 1ctl n ALA 80 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1ctl h LEU 81 N 0.41 0.63 -2.55 0.00 8.10 -1.96 -3.48 115.31 116.46 1ctl h LEU 81 Ca -0.35 -0.81 -0.25 0.00 0.11 0.00 0.00 57.88 56.58 1ctl h LEU 81 Cb 1.18 -0.20 0.16 0.00 -0.44 0.00 0.00 40.66 41.37 1ctl h LEU 81 CO -0.16 1.37 -0.79 0.00 -4.11 0.00 0.00 178.44 174.75 1ctl n ILE 82 N -4.08 -8.85 0.00 0.15 0.13 -1.26 -1.00 119.36 104.46 1ctl n ILE 82 Ca -0.12 -1.19 0.00 0.00 -1.10 0.00 0.00 62.75 60.34 1ctl n ILE 82 Cb 0.79 -6.28 0.00 0.00 -0.84 0.00 0.00 39.64 33.31 1ctl n ILE 82 CO 0.00 0.00 0.00 1.41 2.80 0.00 0.00 176.55 180.76 1ctl n HIS 83 N -3.21 0.00 0.09 9.51 8.25 -1.26 -3.47 115.22 125.13 1ctl n HIS 83 Ca -0.07 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.36 1ctl n HIS 83 Cb 0.60 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.65 1ctl n HIS 83 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1ctl h SER 84 N 0.00 0.00 0.00 0.41 0.02 -2.01 -3.55 113.55 108.41 1ctl h SER 84 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ctl h SER 84 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1ctl h SER 84 CO 0.00 0.80 0.00 1.67 -1.14 0.00 0.00 176.83 178.16